G4VNY6_SCHMA Loading...

Cell division cycle 20 (Fizzy)-related

AlphaFold DB , UniProt , Accession G4VNY6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 651 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	39	Very low	37.8	Very low	237 Å²	237	174.6 Å²	174.6	100%	1.167	87%	0.871	S	S	*	*				0	154.8	0	-70.8	-177.4	-139.5	0	0	107.9
2	E	39	Very low	38	Very low	199 Å²	199	168.3 Å²	168.3	93%	0.93	86%	0.856	S	S	*	*			trans	64.5	142.8	172	-63.1	-174.8	137	0	0	118.6
3	Q	33.5	Very low	38	Very low	199 Å²	199	164.9 Å²	164.9	93%	0.93	85%	0.853	S	S	*	*			trans	-126.5	157.9	-172.4	-68.2	175.7	-17.4	0	0	109.1
4	G	37.8	Very low	38.1	Very low	64 Å²	64	168.8 Å²	168.8	66%	0.66	85%	0.853	S	S	*	*			trans	102.2	120.1	141.5	0	0	0	0	0	116.1
5	Y	47.1	Very low	38.1	Very low	244 Å²	244	171.7 Å²	171.7	96%	0.957	86%	0.858	S	S	*	*			trans	-151.3	112.4	139.7	-99.6	-72.4	0	0	0	108.4
6	E	35.5	Very low	38.4	Very low	150 Å²	150	167 Å²	167	70%	0.701	85%	0.846	S	S	*	*			trans	-126.2	144.9	172.1	-150.2	-151.8	-174.4	0	0	108.4
7	K	37.6	Very low	38.3	Very low	160 Å²	160	164.5 Å²	164.5	70%	0.696	84%	0.844	S	S	*	*			trans	62.9	100.8	166	-64.4	176.1	178.4	110.3	0	119.3
8	R	38.2	Very low	38.5	Very low	245 Å²	245	164 Å²	164	93%	0.925	84%	0.842	S	S	*	*			trans	179.8	133.3	147.4	-104.1	168.7	-148.6	-170.9	7.1	105.7
9	L	41.4	Very low	38.5	Very low	165 Å²	165	165.3 Å²	165.3	86%	0.864	84%	0.84	S	S	*	*			cis	-146.1	153.9	27.9	-79.2	138.3	0	0	0	112.7
10	L	35.6	Very low	38.3	Very low	178 Å²	178	163.9 Å²	163.9	93%	0.932	84%	0.84	S	S	*	*			trans	-84.7	147.1	154.3	-81.2	155.4	0	0	0	109.3
11	G	31.7	Very low	38.5	Very low	80 Å²	80	162.2 Å²	162.2	83%	0.825	84%	0.838	S	S	*	*			trans	114.2	102.8	160.5	0	0	0	0	0	116.1
12	S	39.8	Very low	38.2	Very low	98 Å²	98	155.6 Å²	155.6	69%	0.685	82%	0.815	S	S	*	*			trans	-144.9	120.1	153.2	-179.5	0	0	0	0	108.8
13	P	37.3	Very low	38.2	Very low	125 Å²	125	152.2 Å²	152.2	81%	0.812	81%	0.81	S	S	*	*			trans	-100.8	95.7	-179.3	35.5	-28.7	0	0	0	111.5
14	Y	40.2	Very low	38.4	Very low	219 Å²	219	151.1 Å²	151.1	86%	0.859	81%	0.807	S	S	*	*			trans	-111.6	97.5	162.6	-89.7	-86.5	0	0	0	110.3
15	K	37.8	Very low	38.5	Very low	212 Å²	212	157.8 Å²	157.8	92%	0.922	82%	0.818	S	S	*	*			trans	-80.8	108.5	166	-80.1	-177.8	172.9	-180	0	109.1
16	S	42.8	Very low	37.9	Very low	97 Å²	97	151.5 Å²	151.5	68%	0.678	81%	0.805	S	S	*	*			trans	-94	143.4	156.8	54.4	0	0	0	0	109.6	I18	S16-I18 PolarHBondContact O-N 3.34Å
17	P	36.7	Very low	38	Very low	125 Å²	125	148.4 Å²	148.4	81%	0.812	80%	0.798	S	S	*	*			trans	-80.9	100.7	-176.7	31.1	-33.2	0	0	0	110.9	K19	P17-K19 PolarHBondContact O-N 3.47Å; P17-K19 VanDerWaalsContact O-N 3.12Å
18	I	41.5	Very low	37.9	Very low	155 Å²	155	145.1 Å²	145.1	80%	0.795	79%	0.791	S	S	*	*			trans	-65.7	110.8	168.3	-63.5	171	0	0	0	108.1	S16 T20	S16-I18 PolarHBondContact O-N 3.34Å; I18-T20 PolarHBondContact O-N 3.15Å
19	K	38.9	Very low	38	Very low	188 Å²	188	143.1 Å²	143.1	82%	0.817	79%	0.789	S	S	*	*			trans	-68.8	123.4	165.2	-74.8	-178.5	177.3	177.5	0	108.4	P17 V21	P17-K19 PolarHBondContact O-N 3.47Å; P17-K19 VanDerWaalsContact O-N 3.12Å; K19-V21 PolarHBondContact O-N 3.48Å
20	T	35.3	Very low	38	Very low	137 Å²	137	142.6 Å²	142.6	84%	0.84	78%	0.783	S	S	*	*			trans	-68.4	96	171.9	48.1	0	0	0	0	110	I18	I18-T20 PolarHBondContact O-N 3.15Å
21	V	40.9	Very low	38.1	Very low	130 Å²	130	139 Å²	139	79%	0.788	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-79.9	120.9	161.6	-177.3	0	0	0	0	107	K19	K19-V21 PolarHBondContact O-N 3.48Å
22	S	34.6	Very low	38.5	Very low	97 Å²	97	143 Å²	143	68%	0.678	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-56.8	144.5	178.6	-55.5	0	0	0	0	111	M24	S22-M24 PolarHBondContact O-N 3.16Å
23	P	38.3	Very low	38.4	Very low	129 Å²	129	145 Å²	145	84%	0.838	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-61.5	116.5	178.8	25.6	-33.5	0	0	0	109.8
24	M	38.1	Very low	38.5	Very low	176 Å²	176	142.4 Å²	142.4	87%	0.867	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61.5	144.6	169.7	-70	-171.4	75.8	0	0	109.2	S22 T26	S22-M24 PolarHBondContact O-N 3.16Å; M24-T26 PolarHBondContact O-N 3.4Å
25	K	39.6	Very low	38.3	Very low	204 Å²	204	141.4 Å²	141.4	89%	0.887	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-48	126.9	-173.5	-75.6	176.4	172.9	176.7	0	111.4
26	T	34.6	Very low	38.1	Very low	112 Å²	112	139.3 Å²	139.3	69%	0.687	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-53.2	129.5	163.8	32.2	0	0	0	0	109.7	M24 T28	M24-T26 PolarHBondContact O-N 3.4Å; T26-T28 PolarHBondContact O-N 3.29Å
27	P	36.4	Very low	37.8	Very low	84 Å²	84	141.7 Å²	141.7	55%	0.545	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-62.5	119.8	171.2	-20.3	32.4	0	0	0	109.2
28	T	36.3	Very low	37.8	Very low	92 Å²	92	140 Å²	140	56%	0.564	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-66.9	156.6	173.3	47.8	0	0	0	0	110.6	T26 E30	T26-T28 PolarHBondContact O-N 3.29Å; T28-E30 PolarHBondContact O-N 2.99Å
29	K	40.9	Very low	37.3	Very low	203 Å²	203	141.2 Å²	141.2	88%	0.883	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	1.8	-167.7	-164.6	177.3	173.6	-172.5	0	116.2
30	E	40.1	Very low	37.2	Very low	154 Å²	154	143 Å²	143	72%	0.72	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-23	-164.4	-66.8	168.8	168.9	0	0	113.6	T28	T28-E30 PolarHBondContact O-N 2.99Å
31	N	39.3	Very low	37.3	Very low	103 Å²	103	140.6 Å²	140.6	55%	0.551	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-6.6	-169.9	-78.9	-27.7	0	0	0	116.3	R35	N31-R35 PolarHBondContact O-NH2 3.21Å
32	Y	38.5	Very low	37	Very low	164 Å²	164	142.4 Å²	142.4	64%	0.643	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	52.7	176.6	-87.7	-84	0	0	0	112.3
33	M	37.5	Very low	37.1	Very low	138 Å²	138	141.6 Å²	141.6	68%	0.68	72%	0.716	S	S	*	*	S	Bend	trans	-65.2	150.8	151.1	-63.2	-117	97.2	0	0	109.2	R35	M33-R35 PolarHBondContact O-N 3.42Å
34	D	40.4	Very low	36.7	Very low	72 Å²	72	146.2 Å²	146.2	39%	0.385	72%	0.717	S	S	.	*			trans	-59	90.5	-179.3	-62.4	-49.3	0	0	0	111	Y36 T535	D34-Y36 PolarHBondContact O-N 3.24Å; D34-T535 PolarHBondContact OD1-OG1 3.4Å; D34-T535 WeakPolarHBondContact OD2-CB 3.43Å
35	R	36.8	Very low	36.6	Very low	198 Å²	198	148.9 Å²	148.9	75%	0.747	72%	0.718	S	S	*	*	S	Bend	trans	-80.7	62	-172.8	-88.2	-167.4	-82.7	174.3	-8.2	113.2	N31 M33	N31-R35 PolarHBondContact O-NH2 3.21Å; M33-R35 PolarHBondContact O-N 3.42Å
36	Y	32.6	Very low	36.3	Very low	168 Å²	168	147.8 Å²	147.8	66%	0.659	71%	0.713	S	S	*	*			trans	-149.5	86.9	138.3	-152.6	-94.4	0	0	0	111.1	D34 P38	D34-Y36 PolarHBondContact O-N 3.24Å; Y36-P38 WeakPolarHBondContact O-CD 3.46Å
37	I	36.1	Very low	36.1	Very low	147 Å²	147	149.4 Å²	149.4	75%	0.754	72%	0.723	S	S	*	*			trans	-89.7	115.9	166.9	-59.9	174.2	0	0	0	107.3	L39	I37-L39 PolarHBondContact O-N 3.34Å
38	P	36.1	Very low	35.9	Very low	89 Å²	89	150.4 Å²	150.4	58%	0.578	73%	0.732	S	S	*	*			trans	-69.8	127.3	172.1	27.2	-30.2	0	0	0	109.5	Y36 R40	Y36-P38 WeakPolarHBondContact O-CD 3.46Å; P38-R40 PolarHBondContact O-N 2.71Å
39	L	31.6	Very low	35.7	Very low	180 Å²	180	152.3 Å²	152.3	94%	0.942	74%	0.743	S	S	*	*			trans	-57.9	98.3	176.1	-77.9	158.6	0	0	0	111	I37	I37-L39 PolarHBondContact O-N 3.34Å
40	R	37	Very low	35.4	Very low	227 Å²	227	147.9 Å²	147.9	86%	0.857	74%	0.738	S	S	*	*			trans	-92.2	102	155	-79.1	-171.5	175.5	174.9	-0	108.4	P38	P38-R40 PolarHBondContact O-N 2.71Å
41	A	37	Very low	34.8	Very low	85 Å²	85	149.7 Å²	149.7	70%	0.702	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	149.3	158.9	0	0	0	0	0	109.8
42	N	34.4	Very low	34.4	Very low	169 Å²	169	154.1 Å²	154.1	90%	0.904	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.5	21.1	172.9	-50.4	-17.1	0	0	0	119.1
43	A	37.5	Very low	33.9	Very low	79 Å²	79	154 Å²	154	65%	0.653	77%	0.767	S	S	*	*			trans	-99.1	95.5	164.3	0	0	0	0	0	111.8
44	R	29.3	Very low	33.6	Very low	226 Å²	226	154.2 Å²	154.2	85%	0.853	78%	0.776	S	S	*	*			trans	-97.8	91.8	-174.7	-167.2	-175.6	-164.9	-178.5	7.1	111.8
45	W	36.3	Very low	33	Very low	232 Å²	232	158.3 Å²	158.3	88%	0.879	80%	0.798	S	S	*	*			trans	-105.8	121.4	171	-66.3	98.9	0	0	0	110.7
46	K	33.1	Very low	32.9	Very low	182 Å²	182	154.5 Å²	154.5	79%	0.791	80%	0.802	S	S	*	*			trans	-83.9	125.9	173.9	-67.6	-180	176.7	-178.6	0	109.3
47	T	31.5	Very low	32.7	Very low	146 Å²	146	154 Å²	154	90%	0.896	81%	0.81	S	S	*	*			trans	-114.2	123.1	162.9	36.3	0	0	0	0	109.9
48	S	31.3	Very low	32.9	Very low	105 Å²	105	152.6 Å²	152.6	73%	0.734	81%	0.811	S	S	*	*			trans	-148.4	136.4	176.6	58.7	0	0	0	0	105.4
49	T	32.4	Very low	32.7	Very low	131 Å²	131	154.4 Å²	154.4	80%	0.804	82%	0.821	S	S	*	*			cis	-143.5	171	21	40.7	0	0	0	0	112.8
50	S	34.3	Very low	32.8	Very low	110 Å²	110	156.5 Å²	156.5	77%	0.769	82%	0.816	S	S	*	*			trans	-47.4	155	164.6	39.8	0	0	0	0	115.5
51	F	27.4	Very low	32.5	Very low	192 Å²	192	156.5 Å²	156.5	84%	0.842	82%	0.816	S	S	*	*			trans	-83.7	130.4	169.6	-172.2	-88.4	0	0	0	109.6
52	E	31.4	Very low	32.3	Very low	197 Å²	197	159.1 Å²	159.1	92%	0.921	82%	0.817	S	S	*	*			trans	-147.1	153.6	165.6	-128.8	175.1	-150.5	0	0	111.3
53	Q	27.9	Very low	32.3	Very low	160 Å²	160	158.8 Å²	158.8	75%	0.748	81%	0.808	S	S	*	*			trans	-130.7	122.3	-153.5	177	-174.3	17.6	0	0	111.3
54	T	31.8	Very low	32.1	Very low	143 Å²	143	162.7 Å²	162.7	88%	0.877	81%	0.813	S	S	*	*			trans	-140.1	140.1	168.4	52.5	0	0	0	0	113.1
55	N	27.5	Very low	32.2	Very low	158 Å²	158	157 Å²	157	85%	0.845	81%	0.808	S	S	*	*			trans	-82.9	149	-177.5	-78.5	-50.2	0	0	0	113.8
56	S	35.5	Very low	32.1	Very low	119 Å²	119	152.1 Å²	152.1	83%	0.832	81%	0.809	S	S	*	*				-174.4	133.3	128.6	49.3	0	0	0	0	113.5
57	N	27.8	Very low	32	Very low	157 Å²	157	155.6 Å²	155.6	84%	0.84	82%	0.817	S	S	*	*			trans	-90.8	158.8	169.3	-84.7	-43.6	0	0	0	110.4
58	P	39.4	Very low	32.2	Very low	117 Å²	117	152.3 Å²	152.3	76%	0.76	81%	0.812	S	S	*	*				-154.4	129.3	93.7	35.5	-14.3	0	0	0	119
59	T	32.9	Very low	32.5	Very low	128 Å²	128	154.5 Å²	154.5	79%	0.785	82%	0.816	S	S	*	*				36.6	146.3	126	7.4	0	0	0	0	126.9
60	R	33.8	Very low	32.8	Very low	223 Å²	223	153.1 Å²	153.1	84%	0.842	81%	0.807	S	S	*	*			trans	89.7	115.9	159.5	-67.1	-176.1	176.6	-159.3	0.4	116.7
61	R	30.4	Very low	32.9	Very low	228 Å²	228	155.5 Å²	155.5	86%	0.86	81%	0.811	S	S	*	*				76.6	118.4	62.1	-74.8	-167.6	-174.5	-169.4	3.6	114
62	L	33.2	Very low	33.4	Very low	139 Å²	139	150.2 Å²	150.2	73%	0.728	81%	0.811	S	S	*	*				168.5	128.1	107.4	-102.1	111.9	0	0	0	114.8
63	F	34	Very low	33.8	Very low	163 Å²	163	148.9 Å²	148.9	72%	0.715	81%	0.809	S	S	*	*			trans	58.5	115.5	138	-75.1	-108.6	0	0	0	126.2
64	Q	32.8	Very low	34.4	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	81%	0.806	S	S	*	*				48.6	113.1	115	-76.8	-179.3	-15.6	0	0	124.4
65	S	30.4	Very low	34.8	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	80%	0.8	S	S	*	*				45.6	128.8	125.6	67.5	0	0	0	0	124.1
66	S	35.3	Very low	35.4	Very low	128 Å²	128	144.3 Å²	144.3	90%	0.895	79%	0.792	S	S	*	*			trans	-163.5	169.3	130.1	50.4	0	0	0	0	112.2
67	R	30.9	Very low	35.6	Very low	256 Å²	256	145 Å²	145	97%	0.966	79%	0.791	S	S	*	*			trans	-107	157.1	-173.7	-63.8	169.1	168.2	168.9	-6.8	111.4
68	G	36.3	Very low	36	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	79%	0.786	S	S	*	*			trans	168.2	89.1	161.6	0	0	0	0	0	119
69	N	36.2	Very low	36.5	Very low	151 Å²	151	142.6 Å²	142.6	81%	0.807	79%	0.787	S	S	*	*			trans	26.4	140.2	141.4	-91.8	29.9	0	0	0	126.2
70	T	38.6	Very low	36.8	Very low	102 Å²	102	143 Å²	143	63%	0.626	78%	0.784	S	S	*	*			trans	80.1	115.9	133.2	53.5	0	0	0	0	124
71	D	38	Very low	37.2	Very low	159 Å²	159	140.3 Å²	140.3	85%	0.85	78%	0.781	S	S	*	*				67.3	134.3	125.5	-47.9	-17.9	0	0	0	122.8
72	G	37.2	Very low	37.5	Very low	81 Å²	81	137.3 Å²	137.3	84%	0.835	78%	0.782	S	S	*	*			trans	159.1	100.1	165.6	0	0	0	0	0	117.1
73	L	40.1	Very low	38	Very low	169 Å²	169	134 Å²	134	89%	0.885	78%	0.782	S	S	*	*			trans	-69.9	158	-173	-70	154	0	0	0	119
74	S	40.3	Very low	38.3	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	79%	0.786	S	S	*	*			trans	91.1	124.4	135.4	66.1	0	0	0	0	124.7
75	N	40	Very low	38.7	Very low	140 Å²	140	135.2 Å²	135.2	75%	0.749	79%	0.79	S	S	*	*			trans	58.7	149.9	130.2	-61.5	41.6	0	0	0	121
76	D	40.3	Very low	39.2	Very low	129 Å²	129	134.2 Å²	134.2	69%	0.69	78%	0.782	S	S	*	*			cis	-167.4	163	-2.4	-119.4	-38.2	0	0	0	113
77	V	39.9	Very low	39.3	Very low	132 Å²	132	137.3 Å²	137.3	80%	0.8	78%	0.782	S	S	*	*			trans	74.6	144	149.3	173.8	0	0	0	0	123.6
78	S	36.2	Very low	39.5	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	77%	0.774	S	S	*	*			trans	-115.6	-152.2	-177.4	-32.3	0	0	0	0	112.5
79	P	49	Very low	39.5	Very low	119 Å²	119	132.9 Å²	132.9	77%	0.773	78%	0.777	S	S	*	*			cis	-138.9	-175.9	-36.3	33.2	-11.9	0	0	0	116.3
80	N	39.3	Very low	39.4	Very low	137 Å²	137	131.9 Å²	131.9	73%	0.733	78%	0.776	S	S	*	*			trans	110.2	146.5	130.2	-143.9	6	0	0	0	124.3
81	Q	42.8	Very low	39.1	Very low	166 Å²	166	131.2 Å²	131.2	78%	0.776	78%	0.775	S	S	*	*			trans	101.9	96.4	153.6	-54.1	-163.1	15	0	0	125.8
82	N	36.7	Very low	38.9	Very low	164 Å²	164	132.5 Å²	132.5	88%	0.877	77%	0.774	S	S	*	*				45.5	133	124.8	-65.9	-6	0	0	0	129
83	G	42.9	Very low	38.5	Very low	71 Å²	71	134.9 Å²	134.9	73%	0.732	77%	0.772	S	S	*	*			trans	145.6	161.3	150.7	0	0	0	0	0	115.4
84	H	41.8	Very low	38.1	Very low	173 Å²	173	130.4 Å²	130.4	80%	0.801	77%	0.767	S	S	*	*			cis	-170.9	147.2	-28.1	-124.3	-65.4	0	0	0	112.4
85	Q	41.2	Very low	37.5	Very low	175 Å²	175	135 Å²	135	82%	0.818	78%	0.778	S	S	*	*			trans	67.4	152.4	164.8	-58.5	174.5	28.3	0	0	119
86	S	39.4	Very low	37.1	Very low	86 Å²	86	133.7 Å²	133.7	60%	0.601	78%	0.78	S	S	*	*			cis	-172.4	158.6	-22.2	55.5	0	0	0	0	113.5
87	H	38.4	Very low	36.6	Very low	194 Å²	194	135.1 Å²	135.1	90%	0.898	79%	0.787	S	S	*	*			trans	75	132.1	165.9	-60.4	-75.8	0	0	0	122.2
88	G	35.4	Very low	36.2	Very low	77 Å²	77	141 Å²	141	79%	0.794	80%	0.795	S	S	*	*			trans	159.2	25.3	162.1	0	0	0	0	0	124.5
89	L	35.3	Very low	35.8	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	79%	0.79	S	S	*	*			trans	53.9	137.3	163.3	-107.9	95.1	0	0	0	123.1
90	V	35.1	Very low	34.9	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	79%	0.794	S	S	*	*			trans	50.8	133.6	165.3	-79.6	0	0	0	0	121
91	S	32.3	Very low	34.5	Very low	88 Å²	88	139.1 Å²	139.1	62%	0.615	80%	0.8	S	S	*	*			cis	-171.2	130.2	-25.5	46.2	0	0	0	0	110.5
92	F	32.7	Very low	33.9	Very low	186 Å²	186	134.4 Å²	134.4	82%	0.816	80%	0.796	S	S	*	*			trans	46.9	97.2	162.3	-57.1	-70.6	0	0	0	118.3
93	T	30.4	Very low	33.7	Very low	131 Å²	131	132.7 Å²	132.7	80%	0.804	79%	0.791	S	S	*	*				64.5	138	72.6	71.1	0	0	0	0	115.5
94	G	32	Very low	33	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	79%	0.793	S	S	*	*			cis	-148.7	135.9	15.7	0	0	0	0	0	115.5
95	E	26.6	Very low	32.5	Very low	194 Å²	194	133.2 Å²	133.2	91%	0.907	79%	0.791	S	S	*	*			trans	-89.8	144.2	147.6	-61.1	179.2	133.8	0	0	108.4
96	S	31.9	Very low	32	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	79%	0.791	S	S	*	*			trans	-149.3	96.4	159.9	54.7	0	0	0	0	111.8	W98	S96-W98 PolarHBondContact O-N 3.02Å
97	N	30.3	Very low	31.6	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	80%	0.803	S	S	*	*			trans	-61.7	117.6	168.4	-87	-40.6	0	0	0	112
98	W	29.8	Very low	31.3	Very low	256 Å²	256	131.1 Å²	131.1	97%	0.97	80%	0.799	S	S	*	*			trans	-145.9	127	141.1	-65.3	77.6	0	0	0	104.6	S96	S96-W98 PolarHBondContact O-N 3.02Å
99	G	29.3	Very low	30.9	Very low	62 Å²	62	136 Å²	136	64%	0.639	80%	0.801	S	S	*	*			cis	133.3	135	19.3	0	0	0	0	0	107.5
100	T	30.2	Very low	30.8	Very low	138 Å²	138	133.9 Å²	133.9	85%	0.847	80%	0.797	S	S	*	*			trans	75.1	117.2	171.5	64.3	0	0	0	0	120.8
101	S	30.1	Very low	30.6	Very low	123 Å²	123	131.4 Å²	131.4	86%	0.86	79%	0.79	S	S	*	*			trans	58.8	126.7	138.7	60.5	0	0	0	0	122.4
102	G	30.1	Very low	30.6	Very low	67 Å²	67	132.7 Å²	132.7	69%	0.691	80%	0.796	S	S	*	*			trans	142.3	75.1	169.8	0	0	0	0	0	111.8
103	V	32.3	Very low	30.5	Very low	127 Å²	127	131.9 Å²	131.9	77%	0.77	80%	0.795	S	S	*	*				62.2	110.3	93.3	-178.1	0	0	0	0	113.4
104	N	28.2	Very low	30.6	Very low	144 Å²	144	130.8 Å²	130.8	77%	0.77	79%	0.788	S	S	*	*			trans	55.7	117.8	157.6	-56.4	-14.2	0	0	0	119.4
105	S	31	Very low	30.5	Very low	111 Å²	111	135 Å²	135	78%	0.776	79%	0.788	S	S	*	*				-179.5	119.2	95.6	-75.4	0	0	0	0	111.5	V107	S105-V107 PolarHBondContact O-N 3.45Å
106	A	31	Very low	30.8	Very low	98 Å²	98	127.1 Å²	127.1	81%	0.81	76%	0.755	S	S	*	*			trans	-71.7	116.4	161.1	0	0	0	0	0	108.3	Q108	A106-Q108 PolarHBondContact O-N 2.94Å
107	V	32.3	Very low	31.3	Very low	142 Å²	142	131.6 Å²	131.6	86%	0.861	76%	0.755	S	S	*	*			trans	-74.8	85.9	171.3	-179.3	0	0	0	0	107.9	S105	S105-V107 PolarHBondContact O-N 3.45Å
108	Q	30.2	Very low	31.8	Very low	171 Å²	171	127.3 Å²	127.3	80%	0.799	75%	0.748	S	S	*	*			trans	-83.6	117.2	172.7	-165.4	166.5	13.4	0	0	107.7	A106 P110	A106-Q108 PolarHBondContact O-N 2.94Å; Q108-P110 WeakPolarHBondContact O-CD 3.38Å
109	E	28.6	Very low	32.6	Very low	180 Å²	180	119.3 Å²	119.3	84%	0.841	73%	0.73	S	S	*	*			trans	-56.8	127.1	177.2	-78.6	-158.2	143.6	0	0	110.5	A111	E109-A111 PolarHBondContact O-N 3.38Å; E109-A111 VanDerWaalsContact O-N 3.16Å
110	P	33.5	Very low	34.4	Very low	119 Å²	119	121.2 Å²	121.2	77%	0.773	73%	0.726	S	S	*	*			trans	-76.3	106.4	171.8	30.3	-31	0	0	0	108.8	Q108	Q108-P110 WeakPolarHBondContact O-CD 3.38Å
111	A	29.6	Very low	36.4	Very low	77 Å²	77	117.2 Å²	117.2	64%	0.636	70%	0.699	S	S	*	*			trans	-50	141	165.6	0	0	0	0	0	109.9	E109 Q113	E109-A111 PolarHBondContact O-N 3.38Å; E109-A111 VanDerWaalsContact O-N 3.16Å; A111-Q113 PolarHBondContact O-N 2.91Å
112	P	33.5	Very low	38.6	Very low	114 Å²	114	117.1 Å²	117.1	74%	0.74	69%	0.688	S	S	*	*			trans	-67.5	98.3	-169.9	26.4	-35.1	0	0	0	111.2	T114	P112-T114 PolarHBondContact O-N 3.47Å; P112-T114 PolarHBondContact O-OG1 2.94Å
113	Q	29	Very low	40.9	Very low	170 Å²	170	117.7 Å²	117.7	79%	0.794	68%	0.682	S	S	*	*			trans	-65.3	74.2	177.2	-67.7	-173.5	-5.7	0	0	111.4	A111 E115	A111-Q113 PolarHBondContact O-N 2.91Å; Q113-E115 VanDerWaalsContact C-N 3.33Å
114	T	32	Very low	43.1	Very low	107 Å²	107	113.4 Å²	113.4	66%	0.656	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	24.5	-174.2	-34.8	0	0	0	0	111.8	P112	P112-T114 PolarHBondContact O-N 3.47Å; P112-T114 PolarHBondContact O-OG1 2.94Å
115	E	31.3	Very low	45.8	Very low	165 Å²	165	108.1 Å²	108.1	77%	0.771	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	41.8	176.6	-114.6	156	-134.2	0	0	112.4	Q113 R205	Q113-E115 VanDerWaalsContact C-N 3.33Å; E115-R205 IonicContact OE1-CZ 3.9Å; E115-R205 IonicContact OE1-NH1 3.26Å; E115-R205 PolarHBondContact OE1-NH1 2.74Å; E115-R205 VanDerWaalsContact OE1-NH1 3.1Å; E115-R205 IonicContact OE1-NH2 3.7Å; E115-R205 PolarHBondContact OE1-NH2 3.04Å
116	A	33.1	Very low	48.1	Very low	27 Å²	27	106.5 Å²	106.5	22%	0.223	62%	0.616	C	S	.	*			trans	-117	-6.7	-177.6	0	0	0	0	0	116.4	G118 C119	A116-G118 PolarHBondContact O-N 3.37Å; A116-C119 WeakPolarHBondContact O-CB 3.22Å; A116-C119 PolarHBondContact O-N 3.35Å
117	R	42.2	Very low	50.5	Low	208 Å²	208	103.9 Å²	103.9	79%	0.785	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-6.8	-172.2	-72.6	-170.9	177.9	171.7	3.6	116.5
118	G	39.8	Very low	52.8	Low	68 Å²	68	98.1 Å²	98.1	70%	0.701	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-24.3	168.6	0	0	0	0	0	113.8	A116	A116-G118 PolarHBondContact O-N 3.37Å
119	C	48.1	Very low	55.2	Low	87 Å²	87	93.2 Å²	93.2	59%	0.588	54%	0.536	S	S	*	.	H	α-helix	trans	-84.6	-33.2	-175.8	-66.9	0	0	0	0	112.9	A116 L121 L122 S123	A116-C119 WeakPolarHBondContact O-CB 3.22Å; A116-C119 PolarHBondContact O-N 3.35Å; C119-L121 VanDerWaalsContact C-N 3.3Å; C119-L121 PolarHBondContact O-N 2.92Å; C119-L122 PolarHBondContact O-N 3.02Å; C119-S123 VanDerWaalsContact O-CB 3.26Å; C119-S123 WeakPolarHBondContact O-CB 3.37Å; C119-S123 PolarHBondContact O-N 2.6Å
120	D	67	Low	57.4	Low	103 Å²	103	90.1 Å²	90.1	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-58.9	-39.5	-175.3	-58.3	-28.8	0	0	0	112.8	A124	D120-A124 VanDerWaalsContact O-CB 3.23Å; D120-A124 WeakPolarHBondContact O-CB 3.47Å; D120-A124 PolarHBondContact O-N 3.42Å
121	L	70.7	Confident	59.2	Low	54 Å²	54	89.3 Å²	89.3	28%	0.283	51%	0.51	S	S	.	.	H	α-helix	trans	-71.3	-45.7	178.7	-87.4	156.8	0	0	0	112.4	C119 S123 A124 L125 Q197	C119-L121 VanDerWaalsContact C-N 3.3Å; C119-L121 PolarHBondContact O-N 2.92Å; L121-S123 VanDerWaalsContact C-N 3.29Å; L121-S123 PolarHBondContact O-N 2.61Å; L121-A124 PolarHBondContact O-N 3.03Å; L121-L125 WeakPolarHBondContact O-CB 3.16Å; L121-L125 WeakPolarHBondContact O-CD1 3.08Å; L121-L125 WeakPolarHBondContact O-CG 3.26Å; L121-L125 PolarHBondContact O-N 3.37Å; L121-Q197 VanDerWaalsContact CD1-NE2 3.29Å; L121-Q197 VanDerWaalsContact CD2-NE2 3.28Å
122	L	77	Confident	60.8	Low	120 Å²	120	89.3 Å²	89.3	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-62.6	-41.8	176.6	-169.3	72.9	0	0	0	110.4	C119 L125 V126	C119-L122 PolarHBondContact O-N 3.02Å; L122-L125 PolarHBondContact O-N 3.16Å; L122-V126 VanDerWaalsContact O-CB 3.31Å; L122-V126 WeakPolarHBondContact O-CB 3.4Å; L122-V126 VanDerWaalsContact O-CG2 3.22Å; L122-V126 WeakPolarHBondContact O-CG2 3.32Å; L122-V126 PolarHBondContact O-N 2.61Å
123	S	79	Confident	62.1	Low	80 Å²	80	87.5 Å²	87.5	56%	0.559	49%	0.492	S	S	*	.	H	α-helix	trans	-61.4	-46	175.4	-170.7	0	0	0	0	112	C119 L121 V126 A127	C119-S123 VanDerWaalsContact O-CB 3.26Å; C119-S123 WeakPolarHBondContact O-CB 3.37Å; C119-S123 PolarHBondContact O-N 2.6Å; L121-S123 VanDerWaalsContact C-N 3.29Å; L121-S123 PolarHBondContact O-N 2.61Å; S123-V126 PolarHBondContact O-N 3.23Å; S123-A127 VanDerWaalsContact O-CB 3.26Å; S123-A127 WeakPolarHBondContact O-CB 3.26Å; S123-A127 PolarHBondContact O-N 3.43Å
124	A	78.8	Confident	63.6	Low	36 Å²	36	84 Å²	84	30%	0.298	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-39.6	177.3	0	0	0	0	0	113	D120 L121 A127 N128	D120-A124 VanDerWaalsContact O-CB 3.23Å; D120-A124 WeakPolarHBondContact O-CB 3.47Å; D120-A124 PolarHBondContact O-N 3.42Å; L121-A124 PolarHBondContact O-N 3.03Å; A124-A127 PolarHBondContact O-N 2.88Å; A124-N128 PolarHBondContact O-N 2.88Å; A124-N128 PolarHBondContact O-ND2 2.82Å; A124-N128 VanDerWaalsContact O-ND2 3.12Å
125	L	83.1	Confident	64.8	Low	34 Å²	34	84.7 Å²	84.7	18%	0.178	49%	0.485	C	S	.	.	H	α-helix	trans	-62.6	-50.8	174	-67.8	167.2	0	0	0	110.1	L121 L122 A127 N128 E129 S189 L193	L121-L125 WeakPolarHBondContact O-CB 3.16Å; L121-L125 WeakPolarHBondContact O-CD1 3.08Å; L121-L125 WeakPolarHBondContact O-CG 3.26Å; L121-L125 PolarHBondContact O-N 3.37Å; L122-L125 PolarHBondContact O-N 3.16Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.43Å; L125-N128 WeakPolarHBondContact O-CB 3.31Å; L125-N128 PolarHBondContact O-N 3.16Å; L125-N128 VanDerWaalsContact O-N 3.16Å; L125-E129 WeakPolarHBondContact O-CG 3.39Å; L125-E129 PolarHBondContact O-N 2.78Å; L125-S189 VanDerWaalsContact CD2-CB 3.4Å; L125-S189 WeakPolarHBondContact CD2-OG 3.21Å; L125-L193 HydrophobicContact CD1-CD2 4.35Å; L125-L193 HydrophobicContact CD2-CD1 4.44Å; L125-L193 HydrophobicContact CD2-CD2 4.44Å; L125-L193 HydrophobicContact CD2-CG 4.16Å
126	V	81.3	Confident	65.5	Low	76 Å²	76	79.2 Å²	79.2	46%	0.461	47%	0.473	S	S	.	.	H	α-helix	trans	-59.5	-39.4	177	167.1	0	0	0	0	112	L122 S123 E129 L130	L122-V126 VanDerWaalsContact O-CB 3.31Å; L122-V126 WeakPolarHBondContact O-CB 3.4Å; L122-V126 VanDerWaalsContact O-CG2 3.22Å; L122-V126 WeakPolarHBondContact O-CG2 3.32Å; L122-V126 PolarHBondContact O-N 2.61Å; S123-V126 PolarHBondContact O-N 3.23Å; V126-E129 PolarHBondContact O-N 3.4Å; V126-L130 HydrophobicContact CG1-CD1 3.82Å; V126-L130 WeakPolarHBondContact O-CB 3.44Å; V126-L130 PolarHBondContact O-N 2.9Å
127	A	80.8	Confident	65.7	Low	43 Å²	43	81.7 Å²	81.7	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-42.6	175.4	0	0	0	0	0	112.2	S123 A124 L125 L130 E131	S123-A127 VanDerWaalsContact O-CB 3.26Å; S123-A127 WeakPolarHBondContact O-CB 3.26Å; S123-A127 PolarHBondContact O-N 3.43Å; A124-A127 PolarHBondContact O-N 2.88Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.43Å; A127-L130 PolarHBondContact O-N 3.42Å; A127-E131 WeakPolarHBondContact O-CG 3.16Å; A127-E131 PolarHBondContact O-N 2.95Å
128	N	81	Confident	65.3	Low	21 Å²	21	75.9 Å²	75.9	11%	0.112	50%	0.498	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175.1	-63.8	-35.6	0	0	0	112	A124 L125 L130 E131 E132 K188 S189 L192	A124-N128 PolarHBondContact O-N 2.88Å; A124-N128 PolarHBondContact O-ND2 2.82Å; A124-N128 VanDerWaalsContact O-ND2 3.12Å; L125-N128 WeakPolarHBondContact O-CB 3.31Å; L125-N128 PolarHBondContact O-N 3.16Å; L125-N128 VanDerWaalsContact O-N 3.16Å; N128-L130 VanDerWaalsContact C-N 3.32Å; N128-L130 PolarHBondContact O-N 3.44Å; N128-E131 PolarHBondContact O-N 2.84Å; N128-E132 PolarHBondContact O-N 3.46Å; N128-K188 HydrophobicContact CB-CB 3.98Å; N128-K188 HydrophobicContact CB-CD 4.15Å; N128-S189 WeakPolarHBondContact CB-OG 3.22Å; N128-S189 PolarHBondContact ND2-OG 2.78Å; N128-S189 VanDerWaalsContact ND2-OG 3.07Å; N128-L192 WeakPolarHBondContact ND2-CD1 3.48Å
129	E	80	Confident	65.1	Low	68 Å²	68	82.4 Å²	82.4	32%	0.318	50%	0.503	S	S	.	.	H	α-helix	trans	-65.6	-35.7	179.1	-54.3	-40.7	120.4	0	0	111.3	L125 V126 A133 S186 S189	L125-E129 WeakPolarHBondContact O-CG 3.39Å; L125-E129 PolarHBondContact O-N 2.78Å; V126-E129 PolarHBondContact O-N 3.4Å; E129-A133 VanDerWaalsContact O-CB 3.22Å; E129-A133 WeakPolarHBondContact O-CB 3.19Å; E129-A133 PolarHBondContact O-N 3.12Å; E129-S186 VanDerWaalsContact OE1-CB 3.32Å; E129-S186 WeakPolarHBondContact OE1-CB 3.48Å; E129-S186 PolarHBondContact OE1-N 2.77Å; E129-S186 PolarHBondContact OE1-OG 3.07Å; E129-S186 WeakPolarHBondContact OE2-CB 3.23Å; E129-S186 PolarHBondContact OE2-N 3.43Å; E129-S189 WeakPolarHBondContact OE1-CB 3.42Å; E129-S189 PolarHBondContact OE1-OG 2.72Å
130	L	75.6	Confident	64.2	Low	115 Å²	115	83.2 Å²	83.2	60%	0.602	51%	0.509	S	S	*	.	H	α-helix	trans	-67.5	-43.3	174.2	-88	160.8	0	0	0	112.8	V126 A127 N128 A133 S134	V126-L130 HydrophobicContact CG1-CD1 3.82Å; V126-L130 WeakPolarHBondContact O-CB 3.44Å; V126-L130 PolarHBondContact O-N 2.9Å; A127-L130 PolarHBondContact O-N 3.42Å; N128-L130 VanDerWaalsContact C-N 3.32Å; N128-L130 PolarHBondContact O-N 3.44Å; L130-A133 PolarHBondContact O-N 3.07Å; L130-S134 PolarHBondContact O-N 3.22Å
131	E	70.8	Confident	62.7	Low	102 Å²	102	84.3 Å²	84.3	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-46.6	175.3	-78.9	-173.5	172.7	0	0	111.5	A127 N128 S134 L135 K188	A127-E131 WeakPolarHBondContact O-CG 3.16Å; A127-E131 PolarHBondContact O-N 2.95Å; N128-E131 PolarHBondContact O-N 2.84Å; E131-S134 PolarHBondContact O-N 3Å; E131-S134 PolarHBondContact O-OG 2.83Å; E131-L135 PolarHBondContact O-N 3.24Å; E131-K188 IonicContact OE2-NZ 2.61Å; E131-K188 PolarHBondContact OE2-NZ 2.94Å
132	E	63.1	Low	61	Low	77 Å²	77	87.5 Å²	87.5	36%	0.36	54%	0.544	S	S	.	.	H	α-helix	trans	-69.5	-35.9	178.6	-71.3	-170.4	-165.9	0	0	112.4	N128 S134 L135 G136 S186	N128-E132 PolarHBondContact O-N 3.46Å; E132-S134 VanDerWaalsContact C-N 3.3Å; E132-S134 PolarHBondContact O-N 3.18Å; E132-L135 PolarHBondContact O-N 3.38Å; E132-G136 PolarHBondContact O-N 2.88Å; E132-S186 VanDerWaalsContact CD-CB 3.43Å; E132-S186 WeakPolarHBondContact OE2-CB 3.39Å
133	A	61.3	Low	58.8	Low	76 Å²	76	89.2 Å²	89.2	63%	0.628	55%	0.553	S	S	*	*	H	α-helix	trans	-60.6	-38.2	171.5	0	0	0	0	0	112.4	E129 L130 L135 G136	E129-A133 VanDerWaalsContact O-CB 3.22Å; E129-A133 WeakPolarHBondContact O-CB 3.19Å; E129-A133 PolarHBondContact O-N 3.12Å; L130-A133 PolarHBondContact O-N 3.07Å; A133-L135 VanDerWaalsContact C-N 3.29Å; A133-L135 PolarHBondContact O-N 3.07Å; A133-G136 PolarHBondContact O-N 3.14Å
134	S	59.5	Low	56.6	Low	96 Å²	96	90.9 Å²	90.9	67%	0.671	57%	0.565	S	S	*	*	H	α-helix	trans	-69.1	-23.6	178.6	76.8	0	0	0	0	114.3	L130 E131 E132	L130-S134 PolarHBondContact O-N 3.22Å; E131-S134 PolarHBondContact O-N 3Å; E131-S134 PolarHBondContact O-OG 2.83Å; E132-S134 VanDerWaalsContact C-N 3.3Å; E132-S134 PolarHBondContact O-N 3.18Å
135	L	56.5	Low	54.3	Low	122 Å²	122	100.6 Å²	100.6	64%	0.639	59%	0.594	S	S	*	*	H	α-helix	trans	-94.4	-11.2	179.8	-71.6	164.5	0	0	0	113.1	E131 E132 A133 G137	E131-L135 PolarHBondContact O-N 3.24Å; E132-L135 PolarHBondContact O-N 3.38Å; A133-L135 VanDerWaalsContact C-N 3.29Å; A133-L135 PolarHBondContact O-N 3.07Å; L135-G137 PolarHBondContact O-N 2.93Å; L135-G137 VanDerWaalsContact O-N 3.16Å
136	G	46.9	Very low	51.8	Low	50 Å²	50	105 Å²	105	52%	0.515	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-2.9	-174.5	0	0	0	0	0	116.6	E132 A133 A138	E132-G136 PolarHBondContact O-N 2.88Å; A133-G136 PolarHBondContact O-N 3.14Å; G136-A138 PolarHBondContact O-N 2.87Å
137	G	37.5	Very low	49.5	Very low	80 Å²	80	107.1 Å²	107.1	83%	0.825	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-4.9	-170.4	0	0	0	0	0	117.3	L135	L135-G137 PolarHBondContact O-N 2.93Å; L135-G137 VanDerWaalsContact O-N 3.16Å
138	A	32.5	Very low	47.1	Very low	85 Å²	85	115.3 Å²	115.3	70%	0.702	67%	0.672	S	S	*	*			trans	-137.2	65.1	-166.2	0	0	0	0	0	114.8	G136	G136-A138 PolarHBondContact O-N 2.87Å
139	Y	35.9	Very low	44.8	Very low	205 Å²	205	118.1 Å²	118.1	80%	0.804	71%	0.707	S	S	*	*			trans	-121.9	87.9	168.3	-65.3	-76	0	0	0	111.5
140	S	29.6	Very low	42.5	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	73%	0.732	S	S	*	*			trans	-96.5	120	166.3	-170.1	0	0	0	0	109.4	V142	S140-V142 PolarHBondContact O-N 3.33Å; S140-V142 VanDerWaalsContact O-N 3.15Å
141	P	35.9	Very low	40.8	Very low	126 Å²	126	122.9 Å²	122.9	82%	0.818	75%	0.745	S	S	*	*			trans	-83.6	93.2	-173.6	32.4	-33.7	0	0	0	111.2
142	V	34.7	Very low	39.1	Very low	122 Å²	122	121.3 Å²	121.3	74%	0.739	76%	0.756	S	S	*	*			trans	-94	114.5	172.9	-171.5	0	0	0	0	110.4	S140 S144	S140-V142 PolarHBondContact O-N 3.33Å; S140-V142 VanDerWaalsContact O-N 3.15Å; V142-S144 PolarHBondContact O-N 2.87Å
143	N	31.1	Very low	37.9	Very low	155 Å²	155	124 Å²	124	83%	0.829	78%	0.777	S	S	*	*			trans	-57.7	128.8	171.1	-94.8	-47.5	0	0	0	111.6
144	S	33.3	Very low	36.7	Very low	115 Å²	115	128.3 Å²	128.3	80%	0.804	79%	0.789	S	S	*	*			trans	-139.7	103.2	163.4	-77.7	0	0	0	0	110.6	V142	V142-S144 PolarHBondContact O-N 2.87Å
145	R	29.3	Very low	35.5	Very low	240 Å²	240	128.7 Å²	128.7	91%	0.906	80%	0.798	S	S	*	*			trans	-79.8	129.3	169.6	-65	175.6	178.8	173.6	-0.9	109.6
146	C	30.8	Very low	34.4	Very low	127 Å²	127	128.1 Å²	128.1	86%	0.858	81%	0.81	S	S	*	*			trans	-163.8	88.8	155.8	-90.6	0	0	0	0	107
147	S	32.5	Very low	34.1	Very low	121 Å²	121	137.3 Å²	137.3	85%	0.846	83%	0.829	S	S	*	*				77.9	119.3	95.4	-152.7	0	0	0	0	114.3
148	F	30.7	Very low	34.2	Very low	214 Å²	214	141.5 Å²	141.5	94%	0.939	83%	0.828	S	S	*	*			trans	-79.2	142.6	176.5	-93.7	-106.8	0	0	0	111.2
149	G	32.8	Very low	34.8	Very low	81 Å²	81	144.2 Å²	144.2	84%	0.835	83%	0.83	S	S	*	*			trans	-150.1	130.1	167.6	0	0	0	0	0	109.8
150	N	32.2	Very low	35.2	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	83%	0.831	S	S	*	*			trans	-127.5	132.2	-164.7	-172.1	33.7	0	0	0	110.5
151	S	39.1	Very low	36.4	Very low	123 Å²	123	142.5 Å²	142.5	86%	0.86	83%	0.827	S	S	*	*			trans	-174.3	140.3	165.8	-87.3	0	0	0	0	114.4
152	G	35.5	Very low	37.5	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	83%	0.828	S	S	*	*			trans	79.4	100.7	169.1	0	0	0	0	0	114.9
153	V	38.4	Very low	37.9	Very low	132 Å²	132	148 Å²	148	80%	0.8	83%	0.833	S	S	*	*			cis	72.8	97.4	23	-170.3	0	0	0	0	114.8
154	L	35.2	Very low	39	Very low	168 Å²	168	143.8 Å²	143.8	88%	0.88	82%	0.816	S	S	*	*			trans	67.8	105.6	155.9	-59.5	172.5	0	0	0	120.7
155	A	36.3	Very low	39.6	Very low	104 Å²	104	147.4 Å²	147.4	86%	0.86	82%	0.818	S	S	*	*			trans	-154	120.6	136.6	0	0	0	0	0	109.8
156	A	33	Very low	40.5	Very low	109 Å²	109	144.1 Å²	144.1	90%	0.901	81%	0.81	S	S	*	*			trans	-81.5	147.3	172.6	0	0	0	0	0	110.3
157	R	40.3	Very low	41.2	Very low	243 Å²	243	145.5 Å²	145.5	92%	0.917	81%	0.808	S	S	*	*			trans	-142.3	124	168	-156.3	168.3	-179.1	170.7	-0.2	111.1
158	E	39.6	Very low	41.4	Very low	169 Å²	169	150.6 Å²	150.6	79%	0.79	81%	0.809	S	S	*	*			trans	-66.9	150.4	-172.1	-58.8	162.2	138	0	0	112.2
159	N	45	Very low	41.8	Very low	141 Å²	141	151.9 Å²	151.9	75%	0.754	81%	0.807	S	S	*	*			trans	-156	90.6	164.9	-100.2	-50	0	0	0	109.5	N161	N159-N161 PolarHBondContact O-N 3.45Å
160	N	44.4	Very low	42	Very low	155 Å²	155	155.4 Å²	155.4	83%	0.829	80%	0.802	S	S	*	*			trans	-77	54.5	-176.6	-75.4	-21.3	0	0	0	113.5
161	N	55.1	Low	42.3	Very low	118 Å²	118	152.1 Å²	152.1	63%	0.631	79%	0.791	S	S	*	*			trans	-98	89.8	174.7	-79	-6.1	0	0	0	111.2	N159 F163 S164	N159-N161 PolarHBondContact O-N 3.45Å; N161-F163 PolarHBondContact O-N 2.85Å; N161-S164 PolarHBondContact O-N 2.86Å
162	M	57.5	Low	42.3	Very low	172 Å²	172	152.1 Å²	152.1	85%	0.847	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-19	-177.7	-124.3	-173	-55.6	0	0	115.2
163	F	44.6	Very low	42.5	Very low	191 Å²	191	153.3 Å²	153.3	84%	0.838	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	30.7	-177.7	-61.4	-70.3	0	0	0	113.7	N161 F165	N161-F163 PolarHBondContact O-N 2.85Å; F163-F165 PolarHBondContact O-N 3.27Å
164	S	53.5	Low	42.8	Very low	68 Å²	68	156.4 Å²	156.4	48%	0.476	79%	0.787	S	S	.	*			trans	-81	94.8	175.1	159	0	0	0	0	111.9	N161 K166	N161-S164 PolarHBondContact O-N 2.86Å; S164-K166 VanDerWaalsContact C-N 3.3Å; S164-K166 PolarHBondContact O-N 2.84Å
165	F	46.1	Very low	43.2	Very low	191 Å²	191	154.7 Å²	154.7	84%	0.838	78%	0.778	S	S	*	*			trans	-71.9	86.4	162.5	73.3	-81	0	0	0	109.9	F163 L167	F163-F165 PolarHBondContact O-N 3.27Å; F165-L167 PolarHBondContact O-N 3.28Å; F165-L167 VanDerWaalsContact O-N 3.16Å
166	K	49.2	Very low	43.6	Very low	171 Å²	171	159.3 Å²	159.3	74%	0.743	78%	0.779	S	S	*	*			trans	-74.4	104.5	158.4	-79.4	-176.2	-179.2	177.1	0	106.6	S164 R168	S164-K166 VanDerWaalsContact C-N 3.3Å; S164-K166 PolarHBondContact O-N 2.84Å; K166-R168 PolarHBondContact O-N 2.91Å
167	L	43.5	Very low	44.5	Very low	156 Å²	156	157.6 Å²	157.6	82%	0.817	76%	0.757	S	S	*	*			trans	-50.2	112.3	156.4	-154.6	85.4	0	0	0	105	F165 R169	F165-L167 PolarHBondContact O-N 3.28Å; F165-L167 VanDerWaalsContact O-N 3.16Å; L167-R169 PolarHBondContact O-N 2.66Å
168	R	38.1	Very low	45.1	Very low	228 Å²	228	148.8 Å²	148.8	86%	0.86	73%	0.733	S	S	*	*			trans	-63	99.5	171	-86.8	-171.1	172.2	122.6	-2.5	104.7	K166 E170	K166-R168 PolarHBondContact O-N 2.91Å; R168-E170 PolarHBondContact O-N 2.89Å
169	R	38	Very low	46.1	Very low	241 Å²	241	146.2 Å²	146.2	91%	0.909	73%	0.731	S	S	*	*			trans	-64	91.2	161.1	-160.9	-179.4	-153.7	171.4	7	103.3	L167 S171	L167-R169 PolarHBondContact O-N 2.66Å; R169-S171 VanDerWaalsContact C-N 3.32Å; R169-S171 PolarHBondContact O-N 3.47Å
170	E	36.9	Very low	46.7	Very low	155 Å²	155	148.3 Å²	148.3	72%	0.724	73%	0.73	S	S	*	*			trans	-52	110.1	165	-68.4	-174	167.4	0	0	104.4	R168 P172	R168-E170 PolarHBondContact O-N 2.89Å; E170-P172 VanDerWaalsContact O-N 3.15Å
171	S	38.7	Very low	47.5	Very low	90 Å²	90	144.1 Å²	144.1	63%	0.629	71%	0.71	S	S	*	*			trans	-43.8	124.5	158.5	46.5	0	0	0	0	105	R169 C173	R169-S171 VanDerWaalsContact C-N 3.32Å; R169-S171 PolarHBondContact O-N 3.47Å; S171-C173 VanDerWaalsContact C-N 3.32Å; S171-C173 PolarHBondContact O-N 2.91Å
172	P	40.6	Very low	47.8	Very low	123 Å²	123	146.5 Å²	146.5	80%	0.799	72%	0.719	S	S	*	*			trans	-53.9	105.8	-171.1	21.5	-32.7	0	0	0	106.5	E170 K174	E170-P172 VanDerWaalsContact O-N 3.15Å; P172-K174 PolarHBondContact O-N 3.38Å
173	C	38.7	Very low	48.2	Very low	94 Å²	94	140.8 Å²	140.8	64%	0.635	70%	0.696	S	S	*	*			trans	-58	117.2	178.7	-78.3	0	0	0	0	102.7	S171 L175	S171-C173 VanDerWaalsContact C-N 3.32Å; S171-C173 PolarHBondContact O-N 2.91Å; C173-L175 PolarHBondContact O-N 3.28Å
174	K	43.9	Very low	49.6	Very low	198 Å²	198	137.6 Å²	137.6	86%	0.861	70%	0.695	S	S	*	*			trans	-57.9	92.7	166	-68.9	-175.5	178.9	-175.3	0	104.1	P172 K176	P172-K174 PolarHBondContact O-N 3.38Å; K174-K176 VanDerWaalsContact C-N 3.29Å; K174-K176 PolarHBondContact O-N 2.98Å
175	L	43.6	Very low	50.6	Low	131 Å²	131	136.5 Å²	136.5	69%	0.686	69%	0.685	S	S	*	*			trans	-52.1	110.2	163.7	-91.9	154.4	0	0	0	102	C173 T177	C173-L175 PolarHBondContact O-N 3.28Å; L175-T177 PolarHBondContact O-N 3.26Å; L175-T177 PolarHBondContact O-OG1 3.38Å
176	K	46.5	Very low	52.2	Low	201 Å²	201	127.9 Å²	127.9	87%	0.874	65%	0.648	S	S	*	*			trans	-70.3	83.1	174.9	-74.1	177.8	175.1	178.2	0	104.2	K174 S178	K174-K176 VanDerWaalsContact C-N 3.29Å; K174-K176 PolarHBondContact O-N 2.98Å; K176-S178 VanDerWaalsContact C-N 3.33Å; K176-S178 PolarHBondContact O-N 2.88Å
177	T	50.9	Low	53.7	Low	73 Å²	73	123.5 Å²	123.5	45%	0.448	63%	0.63	S	S	.	*			trans	-48.3	108.4	160.3	-31.1	0	0	0	0	103.7	L175 T181 E187	L175-T177 PolarHBondContact O-N 3.26Å; L175-T177 PolarHBondContact O-OG1 3.38Å; T177-T181 HydrophobicContact CG2-CG2 4.02Å; T177-E187 PolarHBondContact OG1-OE2 3.26Å
178	S	53.9	Low	55.4	Low	58 Å²	58	119.8 Å²	119.8	41%	0.406	61%	0.608	S	S	.	*			trans	-62.3	140.1	-178.9	53	0	0	0	0	106.4	K176 Y180 T181	K176-S178 VanDerWaalsContact C-N 3.33Å; K176-S178 PolarHBondContact O-N 2.88Å; S178-Y180 PolarHBondContact O-N 2.91Å; S178-T181 PolarHBondContact O-N 2.95Å; S178-T181 PolarHBondContact O-OG1 2.72Å; S178-T181 WeakPolarHBondContact OG-CG2 3.45Å
179	P	59.7	Low	57.6	Low	116 Å²	116	108.9 Å²	108.9	75%	0.753	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	16.5	178.1	27.1	-34.3	0	0	0	113.4
180	Y	56.6	Low	59.6	Low	185 Å²	185	99.4 Å²	99.4	73%	0.725	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.8	19.6	-178.1	-53.5	-69.1	0	0	0	111.7	S178 M182	S178-Y180 PolarHBondContact O-N 2.91Å; Y180-M182 VanDerWaalsContact C-N 3.31Å; Y180-M182 PolarHBondContact O-N 2.69Å
181	T	61.7	Low	61.7	Low	66 Å²	66	97.2 Å²	97.2	41%	0.405	52%	0.522	S	S	.	.			trans	-67	89.2	172.5	47.3	0	0	0	0	110.6	T177 S178 S183	T177-T181 HydrophobicContact CG2-CG2 4.02Å; S178-T181 PolarHBondContact O-N 2.95Å; S178-T181 PolarHBondContact O-OG1 2.72Å; S178-T181 WeakPolarHBondContact OG-CG2 3.45Å; T181-S183 PolarHBondContact O-N 2.89Å
182	M	61.5	Low	63.7	Low	168 Å²	168	95.7 Å²	95.7	83%	0.828	51%	0.507	S	S	*	.			trans	-70.6	29.8	173.9	-60	-69.9	93.5	0	0	113.3	Y180	Y180-M182 VanDerWaalsContact C-N 3.31Å; Y180-M182 PolarHBondContact O-N 2.69Å
183	S	66.8	Low	65.7	Low	52 Å²	52	94.6 Å²	94.6	36%	0.364	49%	0.494	S	S	.	.			trans	-83.4	126	174.7	-165.4	0	0	0	0	108.5	T181 V185 Q190	T181-S183 PolarHBondContact O-N 2.89Å; S183-V185 PolarHBondContact O-N 2.82Å; S183-Q190 VanDerWaalsContact CB-NE2 3.3Å; S183-Q190 PolarHBondContact OG-NE2 3.4Å
184	P	72.9	Confident	67.5	Low	125 Å²	125	97.1 Å²	97.1	81%	0.812	49%	0.494	S	S	*	.	S	Bend	trans	-76.9	27.7	179.4	33.4	-36.3	0	0	0	112.6
185	V	74.1	Confident	68.7	Low	44 Å²	44	93.3 Å²	93.3	27%	0.267	48%	0.478	S	S	.	.	S	Bend	trans	-150.1	128.6	-166.9	177.8	0	0	0	0	109.1	S183 Q190 L193	S183-V185 PolarHBondContact O-N 2.82Å; V185-Q190 HydrophobicContact CG1-CG 4.37Å; V185-Q190 PolarHBondContact O-NE2 2.83Å; V185-L193 HydrophobicContact CG1-CD1 4.2Å
186	S	81.7	Confident	69.4	Low	10 Å²	10	92.5 Å²	92.5	7%	0.07	48%	0.48	C	S	.	.			trans	-51.5	159.9	179.1	64	0	0	0	0	114.6	E129 E132 K188 S189 Q190	E129-S186 VanDerWaalsContact OE1-CB 3.32Å; E129-S186 WeakPolarHBondContact OE1-CB 3.48Å; E129-S186 PolarHBondContact OE1-N 2.77Å; E129-S186 PolarHBondContact OE1-OG 3.07Å; E129-S186 WeakPolarHBondContact OE2-CB 3.23Å; E129-S186 PolarHBondContact OE2-N 3.43Å; E132-S186 VanDerWaalsContact CD-CB 3.43Å; E132-S186 WeakPolarHBondContact OE2-CB 3.39Å; S186-K188 VanDerWaalsContact C-N 3.31Å; S186-K188 PolarHBondContact O-N 3.1Å; S186-S189 PolarHBondContact O-N 2.77Å; S186-S189 WeakPolarHBondContact OG-CB 3.38Å; S186-S189 PolarHBondContact OG-N 3.26Å; S186-S189 VanDerWaalsContact OG-N 3.14Å; S186-S189 PolarHBondContact OG-OG 3.14Å; S186-S189 VanDerWaalsContact OG-OG 3.07Å; S186-Q190 WeakPolarHBondContact O-CG 3.49Å; S186-Q190 PolarHBondContact O-N 3.48Å
187	E	80	Confident	70	Confident	79 Å²	79	88 Å²	88	37%	0.369	46%	0.462	S	S	.	.	H	α-helix	trans	-64.4	-37.1	178.2	-170	166.7	166	0	0	111.6	T177 Q190 H191	T177-E187 PolarHBondContact OG1-OE2 3.26Å; E187-Q190 PolarHBondContact O-N 2.81Å; E187-H191 WeakPolarHBondContact O-CB 3.14Å; E187-H191 PolarHBondContact O-N 2.96Å
188	K	79.6	Confident	70.4	Confident	78 Å²	78	94.2 Å²	94.2	34%	0.339	48%	0.483	S	S	.	.	H	α-helix	trans	-57.1	-50.4	171	-69.3	175.7	-179.2	168.2	0	111.7	N128 E131 S186 H191 L192	N128-K188 HydrophobicContact CB-CB 3.98Å; N128-K188 HydrophobicContact CB-CD 4.15Å; E131-K188 IonicContact OE2-NZ 2.61Å; E131-K188 PolarHBondContact OE2-NZ 2.94Å; S186-K188 VanDerWaalsContact C-N 3.31Å; S186-K188 PolarHBondContact O-N 3.1Å; K188-H191 WeakPolarHBondContact O-CB 3.27Å; K188-H191 PolarHBondContact O-N 2.78Å; K188-L192 PolarHBondContact O-N 2.77Å
189	S	82.9	Confident	70.8	Confident	0 Å²	0	100.4 Å²	100.4	0%	0	51%	0.506	C	S	.	.	H	α-helix	trans	-67.8	-39	-179.6	-73.7	0	0	0	0	112.4	L125 N128 E129 S186 H191 L192 L193	L125-S189 VanDerWaalsContact CD2-CB 3.4Å; L125-S189 WeakPolarHBondContact CD2-OG 3.21Å; N128-S189 WeakPolarHBondContact CB-OG 3.22Å; N128-S189 PolarHBondContact ND2-OG 2.78Å; N128-S189 VanDerWaalsContact ND2-OG 3.07Å; E129-S189 WeakPolarHBondContact OE1-CB 3.42Å; E129-S189 PolarHBondContact OE1-OG 2.72Å; S186-S189 PolarHBondContact O-N 2.77Å; S186-S189 WeakPolarHBondContact OG-CB 3.38Å; S186-S189 PolarHBondContact OG-N 3.26Å; S186-S189 VanDerWaalsContact OG-N 3.14Å; S186-S189 PolarHBondContact OG-OG 3.14Å; S186-S189 VanDerWaalsContact OG-OG 3.07Å; S189-H191 VanDerWaalsContact C-N 3.28Å; S189-H191 PolarHBondContact O-N 2.97Å; S189-L192 PolarHBondContact O-N 3.25Å; S189-L193 WeakPolarHBondContact O-CB 3.49Å; S189-L193 VanDerWaalsContact O-CG 3.27Å; S189-L193 WeakPolarHBondContact O-CG 3.44Å; S189-L193 PolarHBondContact O-N 2.9Å
190	Q	81.4	Confident	71.2	Confident	41 Å²	41	98.4 Å²	98.4	19%	0.192	50%	0.499	C	S	.	.	H	α-helix	trans	-58.7	-39.6	169.9	-76.6	-176.4	46.2	0	0	112.2	S183 V185 S186 E187 L193 K194	S183-Q190 VanDerWaalsContact CB-NE2 3.3Å; S183-Q190 PolarHBondContact OG-NE2 3.4Å; V185-Q190 HydrophobicContact CG1-CG 4.37Å; V185-Q190 PolarHBondContact O-NE2 2.83Å; S186-Q190 WeakPolarHBondContact O-CG 3.49Å; S186-Q190 PolarHBondContact O-N 3.48Å; E187-Q190 PolarHBondContact O-N 2.81Å; Q190-L193 PolarHBondContact O-N 2.91Å; Q190-K194 VanDerWaalsContact O-CB 3.3Å; Q190-K194 WeakPolarHBondContact O-CB 3.39Å; Q190-K194 WeakPolarHBondContact O-CD 3.29Å; Q190-K194 WeakPolarHBondContact O-CG 3.42Å; Q190-K194 PolarHBondContact O-N 2.94Å
191	H	79.9	Confident	72.4	Confident	109 Å²	109	93.6 Å²	93.6	51%	0.505	48%	0.479	S	S	.	.	H	α-helix	trans	-66.8	-41.7	178.1	-168.1	-121.8	0	0	0	111.5	E187 K188 S189 L193 K194 F195	E187-H191 WeakPolarHBondContact O-CB 3.14Å; E187-H191 PolarHBondContact O-N 2.96Å; K188-H191 WeakPolarHBondContact O-CB 3.27Å; K188-H191 PolarHBondContact O-N 2.78Å; S189-H191 VanDerWaalsContact C-N 3.28Å; S189-H191 PolarHBondContact O-N 2.97Å; H191-L193 VanDerWaalsContact C-N 3.35Å; H191-L193 PolarHBondContact O-N 3.02Å; H191-K194 PolarHBondContact O-N 2.83Å; H191-F195 AromaticContact CE1-CE2 3.21Å; H191-F195 WeakPolarHBondContact CE1-CE2 3.15Å; H191-F195 AromaticContact CE1-CZ 3.44Å; H191-F195 VanDerWaalsContact CE1-CZ 3.44Å; H191-F195 WeakPolarHBondContact CE1-CZ 3.3Å; H191-F195 AromaticContact ND1-CE2 3.39Å; H191-F195 WeakPolarHBondContact ND1-CE2 3.38Å; H191-F195 AromaticContact NE2-CE2 3.87Å; H191-F195 AromaticContact NE2-CZ 3.89Å; H191-F195 VanDerWaalsContact O-CD2 3.29Å; H191-F195 WeakPolarHBondContact O-CD2 3.49Å; H191-F195 PolarHBondContact O-N 2.91Å
192	L	81.7	Confident	73.5	Confident	58 Å²	58	100 Å²	100	30%	0.304	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-36.8	171.8	-83.9	153.9	0	0	0	113.7	N128 K188 S189	N128-L192 WeakPolarHBondContact ND2-CD1 3.48Å; K188-L192 PolarHBondContact O-N 2.77Å; S189-L192 PolarHBondContact O-N 3.25Å
193	L	81.8	Confident	74.8	Confident	101 Å²	101	92.9 Å²	92.9	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-75.2	-30	175.1	-67.7	170.6	0	0	0	112.9	L125 V185 S189 Q190 H191	L125-L193 HydrophobicContact CD1-CD2 4.35Å; L125-L193 HydrophobicContact CD2-CD1 4.44Å; L125-L193 HydrophobicContact CD2-CD2 4.44Å; L125-L193 HydrophobicContact CD2-CG 4.16Å; V185-L193 HydrophobicContact CG1-CD1 4.2Å; S189-L193 WeakPolarHBondContact O-CB 3.49Å; S189-L193 VanDerWaalsContact O-CG 3.27Å; S189-L193 WeakPolarHBondContact O-CG 3.44Å; S189-L193 PolarHBondContact O-N 2.9Å; Q190-L193 PolarHBondContact O-N 2.91Å; H191-L193 VanDerWaalsContact C-N 3.35Å; H191-L193 PolarHBondContact O-N 3.02Å
194	K	75.9	Confident	76	Confident	147 Å²	147	93.1 Å²	93.1	64%	0.639	47%	0.469	S	S	*	.	H	α-helix	trans	-79.6	-23.9	176.9	-74.4	164.7	-170.1	164.4	0	113	Q190 H191	Q190-K194 VanDerWaalsContact O-CB 3.3Å; Q190-K194 WeakPolarHBondContact O-CB 3.39Å; Q190-K194 WeakPolarHBondContact O-CD 3.29Å; Q190-K194 WeakPolarHBondContact O-CG 3.42Å; Q190-K194 PolarHBondContact O-N 2.94Å; H191-K194 PolarHBondContact O-N 2.83Å
195	F	68.7	Low	77	Confident	118 Å²	118	94.5 Å²	94.5	52%	0.518	46%	0.457	S	S	.	.	S	Bend	trans	-63.1	126.8	172.5	-89.4	-60.2	0	0	0	110.3	H191 Q197	H191-F195 AromaticContact CE1-CE2 3.21Å; H191-F195 WeakPolarHBondContact CE1-CE2 3.15Å; H191-F195 AromaticContact CE1-CZ 3.44Å; H191-F195 VanDerWaalsContact CE1-CZ 3.44Å; H191-F195 WeakPolarHBondContact CE1-CZ 3.3Å; H191-F195 AromaticContact ND1-CE2 3.39Å; H191-F195 WeakPolarHBondContact ND1-CE2 3.38Å; H191-F195 AromaticContact NE2-CE2 3.87Å; H191-F195 AromaticContact NE2-CZ 3.89Å; H191-F195 VanDerWaalsContact O-CD2 3.29Å; H191-F195 WeakPolarHBondContact O-CD2 3.49Å; H191-F195 PolarHBondContact O-N 2.91Å; F195-Q197 PolarHBondContact O-N 3.39Å
196	P	60.1	Low	78	Confident	114 Å²	114	97.1 Å²	97.1	74%	0.74	47%	0.474	S	S	*	.			trans	-66.9	98	175.4	27.1	-33.6	0	0	0	109.2	K198	P196-K198 PolarHBondContact O-N 3.01Å
197	Q	58.6	Low	78.7	Confident	107 Å²	107	97.9 Å²	97.9	50%	0.5	48%	0.478	S	S	.	.			trans	-60.4	108.8	172.3	-64.2	-179.6	13.5	0	0	107.7	L121 F195 Q199	L121-Q197 VanDerWaalsContact CD1-NE2 3.29Å; L121-Q197 VanDerWaalsContact CD2-NE2 3.28Å; F195-Q197 PolarHBondContact O-N 3.39Å; Q197-Q199 PolarHBondContact O-N 3.19Å
198	K	59.8	Low	79.5	Confident	203 Å²	203	99.9 Å²	99.9	88%	0.883	48%	0.483	S	S	*	.			trans	-59.8	100.9	175.9	-68.5	-178	-178.8	177.4	0	107.5	P196 A200	P196-K198 PolarHBondContact O-N 3.01Å; K198-A200 PolarHBondContact O-N 2.91Å
199	Q	61.6	Low	80.3	Confident	188 Å²	188	99.3 Å²	99.3	88%	0.879	48%	0.481	S	S	*	.			trans	-51.9	115.9	178.7	-71.2	179.6	-9	0	0	108.3	Q197 R201	Q197-Q199 PolarHBondContact O-N 3.19Å; Q199-R201 PolarHBondContact O-N 3.09Å
200	A	68.3	Low	81	Confident	74 Å²	74	102.5 Å²	102.5	61%	0.612	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-64.3	121.7	-179.3	0	0	0	0	0	108.3	K198 K202	K198-A200 PolarHBondContact O-N 2.91Å; A200-K202 PolarHBondContact O-N 2.91Å; A200-K202 VanDerWaalsContact O-N 3.08Å
201	R	80.8	Confident	81.8	Confident	83 Å²	83	102.5 Å²	102.5	31%	0.313	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-52.3	118	179.8	-178.6	-171.8	66.3	-148.3	-5.9	109.7	Q199 E571 T632	Q199-R201 PolarHBondContact O-N 3.09Å; R201-E571 IonicContact CZ-OE1 2.73Å; R201-E571 IonicContact CZ-OE2 3.34Å; R201-E571 VanDerWaalsContact CZ-OE2 3.23Å; R201-E571 IonicContact NH1-OE1 3.41Å; R201-E571 IonicContact NH1-OE2 2.79Å; R201-E571 PolarHBondContact NH1-OE2 3.26Å; R201-E571 VanDerWaalsContact NH2-CD 3.26Å; R201-E571 IonicContact NH2-OE1 3.52Å; R201-E571 PolarHBondContact NH2-OE1 2.82Å; R201-E571 VanDerWaalsContact NH2-OE1 3.14Å; R201-E571 IonicContact NH2-OE2 3.44Å; R201-E571 PolarHBondContact NH2-OE2 3.21Å; R201-T632 WeakPolarHBondContact CD-OG1 3.25Å; R201-T632 HydrophobicContact CG-CG2 4.38Å
202	K	84.4	Confident	82.6	Confident	201 Å²	201	104 Å²	104	87%	0.874	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-81.4	120.9	174.6	-170.7	177.6	-177.2	179.9	0	109.1	A200	A200-K202 PolarHBondContact O-N 2.91Å; A200-K202 VanDerWaalsContact O-N 3.08Å
203	I	90.3	Very high	83.4	Confident	18 Å²	18	101.2 Å²	101.2	9%	0.092	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-98.4	143.1	172.4	-65.4	162.2	0	0	0	108	V595 L597 I630	I203-V595 HydrophobicContact CB-CG2 4.11Å; I203-V595 HydrophobicContact CD1-CB 4.44Å; I203-V595 HydrophobicContact CD1-CG2 3.73Å; I203-V595 HydrophobicContact CG1-CG2 4.44Å; I203-L597 HydrophobicContact CG2-CD2 4.5Å; I203-I630 HydrophobicContact CD1-CG2 4.45Å; I203-I630 HydrophobicContact CG2-CG1 4.42Å
204	S	91.7	Very high	84.1	Confident	58 Å²	58	99.8 Å²	99.8	41%	0.406	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-69.7	132.4	175.4	-175.1	0	0	0	0	110.9	V206 L597	S204-V206 VanDerWaalsContact C-N 3.3Å; S204-V206 PolarHBondContact OG-N 3.31Å; S204-V206 VanDerWaalsContact OG-N 3.16Å; S204-V206 PolarHBondContact OG-O 3.49Å; S204-L597 VanDerWaalsContact O-CD2 3.24Å; S204-L597 WeakPolarHBondContact O-CD2 3.47Å
205	R	94	Very high	85	Confident	153 Å²	153	98.6 Å²	98.6	58%	0.577	49%	0.492	S	S	*	.	S	Bend	trans	-85.1	-1.9	170.3	-66.2	-179	-178.8	156	-4.3	113	E115	E115-R205 IonicContact OE1-CZ 3.9Å; E115-R205 IonicContact OE1-NH1 3.26Å; E115-R205 PolarHBondContact OE1-NH1 2.74Å; E115-R205 VanDerWaalsContact OE1-NH1 3.1Å; E115-R205 IonicContact OE1-NH2 3.7Å; E115-R205 PolarHBondContact OE1-NH2 3.04Å
206	V	94.7	Very high	86.4	Confident	100 Å²	100	93.3 Å²	93.3	61%	0.606	47%	0.469	S	S	*	.	S	Bend	trans	-120	135.4	-178.5	-177.8	0	0	0	0	108.7	S204	S204-V206 VanDerWaalsContact C-N 3.3Å; S204-V206 PolarHBondContact OG-N 3.31Å; S204-V206 VanDerWaalsContact OG-N 3.16Å; S204-V206 PolarHBondContact OG-O 3.49Å
207	P	96.7	Very high	88.2	Confident	26 Å²	26	91.3 Å²	91.3	17%	0.169	45%	0.45	C	S	.	.			trans	-67.1	139.3	175.5	29.8	-34.3	0	0	0	110	K209 V210 R626 F627 W628	P207-K209 VanDerWaalsContact C-N 3.32Å; P207-V210 HydrophobicContact CB-CG2 4.41Å; P207-V210 HydrophobicContact CG-CG2 3.94Å; P207-R626 HydrophobicContact CB-CB 4.02Å; P207-R626 HydrophobicContact CG-CB 4.4Å; P207-F627 CarbonylContact C-O 3.57Å; P207-F627 WeakPolarHBondContact CA-O 3.28Å; P207-F627 VanDerWaalsContact CB-O 3.23Å; P207-F627 WeakPolarHBondContact CB-O 3.43Å; P207-W628 HydrophobicContact CB-CD2 4.04Å; P207-W628 HydrophobicContact CB-CE3 4.07Å; P207-W628 HydrophobicContact CB-CH2 4.33Å; P207-W628 HydrophobicContact CB-CZ2 4.27Å; P207-W628 HydrophobicContact CB-CZ3 4.22Å; P207-W628 HydrophobicContact CG-CH2 4.21Å; P207-W628 HydrophobicContact CG-CZ2 4.42Å; P207-W628 HydrophobicContact CG-CZ3 4.34Å
208	Y	95.7	Very high	90	Very high	121 Å²	121	88.6 Å²	88.6	48%	0.475	44%	0.439	S	S	.	.	S	Bend	trans	-80.6	-17.8	-178.3	70.1	-96.9	0	0	0	112.9	N615 F627 N629	Y208-N615 HydrophobicContact CE1-CB 4.2Å; Y208-N615 WeakPolarHBondContact CE1-OD1 3.45Å; Y208-F627 HydrophobicContact CD1-CB 4.14Å; Y208-F627 VanDerWaalsContact CD1-O 3.25Å; Y208-F627 WeakPolarHBondContact CD1-O 3.33Å; Y208-F627 HydrophobicContact CD2-CB 4.46Å; Y208-F627 HydrophobicContact CE1-CB 3.61Å; Y208-F627 HydrophobicContact CE2-CB 3.96Å; Y208-F627 PolarHBondContact N-O 3.18Å; Y208-N629 HydrophobicContact CD1-CB 4.23Å; Y208-N629 HydrophobicContact CE1-CB 4.46Å
209	K	96.8	Very high	91.7	Very high	65 Å²	65	80.6 Å²	80.6	28%	0.283	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	146	174.4	-172.4	162.5	-178.1	154.5	0	109	P207 W244 S249 F627	P207-K209 VanDerWaalsContact C-N 3.32Å; K209-W244 HydrophobicContact CD-CH2 4.36Å; K209-W244 HydrophobicContact CD-CZ2 4.17Å; K209-S249 PolarHBondContact NZ-OG 2.99Å; K209-F627 HydrophobicContact CB-CB 4.08Å; K209-F627 HydrophobicContact CB-CD2 3.99Å; K209-F627 HydrophobicContact CB-CG 4.24Å; K209-F627 HydrophobicContact CG-CD2 4.2Å; K209-F627 PolarHBondContact O-N 3.31Å
210	V	97.6	Very high	93.5	Very high	68 Å²	68	72 Å²	72	41%	0.412	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.6	169	-173.9	0	0	0	0	106.8	P207 T624 L625 R626	P207-V210 HydrophobicContact CB-CG2 4.41Å; P207-V210 HydrophobicContact CG-CG2 3.94Å; V210-T624 HydrophobicContact CG1-CG2 4.13Å; V210-L625 CarbonylContact C-O 3.48Å; V210-L625 VanDerWaalsContact CA-O 3.3Å; V210-L625 WeakPolarHBondContact CA-O 3.37Å; V210-R626 HydrophobicContact CG1-CG 4.21Å; V210-R626 HydrophobicContact CG2-CG 4.21Å
211	L	98.1	Very high	94.9	Very high	40 Å²	40	70.6 Å²	70.6	21%	0.209	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.1	170.4	-64.2	176.3	0	0	0	108.6	W244 L625 F627	L211-W244 HydrophobicContact CD1-CD2 3.69Å; L211-W244 HydrophobicContact CD1-CE3 4.13Å; L211-W244 HydrophobicContact CD1-CG 3.9Å; L211-W244 HydrophobicContact CD1-CZ2 4.46Å; L211-L625 HydrophobicContact CB-CB 4.32Å; L211-L625 PolarHBondContact N-O 2.99Å; L211-L625 PolarHBondContact O-N 3.38Å; L211-F627 HydrophobicContact CB-CE2 4.41Å; L211-F627 HydrophobicContact CD1-CE2 3.65Å; L211-F627 HydrophobicContact CD1-CZ 3.83Å; L211-F627 HydrophobicContact CG-CE2 3.8Å; L211-F627 HydrophobicContact CG-CZ 4.48Å
212	D	97.9	Very high	95.7	Very high	141 Å²	141	66.7 Å²	66.7	75%	0.754	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	140.4	173.1	-53.6	-37	0	0	0	109.6
213	A	97.6	Very high	96.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.			trans	-137.3	65.7	-177.9	0	0	0	0	0	109.6	L216 L237 E623 L625	A213-L216 HydrophobicContact CB-CB 4.15Å; A213-L216 HydrophobicContact CB-CD2 3.98Å; A213-L216 WeakPolarHBondContact O-CB 3.45Å; A213-L216 PolarHBondContact O-N 2.77Å; A213-L237 HydrophobicContact CB-CD2 3.97Å; A213-E623 PolarHBondContact N-O 2.83Å; A213-E623 WeakPolarHBondContact O-CA 3.46Å; A213-E623 WeakPolarHBondContact O-CB 3.3Å; A213-L625 HydrophobicContact CB-CD1 4.12Å; A213-L625 HydrophobicContact CB-CG 3.9Å
214	P	97.3	Very high	96.8	Very high	71 Å²	71	58.1 Å²	58.1	46%	0.461	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	145.5	-179.9	27.7	-36	0	0	0	110.9	L216 L237 E623	P214-L216 PolarHBondContact O-N 3.08Å; P214-L216 VanDerWaalsContact O-N 3.16Å; P214-L237 WeakPolarHBondContact O-CB 3.41Å; P214-L237 WeakPolarHBondContact O-CD2 3.36Å; P214-E623 WeakPolarHBondContact CA-OE1 3.47Å
215	E	94.9	Very high	97.1	Very high	122 Å²	122	56 Å²	56	57%	0.57	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	14.7	-178	-50.9	-174.8	173.2	0	0	115.2	Q217 G238 E623	E215-Q217 PolarHBondContact O-N 2.9Å; E215-Q217 VanDerWaalsContact O-N 3.13Å; E215-Q217 PolarHBondContact O-NE2 3.23Å; E215-G238 PolarHBondContact O-N 3.07Å; E215-E623 PolarHBondContact N-OE1 3.41Å
216	L	97.5	Very high	97.3	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.037	26%	0.262	C	S	.	.			trans	-65.5	111	169.9	-176.3	62.7	0	0	0	109.5	A213 P214 L224 L237 Y606 L625	A213-L216 HydrophobicContact CB-CB 4.15Å; A213-L216 HydrophobicContact CB-CD2 3.98Å; A213-L216 WeakPolarHBondContact O-CB 3.45Å; A213-L216 PolarHBondContact O-N 2.77Å; P214-L216 PolarHBondContact O-N 3.08Å; P214-L216 VanDerWaalsContact O-N 3.16Å; L216-L224 HydrophobicContact CD1-CB 4.15Å; L216-L224 HydrophobicContact CD1-CD1 4.08Å; L216-L237 HydrophobicContact CB-CD2 3.75Å; L216-L237 HydrophobicContact CD1-CD2 4.05Å; L216-L237 HydrophobicContact CG-CD2 4.43Å; L216-Y606 HydrophobicContact CD1-CD2 3.92Å; L216-Y606 HydrophobicContact CD1-CE2 3.69Å; L216-Y606 HydrophobicContact CD2-CD2 3.95Å; L216-Y606 HydrophobicContact CD2-CE2 4.19Å; L216-Y606 HydrophobicContact CG-CD2 4.06Å; L216-Y606 HydrophobicContact CG-CE2 3.79Å; L216-L625 HydrophobicContact CD2-CD2 4.48Å
217	Q	96.9	Very high	97.5	Very high	71 Å²	71	47 Å²	47	33%	0.332	24%	0.237	S	C	.	.			trans	-63.3	140	-169.8	-60.4	-62.9	-64.6	0	0	112.7	E215 D219 L222 L224 Y606	E215-Q217 PolarHBondContact O-N 2.9Å; E215-Q217 VanDerWaalsContact O-N 3.13Å; E215-Q217 PolarHBondContact O-NE2 3.23Å; Q217-D219 VanDerWaalsContact C-N 3.28Å; Q217-D219 PolarHBondContact O-N 2.87Å; Q217-L222 HydrophobicContact CB-CD1 3.99Å; Q217-L222 HydrophobicContact CG-CD1 4.35Å; Q217-L224 HydrophobicContact CB-CD1 4.05Å; Q217-L224 HydrophobicContact CG-CD1 4.29Å; Q217-Y606 WeakPolarHBondContact O-CE2 3.3Å; Q217-Y606 PolarHBondContact O-OH 3.07Å
218	D	96.5	Very high	97.6	Very high	51 Å²	51	45.8 Å²	45.8	27%	0.273	23%	0.229	S	C	.	.			trans	-91	55	171.3	-169.2	12.8	0	0	0	110.9	R603 L605	D218-R603 PolarHBondContact O-NH2 3.04Å; D218-R603 IonicContact OD1-CZ 2.79Å; D218-R603 VanDerWaalsContact OD1-CZ 3.32Å; D218-R603 IonicContact OD1-NE 2.76Å; D218-R603 PolarHBondContact OD1-NE 2.92Å; D218-R603 IonicContact OD1-NH2 3.55Å; D218-R603 PolarHBondContact OD1-NH2 3.02Å; D218-R603 IonicContact OD2-NE 3.23Å; D218-R603 IonicContact OD2-NH2 3.9Å; D218-L605 VanDerWaalsContact OD1-CD1 3.3Å; D218-L605 WeakPolarHBondContact OD1-CD1 3.35Å
219	D	97.3	Very high	97.6	Very high	35 Å²	35	43.2 Å²	43.2	19%	0.187	23%	0.229	C	C	.	.			trans	-117	117.7	176.7	-174.3	-21	0	0	0	111.3	Q217 Y221 L222 Y281 R305 Y606	Q217-D219 VanDerWaalsContact C-N 3.28Å; Q217-D219 PolarHBondContact O-N 2.87Å; D219-Y221 VanDerWaalsContact C-N 3.26Å; D219-Y221 PolarHBondContact O-N 2.9Å; D219-Y221 VanDerWaalsContact OD1-CD2 3.26Å; D219-Y221 WeakPolarHBondContact OD1-CD2 3.46Å; D219-Y221 PolarHBondContact OD1-N 3Å; D219-L222 HydrophobicContact CB-CD1 3.86Å; D219-L222 HydrophobicContact CB-CG 3.84Å; D219-L222 PolarHBondContact O-N 3.27Å; D219-Y281 PolarHBondContact OD2-OH 3.37Å; D219-R305 IonicContact OD2-CZ 3.74Å; D219-R305 IonicContact OD2-NH1 2.86Å; D219-R305 PolarHBondContact OD2-NH1 2.76Å; D219-R305 IonicContact OD2-NH2 3.84Å; D219-Y606 PolarHBondContact O-OH 2.95Å
220	F	97.6	Very high	97.6	Very high	7 Å²	7	44.6 Å²	44.6	3%	0.031	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.2	-179	-179.1	-98.5	0	0	0	113.2	L222 A515 K517 Q559 C561 L605	F220-L222 VanDerWaalsContact C-N 3.28Å; F220-L222 PolarHBondContact O-N 3.31Å; F220-A515 HydrophobicContact CE1-CB 4.03Å; F220-K517 HydrophobicContact CD1-CD 4.3Å; F220-K517 HydrophobicContact CD2-CD 4.11Å; F220-K517 HydrophobicContact CE1-CB 3.64Å; F220-K517 HydrophobicContact CE1-CD 4.08Å; F220-K517 HydrophobicContact CE1-CG 4.47Å; F220-K517 HydrophobicContact CE2-CB 4.35Å; F220-K517 HydrophobicContact CE2-CD 3.89Å; F220-K517 HydrophobicContact CG-CD 4.31Å; F220-K517 HydrophobicContact CZ-CB 3.54Å; F220-K517 HydrophobicContact CZ-CD 3.88Å; F220-K517 HydrophobicContact CZ-CG 4.38Å; F220-K517 WeakPolarHBondContact O-CD 3.43Å; F220-K517 WeakPolarHBondContact O-CE 3.38Å; F220-K517 PolarHBondContact O-NZ 3.28Å; F220-Q559 HydrophobicContact CD2-CG 4.37Å; F220-Q559 VanDerWaalsContact CD2-NE2 3.27Å; F220-Q559 HydrophobicContact CE2-CG 3.8Å; F220-Q559 VanDerWaalsContact CE2-NE2 3.33Å; F220-Q559 HydrophobicContact CZ-CG 4.47Å; F220-C561 HydrophobicContact CE2-CB 4.36Å; F220-L605 HydrophobicContact CB-CD2 4.38Å; F220-L605 HydrophobicContact CD2-CD2 4.12Å
221	Y	98.3	Very high	97.6	Very high	45 Å²	45	42 Å²	42	18%	0.176	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-11.1	-171.9	-56.4	-75.1	0	0	0	113.7	D219 C472 N488 A515	D219-Y221 VanDerWaalsContact C-N 3.26Å; D219-Y221 PolarHBondContact O-N 2.9Å; D219-Y221 VanDerWaalsContact OD1-CD2 3.26Å; D219-Y221 WeakPolarHBondContact OD1-CD2 3.46Å; D219-Y221 PolarHBondContact OD1-N 3Å; Y221-C472 HydrophobicContact CD1-CB 3.88Å; Y221-N488 HydrophobicContact CE1-CB 3.92Å; Y221-N488 VanDerWaalsContact CE1-OD1 3.31Å; Y221-N488 WeakPolarHBondContact CE1-OD1 3.46Å; Y221-N488 PolarHBondContact OH-OD1 3.2Å; Y221-A515 HydrophobicContact CE1-CB 4.36Å
222	L	98.4	Very high	97.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.			trans	-88.1	156.4	-177.9	-50.3	-174.2	0	0	0	112.7	Q217 D219 F220 L224 S265 Y281 K517 Y606	Q217-L222 HydrophobicContact CB-CD1 3.99Å; Q217-L222 HydrophobicContact CG-CD1 4.35Å; D219-L222 HydrophobicContact CB-CD1 3.86Å; D219-L222 HydrophobicContact CB-CG 3.84Å; D219-L222 PolarHBondContact O-N 3.27Å; F220-L222 VanDerWaalsContact C-N 3.28Å; F220-L222 PolarHBondContact O-N 3.31Å; L222-L224 HydrophobicContact CB-CD1 4.38Å; L222-L224 HydrophobicContact CB-CD2 4.1Å; L222-L224 HydrophobicContact CB-CG 3.91Å; L222-L224 HydrophobicContact CD1-CD1 4Å; L222-L224 HydrophobicContact CD1-CD2 4.34Å; L222-L224 HydrophobicContact CD1-CG 4.33Å; L222-S265 WeakPolarHBondContact CA-O 3.38Å; L222-S265 WeakPolarHBondContact CB-O 3.24Å; L222-Y281 HydrophobicContact CD1-CE2 3.94Å; L222-Y281 WeakPolarHBondContact CD1-OH 3.43Å; L222-Y281 HydrophobicContact CD2-CE2 3.83Å; L222-K517 PolarHBondContact O-NZ 2.9Å; L222-Y606 HydrophobicContact CB-CE1 4.46Å; L222-Y606 WeakPolarHBondContact O-CE1 3.46Å
223	N	98.5	Very high	97.6	Very high	38 Å²	38	34.3 Å²	34.3	20%	0.203	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-129.2	76.4	177.1	-69.8	-67.6	0	0	0	110.1	S265 S266 V267 G307 C472 K517	N223-S265 PolarHBondContact N-O 3.32Å; N223-S265 VanDerWaalsContact N-O 3.14Å; N223-S266 CarbonylContact O-C 3.56Å; N223-S266 VanDerWaalsContact O-CA 3.27Å; N223-S266 WeakPolarHBondContact O-CA 3.42Å; N223-V267 PolarHBondContact O-N 3.27Å; N223-G307 PolarHBondContact N-O 3.13Å; N223-G307 PolarHBondContact ND2-O 2.85Å; N223-C472 PolarHBondContact ND2-O 3.01Å; N223-K517 PolarHBondContact OD1-NZ 3.3Å
224	L	98.5	Very high	97.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.18	C	C	.	.			trans	-92	1.9	-164.5	-58.7	-176.1	0	0	0	116.1	L216 Q217 L222 V235 G236 I264 V267 Y606	L216-L224 HydrophobicContact CD1-CB 4.15Å; L216-L224 HydrophobicContact CD1-CD1 4.08Å; Q217-L224 HydrophobicContact CB-CD1 4.05Å; Q217-L224 HydrophobicContact CG-CD1 4.29Å; L222-L224 HydrophobicContact CB-CD1 4.38Å; L222-L224 HydrophobicContact CB-CD2 4.1Å; L222-L224 HydrophobicContact CB-CG 3.91Å; L222-L224 HydrophobicContact CD1-CD1 4Å; L222-L224 HydrophobicContact CD1-CD2 4.34Å; L222-L224 HydrophobicContact CD1-CG 4.33Å; L224-V235 CarbonylContact O-C 3.58Å; L224-V235 WeakPolarHBondContact O-CA 3.41Å; L224-G236 PolarHBondContact O-N 2.79Å; L224-I264 HydrophobicContact CD2-CG2 4.11Å; L224-I264 WeakPolarHBondContact CD2-O 3.44Å; L224-V267 VanDerWaalsContact C-CG2 3.48Å; L224-V267 WeakPolarHBondContact O-CG2 3.42Å; L224-Y606 HydrophobicContact CB-CD1 4.21Å; L224-Y606 HydrophobicContact CB-CE1 3.87Å; L224-Y606 HydrophobicContact CD1-CE1 4.37Å; L224-Y606 HydrophobicContact CD1-CE2 4.5Å; L224-Y606 HydrophobicContact CG-CE1 3.92Å
225	V	98.6	Very high	97.7	Very high	13 Å²	13	31.3 Å²	31.3	8%	0.079	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	126.9	-177.2	-175.9	0	0	0	0	110.2	L233 A234 V235 Y606 A608 V617 L625	V225-L233 HydrophobicContact CG1-CD1 3.75Å; V225-L233 HydrophobicContact CG1-CG 4.4Å; V225-A234 WeakPolarHBondContact CA-O 3.49Å; V225-V235 HydrophobicContact CG2-CG1 4.39Å; V225-Y606 HydrophobicContact CG2-CD2 4.43Å; V225-Y606 HydrophobicContact CG2-CG 3.96Å; V225-A608 HydrophobicContact CG1-CB 4.32Å; V225-V617 HydrophobicContact CG1-CG1 4.15Å; V225-L625 HydrophobicContact CG1-CD2 4.43Å; V225-L625 HydrophobicContact CG2-CD2 3.98Å
226	D	98.6	Very high	97.9	Very high	46 Å²	46	25.6 Å²	25.6	25%	0.246	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.5	172.6	-169.1	24.4	0	0	0	111.7	A234 V267 A268 W269	D226-A234 PolarHBondContact N-O 3.07Å; D226-A234 VanDerWaalsContact N-O 3.13Å; D226-A234 PolarHBondContact O-N 3.21Å; D226-V267 HydrophobicContact CB-CG2 4.27Å; D226-A268 WeakPolarHBondContact OD2-CA 3.41Å; D226-W269 PolarHBondContact O-NE1 3.05Å; D226-W269 PolarHBondContact OD2-N 3.16Å
227	W	98.4	Very high	97.9	Very high	18 Å²	18	26 Å²	26	7%	0.068	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.1	-171.8	-159.7	-24.6	0	0	0	110.7	N231 L233 W244 A246 A608 I609 V617 F627	W227-N231 WeakPolarHBondContact CZ2-OD1 3.18Å; W227-N231 PolarHBondContact NE1-OD1 2.96Å; W227-L233 HydrophobicContact CB-CD1 3.82Å; W227-L233 HydrophobicContact CD2-CD1 4.18Å; W227-L233 HydrophobicContact CE3-CD1 4.34Å; W227-L233 HydrophobicContact CG-CD1 3.99Å; W227-W244 HydrophobicContact CZ2-CZ3 4.48Å; W227-A246 HydrophobicContact CZ2-CB 3.9Å; W227-A608 HydrophobicContact CB-CB 3.86Å; W227-I609 WeakPolarHBondContact CB-O 3.32Å; W227-V617 HydrophobicContact CE3-CB 4.21Å; W227-V617 HydrophobicContact CE3-CG1 3.72Å; W227-V617 HydrophobicContact CZ3-CB 4Å; W227-V617 HydrophobicContact CZ3-CG1 4.05Å; W227-F627 AromaticContact CH2-CD1 3.75Å; W227-F627 HydrophobicContact CH2-CD1 3.75Å; W227-F627 AromaticContact CH2-CE1 3.75Å; W227-F627 HydrophobicContact CH2-CE1 3.75Å; W227-F627 HydrophobicContact CZ2-CE1 4.45Å; W227-F627 AromaticContact CZ3-CD1 3.89Å; W227-F627 HydrophobicContact CZ3-CD1 3.89Å; W227-F627 AromaticContact CZ3-CE1 3.88Å; W227-F627 HydrophobicContact CZ3-CE1 3.88Å
228	S	97.9	Very high	97.9	Very high	1 Å²	1	23 Å²	23	1%	0.007	12%	0.124	C	C	.	.			trans	-71.4	156.1	-173.9	90.5	0	0	0	0	113.6	Q230 N231 V232 W269	S228-Q230 PolarHBondContact O-N 3.17Å; S228-Q230 VanDerWaalsContact O-N 3.1Å; S228-Q230 WeakPolarHBondContact OG-CA 3.44Å; S228-Q230 PolarHBondContact OG-N 3.27Å; S228-N231 PolarHBondContact O-N 2.94Å; S228-N231 PolarHBondContact OG-N 3.16Å; S228-V232 WeakPolarHBondContact CB-O 3.33Å; S228-V232 PolarHBondContact N-O 3Å; S228-V232 PolarHBondContact OG-N 2.68Å; S228-V232 VanDerWaalsContact OG-N 3.09Å; S228-V232 PolarHBondContact OG-O 2.92Å; S228-W269 VanDerWaalsContact CB-CE2 3.49Å
229	S	96.6	Very high	97.9	Very high	67 Å²	67	22.4 Å²	22.4	47%	0.469	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17	168.1	62.6	0	0	0	0	113.8	N231 K271 K272 G273	S229-N231 VanDerWaalsContact C-N 3.33Å; S229-K271 PolarHBondContact OG-O 3.15Å; S229-K272 PolarHBondContact OG-O 2.92Å; S229-G273 PolarHBondContact OG-N 3.44Å; S229-G273 VanDerWaalsContact OG-N 3.15Å
230	Q	96.9	Very high	97.9	Very high	94 Å²	94	21.2 Å²	21.2	44%	0.439	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	11.3	176.4	-59.4	-177.3	8.1	0	0	112.5	S228 V232 K272	S228-Q230 PolarHBondContact O-N 3.17Å; S228-Q230 VanDerWaalsContact O-N 3.1Å; S228-Q230 WeakPolarHBondContact OG-CA 3.44Å; S228-Q230 PolarHBondContact OG-N 3.27Å; Q230-V232 VanDerWaalsContact C-N 3.34Å; Q230-V232 PolarHBondContact O-N 2.86Å; Q230-K272 PolarHBondContact NE2-O 3.1Å
231	N	97.2	Very high	97.9	Very high	14 Å²	14	20.9 Å²	20.9	8%	0.075	12%	0.115	C	C	.	.	S	Bend	trans	65	32.7	179.4	-151.7	18.3	0	0	0	114.3	W227 S228 S229 A246 F247 P611	W227-N231 WeakPolarHBondContact CZ2-OD1 3.18Å; W227-N231 PolarHBondContact NE1-OD1 2.96Å; S228-N231 PolarHBondContact O-N 2.94Å; S228-N231 PolarHBondContact OG-N 3.16Å; S229-N231 VanDerWaalsContact C-N 3.33Å; N231-A246 WeakPolarHBondContact O-CB 3.44Å; N231-A246 PolarHBondContact O-N 2.79Å; N231-A246 WeakPolarHBondContact OD1-CB 3.28Å; N231-F247 HydrophobicContact CB-CD2 3.81Å; N231-F247 HydrophobicContact CB-CE2 3.31Å; N231-F247 HydrophobicContact CB-CZ 3.83Å; N231-F247 VanDerWaalsContact ND2-CE1 3.33Å; N231-F247 WeakPolarHBondContact ND2-CE1 3.5Å; N231-F247 WeakPolarHBondContact ND2-CE2 3.19Å; N231-F247 WeakPolarHBondContact ND2-CZ 3.42Å; N231-P611 HydrophobicContact CB-CG 3.84Å; N231-P611 WeakPolarHBondContact OD1-CD 3.42Å
232	V	98	Very high	97.9	Very high	20 Å²	20	22.6 Å²	22.6	12%	0.121	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.9	173.6	-175.4	0	0	0	0	108.9	S228 Q230 L243 W244 N245 W269	S228-V232 WeakPolarHBondContact CB-O 3.33Å; S228-V232 PolarHBondContact N-O 3Å; S228-V232 PolarHBondContact OG-N 2.68Å; S228-V232 VanDerWaalsContact OG-N 3.09Å; S228-V232 PolarHBondContact OG-O 2.92Å; Q230-V232 VanDerWaalsContact C-N 3.34Å; Q230-V232 PolarHBondContact O-N 2.86Å; V232-L243 HydrophobicContact CG1-CB 3.96Å; V232-L243 HydrophobicContact CG1-CD2 4.5Å; V232-W244 WeakPolarHBondContact CA-O 3.46Å; V232-N245 HydrophobicContact CG2-CB 4.46Å; V232-W269 HydrophobicContact CB-CH2 4.14Å; V232-W269 HydrophobicContact CB-CZ2 4.05Å; V232-W269 HydrophobicContact CG1-CH2 4.02Å; V232-W269 HydrophobicContact CG1-CZ2 3.9Å; V232-W269 WeakPolarHBondContact O-CZ2 3.45Å; V232-W269 PolarHBondContact O-NE1 2.79Å
233	L	98.5	Very high	97.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.3	174	-172.1	67.9	0	0	0	109.5	V225 W227 V235 L243 W244 V617 L625 F627	V225-L233 HydrophobicContact CG1-CD1 3.75Å; V225-L233 HydrophobicContact CG1-CG 4.4Å; W227-L233 HydrophobicContact CB-CD1 3.82Å; W227-L233 HydrophobicContact CD2-CD1 4.18Å; W227-L233 HydrophobicContact CE3-CD1 4.34Å; W227-L233 HydrophobicContact CG-CD1 3.99Å; L233-V235 HydrophobicContact CD2-CG2 3.94Å; L233-V235 HydrophobicContact CG-CG2 3.94Å; L233-L243 CarbonylContact O-C 3.48Å; L233-L243 VanDerWaalsContact O-CA 3.28Å; L233-L243 WeakPolarHBondContact O-CA 3.29Å; L233-W244 HydrophobicContact CB-CB 4.42Å; L233-W244 HydrophobicContact CB-CE3 3.99Å; L233-W244 HydrophobicContact CD2-CE3 4.28Å; L233-W244 PolarHBondContact N-O 3.46Å; L233-W244 PolarHBondContact O-N 2.75Å; L233-V617 HydrophobicContact CD1-CG1 3.7Å; L233-V617 HydrophobicContact CD2-CG1 4.29Å; L233-V617 HydrophobicContact CD2-CG2 4.21Å; L233-L625 HydrophobicContact CD2-CD1 4.24Å; L233-F627 HydrophobicContact CD2-CE1 4.28Å; L233-F627 HydrophobicContact CD2-CZ 3.85Å
234	A	98.7	Very high	97.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137	168.3	0	0	0	0	0	109.7	V225 D226 Y242 L243 V267 W269 L276	V225-A234 WeakPolarHBondContact CA-O 3.49Å; D226-A234 PolarHBondContact N-O 3.07Å; D226-A234 VanDerWaalsContact N-O 3.13Å; D226-A234 PolarHBondContact O-N 3.21Å; A234-Y242 WeakPolarHBondContact CA-O 3.34Å; A234-L243 HydrophobicContact CB-CD2 3.74Å; A234-V267 HydrophobicContact CB-CG2 4.43Å; A234-W269 HydrophobicContact CB-CZ2 3.79Å; A234-L276 HydrophobicContact CB-CD1 3.89Å; A234-L276 HydrophobicContact CB-CD2 3.84Å
235	V	98.6	Very high	97.8	Very high	8 Å²	8	23.8 Å²	23.8	5%	0.048	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	121.6	-176.6	-171.2	0	0	0	0	109.4	L224 V225 L233 L237 V241 Y242 L625	L224-V235 CarbonylContact O-C 3.58Å; L224-V235 WeakPolarHBondContact O-CA 3.41Å; V225-V235 HydrophobicContact CG2-CG1 4.39Å; L233-V235 HydrophobicContact CD2-CG2 3.94Å; L233-V235 HydrophobicContact CG-CG2 3.94Å; V235-L237 HydrophobicContact CG1-CD2 3.58Å; V235-L237 HydrophobicContact CG1-CG 3.91Å; V235-V241 WeakPolarHBondContact O-CA 3.39Å; V235-Y242 PolarHBondContact N-O 3.46Å; V235-Y242 PolarHBondContact O-N 3.46Å; V235-L625 HydrophobicContact CB-CD1 4.44Å; V235-L625 HydrophobicContact CG1-CD1 3.98Å; V235-L625 HydrophobicContact CG2-CD1 3.61Å
236	G	98.2	Very high	97.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.7	169.1	0	0	0	0	0	110.9	L224 C240	L224-G236 PolarHBondContact O-N 2.79Å; G236-C240 WeakPolarHBondContact CA-O 3.47Å
237	L	97.8	Very high	97.5	Very high	17 Å²	17	29.6 Å²	29.6	9%	0.089	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	110.1	177.7	-59.8	-176	0	0	0	108	A213 P214 L216 V235 T239 C240 Y242	A213-L237 HydrophobicContact CB-CD2 3.97Å; P214-L237 WeakPolarHBondContact O-CB 3.41Å; P214-L237 WeakPolarHBondContact O-CD2 3.36Å; L216-L237 HydrophobicContact CB-CD2 3.75Å; L216-L237 HydrophobicContact CD1-CD2 4.05Å; L216-L237 HydrophobicContact CG-CD2 4.43Å; V235-L237 HydrophobicContact CG1-CD2 3.58Å; V235-L237 HydrophobicContact CG1-CG 3.91Å; L237-T239 PolarHBondContact O-N 3.03Å; L237-T239 VanDerWaalsContact O-N 3.11Å; L237-C240 PolarHBondContact N-O 2.84Å; L237-C240 PolarHBondContact O-N 2.76Å; L237-Y242 HydrophobicContact CB-CD2 4.09Å; L237-Y242 HydrophobicContact CB-CE2 4.16Å; L237-Y242 HydrophobicContact CD1-CD2 3.72Å; L237-Y242 HydrophobicContact CD1-CE2 4.06Å; L237-Y242 HydrophobicContact CD1-CG 4.45Å; L237-Y242 HydrophobicContact CG-CD2 4.05Å
238	G	96	Very high	97.4	Very high	7 Å²	7	33 Å²	33	7%	0.072	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	-115.1	-174.2	0	0	0	0	0	113.3	E215 I264	E215-G238 PolarHBondContact O-N 3.07Å; G238-I264 PolarHBondContact O-N 2.92Å; G238-I264 VanDerWaalsContact O-N 3.14Å
239	T	96.8	Very high	97.3	Very high	39 Å²	39	35.6 Å²	35.6	24%	0.239	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-7	178.1	68.2	0	0	0	0	113.8	L237 D256 V257 D262	L237-T239 PolarHBondContact O-N 3.03Å; L237-T239 VanDerWaalsContact O-N 3.11Å; T239-D256 WeakPolarHBondContact CB-OD1 3.2Å; T239-D256 WeakPolarHBondContact O-CA 3.3Å; T239-D256 PolarHBondContact OG1-OD1 3.4Å; T239-V257 VanDerWaalsContact O-CG2 3.32Å; T239-V257 WeakPolarHBondContact O-CG2 3.48Å; T239-V257 PolarHBondContact O-N 2.77Å; T239-D262 WeakPolarHBondContact CG2-O 3.24Å
240	C	97.5	Very high	97.3	Very high	10 Å²	10	38.2 Å²	38.2	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	151.7	-170.5	-71.7	0	0	0	0	112.4	G236 L237 Y242 C255	G236-C240 WeakPolarHBondContact CA-O 3.47Å; L237-C240 PolarHBondContact N-O 2.84Å; L237-C240 PolarHBondContact O-N 2.76Å; C240-Y242 HydrophobicContact CB-CD2 4.03Å; C240-Y242 HydrophobicContact CB-CE2 3.44Å; C240-Y242 VanDerWaalsContact CB-CE2 3.44Å; C240-C255 WeakPolarHBondContact CA-O 3.48Å
241	V	98.2	Very high	97.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.7	162.3	179	0	0	0	0	109.8	V235 L254 C255 I264 V267 L276 I278	V235-V241 WeakPolarHBondContact O-CA 3.39Å; V241-L254 PolarHBondContact O-N 3.49Å; V241-C255 PolarHBondContact N-O 3.14Å; V241-I264 HydrophobicContact CG2-CD1 3.95Å; V241-I264 HydrophobicContact CG2-CG1 3.84Å; V241-I264 HydrophobicContact CG2-CG2 3.99Å; V241-V267 HydrophobicContact CG1-CG1 4.35Å; V241-V267 HydrophobicContact CG2-CG1 4.07Å; V241-L276 HydrophobicContact CG1-CD2 3.92Å; V241-I278 HydrophobicContact CB-CD1 4.3Å; V241-I278 HydrophobicContact CG2-CD1 3.95Å; V241-I278 HydrophobicContact CG2-CG1 4.5Å; V241-I278 HydrophobicContact CG2-CG2 4.1Å
242	Y	98.4	Very high	97.3	Very high	80 Å²	80	40.1 Å²	40.1	31%	0.314	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.4	175.5	-69.1	-92.5	0	0	0	110.5	A234 V235 L237 C240 V251 T252 R253	A234-Y242 WeakPolarHBondContact CA-O 3.34Å; V235-Y242 PolarHBondContact N-O 3.46Å; V235-Y242 PolarHBondContact O-N 3.46Å; L237-Y242 HydrophobicContact CB-CD2 4.09Å; L237-Y242 HydrophobicContact CB-CE2 4.16Å; L237-Y242 HydrophobicContact CD1-CD2 3.72Å; L237-Y242 HydrophobicContact CD1-CE2 4.06Å; L237-Y242 HydrophobicContact CD1-CG 4.45Å; L237-Y242 HydrophobicContact CG-CD2 4.05Å; C240-Y242 HydrophobicContact CB-CD2 4.03Å; C240-Y242 HydrophobicContact CB-CE2 3.44Å; C240-Y242 VanDerWaalsContact CB-CE2 3.44Å; Y242-V251 HydrophobicContact CD1-CG1 4.11Å; Y242-T252 WeakPolarHBondContact CA-O 3.11Å; Y242-R253 HydrophobicContact CD1-CB 4.05Å; Y242-R253 HydrophobicContact CD1-CG 4.45Å; Y242-R253 HydrophobicContact CE1-CB 3.85Å; Y242-R253 HydrophobicContact CE1-CG 4.12Å
243	L	98.3	Very high	97.3	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.6	173.8	-57.2	-177.5	0	0	0	109.2	V232 L233 A234 V251 T252 L254 W269 L276 V290	V232-L243 HydrophobicContact CG1-CB 3.96Å; V232-L243 HydrophobicContact CG1-CD2 4.5Å; L233-L243 CarbonylContact O-C 3.48Å; L233-L243 VanDerWaalsContact O-CA 3.28Å; L233-L243 WeakPolarHBondContact O-CA 3.29Å; A234-L243 HydrophobicContact CB-CD2 3.74Å; L243-V251 CarbonylContact O-C 3.53Å; L243-V251 VanDerWaalsContact O-CA 3.3Å; L243-V251 WeakPolarHBondContact O-CA 3.29Å; L243-T252 PolarHBondContact N-O 2.9Å; L243-T252 PolarHBondContact O-N 2.94Å; L243-L254 HydrophobicContact CD1-CB 4.05Å; L243-L254 HydrophobicContact CD1-CD1 4.21Å; L243-L254 HydrophobicContact CD1-CD2 4.25Å; L243-L254 HydrophobicContact CD1-CG 4.41Å; L243-L254 HydrophobicContact CD2-CD2 4.42Å; L243-L254 HydrophobicContact CG-CB 4.02Å; L243-W269 HydrophobicContact CD2-CH2 4.05Å; L243-W269 HydrophobicContact CD2-CZ2 3.81Å; L243-L276 HydrophobicContact CD2-CD2 4.25Å; L243-V290 HydrophobicContact CD1-CB 4.44Å; L243-V290 HydrophobicContact CD1-CG1 3.47Å; L243-V290 VanDerWaalsContact CD1-CG1 3.47Å; L243-V290 HydrophobicContact CD1-CG2 4.18Å
244	W	98.3	Very high	97.2	Very high	17 Å²	17	46.8 Å²	46.8	6%	0.064	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	117.2	173.6	175.2	71.1	0	0	0	110.3	K209 L211 W227 V232 L233 A246 S249 Q250 F627	K209-W244 HydrophobicContact CD-CH2 4.36Å; K209-W244 HydrophobicContact CD-CZ2 4.17Å; L211-W244 HydrophobicContact CD1-CD2 3.69Å; L211-W244 HydrophobicContact CD1-CE3 4.13Å; L211-W244 HydrophobicContact CD1-CG 3.9Å; L211-W244 HydrophobicContact CD1-CZ2 4.46Å; W227-W244 HydrophobicContact CZ2-CZ3 4.48Å; V232-W244 WeakPolarHBondContact CA-O 3.46Å; L233-W244 HydrophobicContact CB-CB 4.42Å; L233-W244 HydrophobicContact CB-CE3 3.99Å; L233-W244 HydrophobicContact CD2-CE3 4.28Å; L233-W244 PolarHBondContact N-O 3.46Å; L233-W244 PolarHBondContact O-N 2.75Å; W244-A246 HydrophobicContact CE3-CB 4.12Å; W244-A246 VanDerWaalsContact CH2-CA 3.46Å; W244-A246 HydrophobicContact CH2-CB 3.52Å; W244-A246 HydrophobicContact CZ2-CB 4.31Å; W244-A246 HydrophobicContact CZ3-CB 3.4Å; W244-A246 VanDerWaalsContact CZ3-CB 3.4Å; W244-S249 PolarHBondContact NE1-O 3.22Å; W244-Q250 WeakPolarHBondContact CA-O 3.29Å; W244-F627 HydrophobicContact CE3-CE1 4.11Å; W244-F627 AromaticContact CE3-CZ 3.82Å; W244-F627 HydrophobicContact CE3-CZ 3.82Å; W244-F627 HydrophobicContact CH2-CE1 4.06Å; W244-F627 HydrophobicContact CH2-CZ 4.1Å; W244-F627 HydrophobicContact CZ3-CD1 4.39Å; W244-F627 AromaticContact CZ3-CE1 3.4Å; W244-F627 HydrophobicContact CZ3-CE1 3.4Å; W244-F627 VanDerWaalsContact CZ3-CE1 3.4Å; W244-F627 AromaticContact CZ3-CZ 3.48Å; W244-F627 HydrophobicContact CZ3-CZ 3.48Å; W244-F627 VanDerWaalsContact CZ3-CZ 3.48Å
245	N	96.9	Very high	97	Very high	40 Å²	40	47.1 Å²	47.1	21%	0.214	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.3	177.2	-179.2	-34.1	0	0	0	109.6	V232 F247 T248 S249 Q250	V232-N245 HydrophobicContact CG2-CB 4.46Å; N245-F247 VanDerWaalsContact C-N 3.29Å; N245-F247 PolarHBondContact O-N 3.01Å; N245-F247 WeakPolarHBondContact OD1-CB 3.47Å; N245-F247 PolarHBondContact OD1-N 2.75Å; N245-T248 WeakPolarHBondContact CB-OG1 3.37Å; N245-T248 VanDerWaalsContact CG-OG1 3.27Å; N245-T248 PolarHBondContact OD1-N 3.14Å; N245-S249 WeakPolarHBondContact O-CA 3.13Å; N245-S249 PolarHBondContact O-N 2.84Å; N245-Q250 PolarHBondContact N-O 2.9Å
246	A	95.7	Very high	96.8	Very high	24 Å²	24	49.8 Å²	49.8	20%	0.198	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-18.4	-174	0	0	0	0	0	114.4	W227 N231 W244	W227-A246 HydrophobicContact CZ2-CB 3.9Å; N231-A246 WeakPolarHBondContact O-CB 3.44Å; N231-A246 PolarHBondContact O-N 2.79Å; N231-A246 WeakPolarHBondContact OD1-CB 3.28Å; W244-A246 HydrophobicContact CE3-CB 4.12Å; W244-A246 VanDerWaalsContact CH2-CA 3.46Å; W244-A246 HydrophobicContact CH2-CB 3.52Å; W244-A246 HydrophobicContact CZ2-CB 4.31Å; W244-A246 HydrophobicContact CZ3-CB 3.4Å; W244-A246 VanDerWaalsContact CZ3-CB 3.4Å
247	F	94.5	Very high	96.6	Very high	158 Å²	158	50 Å²	50	69%	0.693	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-48.7	173.8	-64.7	-64.1	0	0	0	112	N231 N245	N231-F247 HydrophobicContact CB-CD2 3.81Å; N231-F247 HydrophobicContact CB-CE2 3.31Å; N231-F247 HydrophobicContact CB-CZ 3.83Å; N231-F247 VanDerWaalsContact ND2-CE1 3.33Å; N231-F247 WeakPolarHBondContact ND2-CE1 3.5Å; N231-F247 WeakPolarHBondContact ND2-CE2 3.19Å; N231-F247 WeakPolarHBondContact ND2-CZ 3.42Å; N245-F247 VanDerWaalsContact C-N 3.29Å; N245-F247 PolarHBondContact O-N 3.01Å; N245-F247 WeakPolarHBondContact OD1-CB 3.47Å; N245-F247 PolarHBondContact OD1-N 2.75Å
248	T	96.5	Very high	96.1	Very high	89 Å²	89	52 Å²	52	55%	0.546	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-12.6	-175.3	63.2	0	0	0	0	113.5	N245 Q250	N245-T248 WeakPolarHBondContact CB-OG1 3.37Å; N245-T248 VanDerWaalsContact CG-OG1 3.27Å; N245-T248 PolarHBondContact OD1-N 3.14Å; T248-Q250 PolarHBondContact O-N 2.81Å; T248-Q250 VanDerWaalsContact O-N 3.17Å; T248-Q250 VanDerWaalsContact OG1-CB 3.27Å; T248-Q250 WeakPolarHBondContact OG1-CB 3.23Å; T248-Q250 PolarHBondContact OG1-N 3.4Å
249	S	95.8	Very high	95.5	Very high	56 Å²	56	55.4 Å²	55.4	39%	0.392	31%	0.31	S	S	.	.			trans	56.5	13.5	-165.6	-65.6	0	0	0	0	115.3	K209 W244 N245	K209-S249 PolarHBondContact NZ-OG 2.99Å; W244-S249 PolarHBondContact NE1-O 3.22Å; N245-S249 WeakPolarHBondContact O-CA 3.13Å; N245-S249 PolarHBondContact O-N 2.84Å
250	Q	96.9	Very high	95	Very high	121 Å²	121	57.7 Å²	57.7	57%	0.565	32%	0.318	S	S	*	.			trans	-67.6	136.8	176.2	-172.6	-179.4	21	0	0	110.9	W244 N245 T248 T252	W244-Q250 WeakPolarHBondContact CA-O 3.29Å; N245-Q250 PolarHBondContact N-O 2.9Å; T248-Q250 PolarHBondContact O-N 2.81Å; T248-Q250 VanDerWaalsContact O-N 3.17Å; T248-Q250 VanDerWaalsContact OG1-CB 3.27Å; T248-Q250 WeakPolarHBondContact OG1-CB 3.23Å; T248-Q250 PolarHBondContact OG1-N 3.4Å; Q250-T252 HydrophobicContact CG-CG2 4.35Å
251	V	97.2	Very high	94.6	Very high	90 Å²	90	62.4 Å²	62.4	55%	0.545	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135.1	170	179.7	0	0	0	0	109.1	Y242 L243	Y242-V251 HydrophobicContact CD1-CG1 4.11Å; L243-V251 CarbonylContact O-C 3.53Å; L243-V251 VanDerWaalsContact O-CA 3.3Å; L243-V251 WeakPolarHBondContact O-CA 3.29Å
252	T	96.9	Very high	94.4	Very high	59 Å²	59	62.6 Å²	62.6	36%	0.362	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.6	168.2	59.6	0	0	0	0	110.2	Y242 L243 Q250	Y242-T252 WeakPolarHBondContact CA-O 3.11Å; L243-T252 PolarHBondContact N-O 2.9Å; L243-T252 PolarHBondContact O-N 2.94Å; Q250-T252 HydrophobicContact CG-CG2 4.35Å
253	R	97.1	Very high	94.3	Very high	146 Å²	146	60.9 Å²	60.9	55%	0.551	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.7	167.6	-176.2	174.6	62.8	166.7	2.1	107.6	Y242 D256	Y242-R253 HydrophobicContact CD1-CB 4.05Å; Y242-R253 HydrophobicContact CD1-CG 4.45Å; Y242-R253 HydrophobicContact CE1-CB 3.85Å; Y242-R253 HydrophobicContact CE1-CG 4.12Å; R253-D256 IonicContact NH1-OD2 2.71Å
254	L	96.5	Very high	94.3	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.068	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-49	-178.5	177.1	66.5	0	0	0	111.3	V241 L243 L276 I278 W288 V290	V241-L254 PolarHBondContact O-N 3.49Å; L243-L254 HydrophobicContact CD1-CB 4.05Å; L243-L254 HydrophobicContact CD1-CD1 4.21Å; L243-L254 HydrophobicContact CD1-CD2 4.25Å; L243-L254 HydrophobicContact CD1-CG 4.41Å; L243-L254 HydrophobicContact CD2-CD2 4.42Å; L243-L254 HydrophobicContact CG-CB 4.02Å; L254-L276 HydrophobicContact CD2-CD2 3.71Å; L254-I278 HydrophobicContact CD2-CD1 4.22Å; L254-W288 HydrophobicContact CD1-CE3 3.82Å; L254-W288 HydrophobicContact CD1-CZ3 4.47Å; L254-W288 HydrophobicContact CD2-CB 4.04Å; L254-W288 HydrophobicContact CD2-CD2 4.41Å; L254-W288 HydrophobicContact CD2-CE3 4.49Å; L254-W288 HydrophobicContact CD2-CG 4.23Å; L254-W288 HydrophobicContact CG-CD2 4.23Å; L254-W288 HydrophobicContact CG-CE3 3.88Å; L254-W288 HydrophobicContact CG-CZ3 4.48Å; L254-W288 WeakPolarHBondContact O-CZ3 3.48Å; L254-V290 HydrophobicContact CD1-CG2 4.38Å; L254-V290 HydrophobicContact CD2-CG2 4.16Å
255	C	94.7	Very high	94.3	Very high	8 Å²	8	59.9 Å²	59.9	5%	0.054	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	161.4	-177.7	69.9	0	0	0	0	111.5	C240 V241 W288	C240-C255 WeakPolarHBondContact CA-O 3.48Å; V241-C255 PolarHBondContact N-O 3.14Å; C255-W288 HydrophobicContact CB-CD2 4.34Å; C255-W288 HydrophobicContact CB-CE3 4.45Å; C255-W288 HydrophobicContact CB-CH2 3.45Å; C255-W288 VanDerWaalsContact CB-CH2 3.45Å; C255-W288 HydrophobicContact CB-CZ2 3.28Å; C255-W288 HydrophobicContact CB-CZ3 4.04Å
256	D	95.7	Very high	94.4	Very high	64 Å²	64	58 Å²	58	34%	0.342	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	122.4	170	179.5	11.5	0	0	0	107.6	T239 R253 S258	T239-D256 WeakPolarHBondContact CB-OD1 3.2Å; T239-D256 WeakPolarHBondContact O-CA 3.3Å; T239-D256 PolarHBondContact OG1-OD1 3.4Å; R253-D256 IonicContact NH1-OD2 2.71Å; D256-S258 WeakPolarHBondContact OD1-CB 3.42Å; D256-S258 PolarHBondContact OD1-N 2.92Å; D256-S258 PolarHBondContact OD1-OG 2.86Å; D256-S258 PolarHBondContact OD2-OG 3.02Å
257	V	92.4	Very high	94.5	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.036	32%	0.323	C	S	.	.			trans	-100.2	14.3	178.5	-62.1	0	0	0	0	112.9	T239 G259 E260 D262 I264	T239-V257 VanDerWaalsContact O-CG2 3.32Å; T239-V257 WeakPolarHBondContact O-CG2 3.48Å; T239-V257 PolarHBondContact O-N 2.77Å; V257-G259 PolarHBondContact O-N 2.92Å; V257-E260 PolarHBondContact O-N 3.45Å; V257-D262 HydrophobicContact CB-CB 4.41Å; V257-D262 HydrophobicContact CG2-CB 4.12Å; V257-D262 WeakPolarHBondContact CG2-O 3.08Å; V257-I264 HydrophobicContact CG1-CD1 4.43Å; V257-I264 HydrophobicContact CG2-CD1 3.73Å
258	S	87.7	Confident	94.7	Very high	58 Å²	58	50 Å²	50	41%	0.406	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-52.2	-38.5	177.4	57.8	0	0	0	0	113.5	D256 E260 T261	D256-S258 WeakPolarHBondContact OD1-CB 3.42Å; D256-S258 PolarHBondContact OD1-N 2.92Å; D256-S258 PolarHBondContact OD1-OG 2.86Å; D256-S258 PolarHBondContact OD2-OG 3.02Å; S258-E260 PolarHBondContact O-N 2.91Å; S258-T261 PolarHBondContact O-N 3.01Å
259	G	84.8	Confident	94.8	Very high	79 Å²	79	46.5 Å²	46.5	81%	0.814	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-63.4	-24	177.7	0	0	0	0	0	114.6	V257	V257-G259 PolarHBondContact O-N 2.92Å
260	E	85.3	Confident	94.9	Very high	86 Å²	86	44.4 Å²	44.4	40%	0.402	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-88.9	-4.5	173	-68.4	-178.8	-153.8	0	0	112.1	V257 S258 D262 R282	V257-E260 PolarHBondContact O-N 3.45Å; S258-E260 PolarHBondContact O-N 2.91Å; E260-D262 HydrophobicContact CB-CB 4.22Å; E260-D262 PolarHBondContact O-N 2.85Å; E260-R282 PolarHBondContact O-NE 3.29Å; E260-R282 PolarHBondContact O-NH1 2.87Å; E260-R282 VanDerWaalsContact O-NH1 3.07Å; E260-R282 PolarHBondContact O-NH2 2.84Å
261	T	89.7	Confident	94.7	Very high	110 Å²	110	46 Å²	46	68%	0.675	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.8	-166.3	60.7	0	0	0	0	111.9	S258 R282	S258-T261 PolarHBondContact O-N 3.01Å; T261-R282 PolarHBondContact OG1-NH2 2.91Å
262	D	93.8	Very high	94.6	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.016	27%	0.266	C	S	.	.			trans	-113.2	163.6	177	-153.2	-12.3	0	0	0	110.3	T239 V257 E260 T280 Y281 R282 H284	T239-D262 WeakPolarHBondContact CG2-O 3.24Å; V257-D262 HydrophobicContact CB-CB 4.41Å; V257-D262 HydrophobicContact CG2-CB 4.12Å; V257-D262 WeakPolarHBondContact CG2-O 3.08Å; E260-D262 HydrophobicContact CB-CB 4.22Å; E260-D262 PolarHBondContact O-N 2.85Å; D262-T280 VanDerWaalsContact CG-CB 3.46Å; D262-T280 WeakPolarHBondContact OD2-CB 3.18Å; D262-T280 PolarHBondContact OD2-OG1 2.91Å; D262-Y281 WeakPolarHBondContact OD1-CA 3.2Å; D262-Y281 VanDerWaalsContact OD1-CB 3.25Å; D262-Y281 WeakPolarHBondContact OD1-CB 3.41Å; D262-Y281 PolarHBondContact OD1-N 3.01Å; D262-R282 HydrophobicContact CB-CG 4.31Å; D262-R282 PolarHBondContact OD1-N 3.43Å; D262-R282 VanDerWaalsContact OD2-CB 3.25Å; D262-R282 WeakPolarHBondContact OD2-CB 3.45Å; D262-R282 WeakPolarHBondContact OD2-CD 3.34Å; D262-R282 WeakPolarHBondContact OD2-CG 3.42Å; D262-R282 PolarHBondContact OD2-N 3.31Å; D262-H284 IonicContact OD2-CD2 3.19Å
263	V	96.1	Very high	94.5	Very high	45 Å²	45	46.1 Å²	46.1	27%	0.273	25%	0.249	S	C	.	.			trans	-128.3	146	-177	175.8	0	0	0	0	108.6	S265 T280 Y281	V263-S265 PolarHBondContact O-N 2.78Å; V263-T280 CarbonylContact O-C 3.57Å; V263-T280 WeakPolarHBondContact O-CA 3.38Å; V263-Y281 HydrophobicContact CB-CD2 3.64Å; V263-Y281 HydrophobicContact CB-CE2 4.19Å; V263-Y281 HydrophobicContact CB-CG 4.04Å; V263-Y281 HydrophobicContact CG1-CD2 3.75Å; V263-Y281 HydrophobicContact CG1-CE2 3.81Å; V263-Y281 WeakPolarHBondContact O-CD2 3.4Å; V263-Y281 PolarHBondContact O-N 3.26Å
264	I	98	Very high	94.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.3	177.3	-51.4	-55.9	0	0	0	109.4	L224 G238 V241 V257 V267 I278	L224-I264 HydrophobicContact CD2-CG2 4.11Å; L224-I264 WeakPolarHBondContact CD2-O 3.44Å; G238-I264 PolarHBondContact O-N 2.92Å; G238-I264 VanDerWaalsContact O-N 3.14Å; V241-I264 HydrophobicContact CG2-CD1 3.95Å; V241-I264 HydrophobicContact CG2-CG1 3.84Å; V241-I264 HydrophobicContact CG2-CG2 3.99Å; V257-I264 HydrophobicContact CG1-CD1 4.43Å; V257-I264 HydrophobicContact CG2-CD1 3.73Å; I264-V267 HydrophobicContact CG2-CG1 4.08Å; I264-I278 HydrophobicContact CD1-CG2 3.8Å; I264-I278 HydrophobicContact CG2-CG2 4.05Å
265	S	98.2	Very high	94.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	-24.1	178.6	58.2	0	0	0	0	113.8	L222 N223 V263 G279 T280 V306	L222-S265 WeakPolarHBondContact CA-O 3.38Å; L222-S265 WeakPolarHBondContact CB-O 3.24Å; N223-S265 PolarHBondContact N-O 3.32Å; N223-S265 VanDerWaalsContact N-O 3.14Å; V263-S265 PolarHBondContact O-N 2.78Å; S265-G279 PolarHBondContact N-O 3.46Å; S265-G279 VanDerWaalsContact OG-C 3.23Å; S265-G279 PolarHBondContact OG-O 3.41Å; S265-G279 VanDerWaalsContact OG-O 3.09Å; S265-T280 WeakPolarHBondContact OG-CA 3.37Å; S265-T280 PolarHBondContact OG-N 2.99Å; S265-T280 PolarHBondContact OG-O 3.42Å; S265-T280 VanDerWaalsContact OG-O 3.13Å; S265-V306 CarbonylContact C-O 3.59Å; S265-V306 WeakPolarHBondContact CB-O 3.32Å; S265-V306 VanDerWaalsContact OG-C 3.32Å; S265-V306 PolarHBondContact OG-N 3.19Å; S265-V306 PolarHBondContact OG-O 2.99Å
266	S	98.6	Very high	94.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	154.7	171.6	53.3	0	0	0	0	113.8	N223 I278 G279 V306 G307 L309	N223-S266 CarbonylContact O-C 3.56Å; N223-S266 VanDerWaalsContact O-CA 3.27Å; N223-S266 WeakPolarHBondContact O-CA 3.42Å; S266-I278 CarbonylContact O-C 3.55Å; S266-I278 WeakPolarHBondContact O-CA 3.43Å; S266-G279 PolarHBondContact N-O 3.06Å; S266-G279 VanDerWaalsContact N-O 3.14Å; S266-G279 PolarHBondContact O-N 3.06Å; S266-V306 WeakPolarHBondContact CB-O 3.25Å; S266-V306 PolarHBondContact OG-O 3.04Å; S266-G307 WeakPolarHBondContact CB-O 3.23Å; S266-L309 VanDerWaalsContact OG-CD1 3.28Å; S266-L309 WeakPolarHBondContact OG-CD1 3.3Å; S266-L309 WeakPolarHBondContact OG-CG 3.1Å
267	V	98.5	Very high	94.7	Very high	7 Å²	7	39 Å²	39	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.5	169.2	-61.5	0	0	0	0	109.9	N223 L224 D226 A234 V241 I264 L276 A277	N223-V267 PolarHBondContact O-N 3.27Å; L224-V267 VanDerWaalsContact C-CG2 3.48Å; L224-V267 WeakPolarHBondContact O-CG2 3.42Å; D226-V267 HydrophobicContact CB-CG2 4.27Å; A234-V267 HydrophobicContact CB-CG2 4.43Å; V241-V267 HydrophobicContact CG1-CG1 4.35Å; V241-V267 HydrophobicContact CG2-CG1 4.07Å; I264-V267 HydrophobicContact CG2-CG1 4.08Å; V267-L276 HydrophobicContact CB-CD1 4.35Å; V267-A277 CarbonylContact C-O 3.58Å; V267-A277 WeakPolarHBondContact CA-O 3.41Å
268	A	98.6	Very high	95	Very high	7 Å²	7	38.8 Å²	38.8	6%	0.058	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	126.2	174	0	0	0	0	0	112.3	D226 A277 L309 W311	D226-A268 WeakPolarHBondContact OD2-CA 3.41Å; A268-A277 PolarHBondContact N-O 3.27Å; A268-A277 PolarHBondContact O-N 3.47Å; A268-L309 HydrophobicContact CB-CB 3.57Å; A268-L309 HydrophobicContact CB-CD1 4.36Å; A268-W311 PolarHBondContact O-NE1 2.75Å
269	W	98.4	Very high	95.5	Very high	16 Å²	16	36 Å²	36	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	142.3	177.4	-72.4	101.6	0	0	0	112.5	D226 S228 V232 A234 L243 G273 L276 V290 W311	D226-W269 PolarHBondContact O-NE1 3.05Å; D226-W269 PolarHBondContact OD2-N 3.16Å; S228-W269 VanDerWaalsContact CB-CE2 3.49Å; V232-W269 HydrophobicContact CB-CH2 4.14Å; V232-W269 HydrophobicContact CB-CZ2 4.05Å; V232-W269 HydrophobicContact CG1-CH2 4.02Å; V232-W269 HydrophobicContact CG1-CZ2 3.9Å; V232-W269 WeakPolarHBondContact O-CZ2 3.45Å; V232-W269 PolarHBondContact O-NE1 2.79Å; A234-W269 HydrophobicContact CB-CZ2 3.79Å; L243-W269 HydrophobicContact CD2-CH2 4.05Å; L243-W269 HydrophobicContact CD2-CZ2 3.81Å; W269-G273 VanDerWaalsContact CZ3-O 3.28Å; W269-G273 WeakPolarHBondContact CZ3-O 3.44Å; W269-L276 HydrophobicContact CD2-CD1 3.68Å; W269-L276 HydrophobicContact CE3-CB 4.31Å; W269-L276 HydrophobicContact CE3-CD1 4.15Å; W269-L276 HydrophobicContact CG-CD1 3.9Å; W269-L276 HydrophobicContact CZ2-CD1 4.42Å; W269-L276 HydrophobicContact CZ3-CB 4.41Å; W269-V290 HydrophobicContact CH2-CB 4.39Å; W269-V290 HydrophobicContact CH2-CG1 4.12Å; W269-V290 HydrophobicContact CH2-CG2 3.84Å; W269-V290 HydrophobicContact CZ3-CB 4.2Å; W269-V290 HydrophobicContact CZ3-CG1 4.37Å; W269-V290 HydrophobicContact CZ3-CG2 3.65Å; W269-W311 VanDerWaalsContact C-CD1 3.4Å
270	S	97.2	Very high	96.1	Very high	12 Å²	12	32.2 Å²	32.2	8%	0.084	16%	0.162	C	C	.	.			trans	-64.7	153.3	165.5	80.1	0	0	0	0	110.5	K272 G273 H275	S270-K272 PolarHBondContact O-N 3.28Å; S270-G273 PolarHBondContact O-N 2.85Å; S270-H275 PolarHBondContact N-O 2.74Å; S270-H275 PolarHBondContact OG-N 3.03Å; S270-H275 PolarHBondContact OG-O 2.99Å
271	K	94.3	Very high	96.7	Very high	156 Å²	156	31.5 Å²	31.5	68%	0.678	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-19.4	-178.4	-172.2	172.1	-177.6	172.7	0	114.4	S229	S229-K271 PolarHBondContact OG-O 3.15Å
272	K	94.6	Very high	97	Very high	149 Å²	149	32.2 Å²	32.2	65%	0.648	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-11.6	176.6	-64.8	176.3	-179.2	168.7	0	113.4	S229 Q230 S270 S274	S229-K272 PolarHBondContact OG-O 2.92Å; Q230-K272 PolarHBondContact NE2-O 3.1Å; S270-K272 PolarHBondContact O-N 3.28Å; K272-S274 PolarHBondContact O-N 2.94Å
273	G	95	Very high	97	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	15%	0.147	C	C	.	.	S	Bend	trans	70.6	6.7	-175.3	0	0	0	0	0	114.8	S229 W269 S270	S229-G273 PolarHBondContact OG-N 3.44Å; S229-G273 VanDerWaalsContact OG-N 3.15Å; W269-G273 VanDerWaalsContact CZ3-O 3.28Å; W269-G273 WeakPolarHBondContact CZ3-O 3.44Å; S270-G273 PolarHBondContact O-N 2.85Å
274	S	95	Very high	97	Very high	30 Å²	30	32.2 Å²	32.2	21%	0.21	14%	0.144	C	C	.	.	S	Bend	trans	-83	-23.7	-177.8	60.8	0	0	0	0	113.8	K272 V290	K272-S274 PolarHBondContact O-N 2.94Å; S274-V290 PolarHBondContact O-N 3.44Å
275	H	96.7	Very high	96.9	Very high	53 Å²	53	32.2 Å²	32.2	25%	0.245	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.1	-173.8	-60.3	-11.2	0	0	0	110	S270 W288	S270-H275 PolarHBondContact N-O 2.74Å; S270-H275 PolarHBondContact OG-N 3.03Å; S270-H275 PolarHBondContact OG-O 2.99Å; H275-W288 WeakPolarHBondContact CA-O 3.32Å
276	L	98.2	Very high	96.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.1	176.6	-173.2	67.7	0	0	0	109.4	A234 V241 L243 L254 V267 W269 I278 W288 V290	A234-L276 HydrophobicContact CB-CD1 3.89Å; A234-L276 HydrophobicContact CB-CD2 3.84Å; V241-L276 HydrophobicContact CG1-CD2 3.92Å; L243-L276 HydrophobicContact CD2-CD2 4.25Å; L254-L276 HydrophobicContact CD2-CD2 3.71Å; V267-L276 HydrophobicContact CB-CD1 4.35Å; W269-L276 HydrophobicContact CD2-CD1 3.68Å; W269-L276 HydrophobicContact CE3-CB 4.31Å; W269-L276 HydrophobicContact CE3-CD1 4.15Å; W269-L276 HydrophobicContact CG-CD1 3.9Å; W269-L276 HydrophobicContact CZ2-CD1 4.42Å; W269-L276 HydrophobicContact CZ3-CB 4.41Å; L276-I278 HydrophobicContact CD2-CD1 4.08Å; L276-I278 HydrophobicContact CD2-CG1 3.98Å; L276-I278 HydrophobicContact CG-CG1 4.01Å; L276-W288 PolarHBondContact N-O 2.89Å; L276-W288 PolarHBondContact O-N 2.86Å; L276-V290 HydrophobicContact CB-CG2 4.04Å
277	A	98.5	Very high	96.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	136.7	164.4	0	0	0	0	0	109.1	V267 A268 Q286 I287 L309 W311 L316	V267-A277 CarbonylContact C-O 3.58Å; V267-A277 WeakPolarHBondContact CA-O 3.41Å; A268-A277 PolarHBondContact N-O 3.27Å; A268-A277 PolarHBondContact O-N 3.47Å; A277-Q286 CarbonylContact C-O 3.28Å; A277-Q286 WeakPolarHBondContact CA-O 3.32Å; A277-I287 HydrophobicContact CB-CD1 3.92Å; A277-L309 HydrophobicContact CB-CD1 3.91Å; A277-W311 HydrophobicContact CB-CZ2 3.7Å; A277-L316 HydrophobicContact CB-CD1 4.12Å; A277-L316 HydrophobicContact CB-CD2 3.75Å
278	I	98.4	Very high	96.7	Very high	0 Å²	0	34 Å²	34	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.1	-179.5	-54	178.2	0	0	0	107.6	V241 L254 I264 S266 L276 V285 Q286 W288	V241-I278 HydrophobicContact CB-CD1 4.3Å; V241-I278 HydrophobicContact CG2-CD1 3.95Å; V241-I278 HydrophobicContact CG2-CG1 4.5Å; V241-I278 HydrophobicContact CG2-CG2 4.1Å; L254-I278 HydrophobicContact CD2-CD1 4.22Å; I264-I278 HydrophobicContact CD1-CG2 3.8Å; I264-I278 HydrophobicContact CG2-CG2 4.05Å; S266-I278 CarbonylContact O-C 3.55Å; S266-I278 WeakPolarHBondContact O-CA 3.43Å; L276-I278 HydrophobicContact CD2-CD1 4.08Å; L276-I278 HydrophobicContact CD2-CG1 3.98Å; L276-I278 HydrophobicContact CG-CG1 4.01Å; I278-V285 CarbonylContact O-C 3.59Å; I278-V285 WeakPolarHBondContact O-CA 3.3Å; I278-Q286 HydrophobicContact CB-CB 4.49Å; I278-Q286 PolarHBondContact N-O 3.49Å; I278-Q286 PolarHBondContact O-N 3.26Å; I278-W288 VanDerWaalsContact CD1-CD1 3.44Å; I278-W288 HydrophobicContact CD1-CG 4.05Å
279	G	98.1	Very high	96.6	Very high	0 Å²	0	34 Å²	34	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.6	174.3	0	0	0	0	0	110.5	S265 S266 H284	S265-G279 PolarHBondContact N-O 3.46Å; S265-G279 VanDerWaalsContact OG-C 3.23Å; S265-G279 PolarHBondContact OG-O 3.41Å; S265-G279 VanDerWaalsContact OG-O 3.09Å; S266-G279 PolarHBondContact N-O 3.06Å; S266-G279 VanDerWaalsContact N-O 3.14Å; S266-G279 PolarHBondContact O-N 3.06Å; G279-H284 WeakPolarHBondContact CA-O 3.49Å
280	T	97.8	Very high	96.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	165.2	-177.8	80.5	0	0	0	0	113.2	D262 V263 S265 R282 G283 H284 R305 V306	D262-T280 VanDerWaalsContact CG-CB 3.46Å; D262-T280 WeakPolarHBondContact OD2-CB 3.18Å; D262-T280 PolarHBondContact OD2-OG1 2.91Å; V263-T280 CarbonylContact O-C 3.57Å; V263-T280 WeakPolarHBondContact O-CA 3.38Å; S265-T280 WeakPolarHBondContact OG-CA 3.37Å; S265-T280 PolarHBondContact OG-N 2.99Å; S265-T280 PolarHBondContact OG-O 3.42Å; S265-T280 VanDerWaalsContact OG-O 3.13Å; T280-R282 VanDerWaalsContact C-N 3.31Å; T280-R282 PolarHBondContact O-N 3.41Å; T280-G283 PolarHBondContact O-N 2.81Å; T280-H284 HydrophobicContact CG2-CB 4.31Å; T280-H284 PolarHBondContact N-O 2.99Å; T280-H284 WeakPolarHBondContact OG1-CB 3.46Å; T280-H284 PolarHBondContact OG1-N 3.23Å; T280-R305 WeakPolarHBondContact O-CA 3.26Å; T280-V306 PolarHBondContact O-N 2.91Å; T280-V306 VanDerWaalsContact O-N 3.11Å
281	Y	96.4	Very high	96.3	Very high	70 Å²	70	39 Å²	39	28%	0.275	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.6	179.8	-100.5	-108.1	0	0	0	114	D219 L222 D262 V263 G283 R305	D219-Y281 PolarHBondContact OD2-OH 3.37Å; L222-Y281 HydrophobicContact CD1-CE2 3.94Å; L222-Y281 WeakPolarHBondContact CD1-OH 3.43Å; L222-Y281 HydrophobicContact CD2-CE2 3.83Å; D262-Y281 WeakPolarHBondContact OD1-CA 3.2Å; D262-Y281 VanDerWaalsContact OD1-CB 3.25Å; D262-Y281 WeakPolarHBondContact OD1-CB 3.41Å; D262-Y281 PolarHBondContact OD1-N 3.01Å; V263-Y281 HydrophobicContact CB-CD2 3.64Å; V263-Y281 HydrophobicContact CB-CE2 4.19Å; V263-Y281 HydrophobicContact CB-CG 4.04Å; V263-Y281 HydrophobicContact CG1-CD2 3.75Å; V263-Y281 HydrophobicContact CG1-CE2 3.81Å; V263-Y281 WeakPolarHBondContact O-CD2 3.4Å; V263-Y281 PolarHBondContact O-N 3.26Å; Y281-G283 VanDerWaalsContact C-N 3.3Å; Y281-R305 HydrophobicContact CD1-CB 4.24Å; Y281-R305 HydrophobicContact CG-CB 4.13Å; Y281-R305 WeakPolarHBondContact O-CA 3.29Å; Y281-R305 WeakPolarHBondContact O-CB 3.37Å; Y281-R305 PolarHBondContact O-N 2.97Å; Y281-R305 PolarHBondContact OH-NH1 2.78Å; Y281-R305 VanDerWaalsContact OH-NH1 3.09Å
282	R	95.7	Very high	96.2	Very high	126 Å²	126	38.6 Å²	38.6	48%	0.475	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.2	174.6	-64.9	173.4	169.3	-146.4	-10.1	114.5	E260 T261 D262 T280	E260-R282 PolarHBondContact O-NE 3.29Å; E260-R282 PolarHBondContact O-NH1 2.87Å; E260-R282 VanDerWaalsContact O-NH1 3.07Å; E260-R282 PolarHBondContact O-NH2 2.84Å; T261-R282 PolarHBondContact OG1-NH2 2.91Å; D262-R282 HydrophobicContact CB-CG 4.31Å; D262-R282 PolarHBondContact OD1-N 3.43Å; D262-R282 VanDerWaalsContact OD2-CB 3.25Å; D262-R282 WeakPolarHBondContact OD2-CB 3.45Å; D262-R282 WeakPolarHBondContact OD2-CD 3.34Å; D262-R282 WeakPolarHBondContact OD2-CG 3.42Å; D262-R282 PolarHBondContact OD2-N 3.31Å; T280-R282 VanDerWaalsContact C-N 3.31Å; T280-R282 PolarHBondContact O-N 3.41Å
283	G	95.3	Very high	96.2	Very high	1 Å²	1	35 Å²	35	1%	0.01	17%	0.174	C	C	.	.	S	Bend	trans	98.8	10.7	179.8	0	0	0	0	0	114.9	T280 Y281 A304	T280-G283 PolarHBondContact O-N 2.81Å; Y281-G283 VanDerWaalsContact C-N 3.3Å; G283-A304 VanDerWaalsContact CA-O 3.25Å; G283-A304 WeakPolarHBondContact CA-O 3.28Å
284	H	95.3	Very high	96.2	Very high	47 Å²	47	37.3 Å²	37.3	22%	0.218	19%	0.189	C	C	.	.			trans	-79	146.5	173.3	-57.7	-66.9	0	0	0	110.6	D262 G279 T280 N300	D262-H284 IonicContact OD2-CD2 3.19Å; G279-H284 WeakPolarHBondContact CA-O 3.49Å; T280-H284 HydrophobicContact CG2-CB 4.31Å; T280-H284 PolarHBondContact N-O 2.99Å; T280-H284 WeakPolarHBondContact OG1-CB 3.46Å; T280-H284 PolarHBondContact OG1-N 3.23Å; H284-N300 PolarHBondContact ND1-OD1 2.83Å
285	V	96.7	Very high	96.2	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	103.1	171	-176.9	0	0	0	0	109	I278 I287 L299 V306 L309 L316	I278-V285 CarbonylContact O-C 3.59Å; I278-V285 WeakPolarHBondContact O-CA 3.3Å; V285-I287 HydrophobicContact CG1-CD1 4.33Å; V285-L299 HydrophobicContact CB-CB 4.25Å; V285-L299 PolarHBondContact N-O 2.99Å; V285-L299 WeakPolarHBondContact O-CB 3.23Å; V285-L299 PolarHBondContact O-N 2.79Å; V285-V306 HydrophobicContact CG2-CB 4.26Å; V285-V306 HydrophobicContact CG2-CG1 4Å; V285-V306 HydrophobicContact CG2-CG2 3.77Å; V285-L309 HydrophobicContact CG1-CD2 3.9Å; V285-L309 HydrophobicContact CG2-CD2 4.43Å; V285-L316 HydrophobicContact CG1-CD2 3.7Å
286	Q	95.9	Very high	96	Very high	11 Å²	11	39.2 Å²	39.2	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140.8	179	-59.1	-176.7	-0.2	0	0	110.6	A277 I278 R297	A277-Q286 CarbonylContact C-O 3.28Å; A277-Q286 WeakPolarHBondContact CA-O 3.32Å; I278-Q286 HydrophobicContact CB-CB 4.49Å; I278-Q286 PolarHBondContact N-O 3.49Å; I278-Q286 PolarHBondContact O-N 3.26Å; Q286-R297 CarbonylContact C-O 3.56Å; Q286-R297 WeakPolarHBondContact CA-O 3.3Å
287	I	96.8	Very high	95.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117.2	175.1	-48.1	-60.6	0	0	0	108.4	A277 V285 I296 R297 L299 W311 L316	A277-I287 HydrophobicContact CB-CD1 3.92Å; V285-I287 HydrophobicContact CG1-CD1 4.33Å; I287-I296 HydrophobicContact CG2-CD1 4.3Å; I287-I296 WeakPolarHBondContact O-CB 3.26Å; I287-I296 PolarHBondContact O-N 2.73Å; I287-R297 HydrophobicContact CB-CB 4.48Å; I287-R297 HydrophobicContact CG1-CB 4.43Å; I287-R297 PolarHBondContact N-O 2.9Å; I287-R297 PolarHBondContact O-N 2.94Å; I287-L299 HydrophobicContact CD1-CD1 4.16Å; I287-L299 HydrophobicContact CG1-CD1 4Å; I287-W311 HydrophobicContact CD1-CH2 4.16Å; I287-W311 HydrophobicContact CD1-CZ2 4.17Å; I287-W311 HydrophobicContact CG2-CH2 4.23Å; I287-W311 HydrophobicContact CG2-CZ2 4.5Å; I287-L316 HydrophobicContact CD1-CD2 3.47Å; I287-L316 VanDerWaalsContact CD1-CD2 3.47Å
288	W	97.6	Very high	95.5	Very high	32 Å²	32	45.6 Å²	45.6	12%	0.121	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.3	-176.1	-74.9	74.2	0	0	0	112.2	L254 C255 H275 L276 I278 S294 C295	L254-W288 HydrophobicContact CD1-CE3 3.82Å; L254-W288 HydrophobicContact CD1-CZ3 4.47Å; L254-W288 HydrophobicContact CD2-CB 4.04Å; L254-W288 HydrophobicContact CD2-CD2 4.41Å; L254-W288 HydrophobicContact CD2-CE3 4.49Å; L254-W288 HydrophobicContact CD2-CG 4.23Å; L254-W288 HydrophobicContact CG-CD2 4.23Å; L254-W288 HydrophobicContact CG-CE3 3.88Å; L254-W288 HydrophobicContact CG-CZ3 4.48Å; L254-W288 WeakPolarHBondContact O-CZ3 3.48Å; C255-W288 HydrophobicContact CB-CD2 4.34Å; C255-W288 HydrophobicContact CB-CE3 4.45Å; C255-W288 HydrophobicContact CB-CH2 3.45Å; C255-W288 VanDerWaalsContact CB-CH2 3.45Å; C255-W288 HydrophobicContact CB-CZ2 3.28Å; C255-W288 HydrophobicContact CB-CZ3 4.04Å; H275-W288 WeakPolarHBondContact CA-O 3.32Å; L276-W288 PolarHBondContact N-O 2.89Å; L276-W288 PolarHBondContact O-N 2.86Å; I278-W288 VanDerWaalsContact CD1-CD1 3.44Å; I278-W288 HydrophobicContact CD1-CG 4.05Å; W288-S294 CarbonylContact C-O 3.59Å; W288-S294 WeakPolarHBondContact CA-O 3.33Å; W288-C295 HydrophobicContact CD2-CB 4.05Å; W288-C295 HydrophobicContact CE3-CB 4.44Å; W288-C295 HydrophobicContact CH2-CB 4.19Å; W288-C295 HydrophobicContact CZ2-CB 3.77Å
289	D	96.5	Very high	95.2	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.043	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	109	163.3	-170.8	-27.6	0	0	0	107.5	T291 K292 S293 S294 I296	D289-T291 VanDerWaalsContact C-N 3.29Å; D289-T291 PolarHBondContact O-N 2.98Å; D289-T291 PolarHBondContact OD1-N 2.89Å; D289-T291 PolarHBondContact OD1-OG1 2.85Å; D289-K292 HydrophobicContact CB-CB 4.22Å; D289-K292 HydrophobicContact CB-CG 4.49Å; D289-K292 PolarHBondContact O-N 2.9Å; D289-K292 PolarHBondContact OD1-N 2.91Å; D289-K292 WeakPolarHBondContact OD2-CD 3.31Å; D289-K292 WeakPolarHBondContact OD2-CE 3.21Å; D289-K292 IonicContact OD2-NZ 3.73Å; D289-K292 PolarHBondContact OD2-NZ 3.22Å; D289-S293 WeakPolarHBondContact O-CA 3.46Å; D289-S293 PolarHBondContact O-N 3.38Å; D289-S294 PolarHBondContact N-O 2.91Å; D289-S294 PolarHBondContact O-N 3.29Å; D289-I296 HydrophobicContact CB-CD1 3.81Å; D289-I296 HydrophobicContact CB-CG1 3.82Å
290	V	95.5	Very high	94.9	Very high	28 Å²	28	51.4 Å²	51.4	17%	0.17	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-26	-176.4	170	0	0	0	0	111.9	L243 L254 W269 S274 L276	L243-V290 HydrophobicContact CD1-CB 4.44Å; L243-V290 HydrophobicContact CD1-CG1 3.47Å; L243-V290 VanDerWaalsContact CD1-CG1 3.47Å; L243-V290 HydrophobicContact CD1-CG2 4.18Å; L254-V290 HydrophobicContact CD1-CG2 4.38Å; L254-V290 HydrophobicContact CD2-CG2 4.16Å; W269-V290 HydrophobicContact CH2-CB 4.39Å; W269-V290 HydrophobicContact CH2-CG1 4.12Å; W269-V290 HydrophobicContact CH2-CG2 3.84Å; W269-V290 HydrophobicContact CZ3-CB 4.2Å; W269-V290 HydrophobicContact CZ3-CG1 4.37Å; W269-V290 HydrophobicContact CZ3-CG2 3.65Å; S274-V290 PolarHBondContact O-N 3.44Å; L276-V290 HydrophobicContact CB-CG2 4.04Å
291	T	93.5	Very high	94.6	Very high	105 Å²	105	52.4 Å²	52.4	64%	0.644	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-29.6	178.7	65.8	0	0	0	0	112.4	D289	D289-T291 VanDerWaalsContact C-N 3.29Å; D289-T291 PolarHBondContact O-N 2.98Å; D289-T291 PolarHBondContact OD1-N 2.89Å; D289-T291 PolarHBondContact OD1-OG1 2.85Å
292	K	93.8	Very high	94.6	Very high	147 Å²	147	49.7 Å²	49.7	64%	0.639	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-5.4	177	-58.9	-179.4	-169.3	124.8	0	113.4	D289 S294	D289-K292 HydrophobicContact CB-CB 4.22Å; D289-K292 HydrophobicContact CB-CG 4.49Å; D289-K292 PolarHBondContact O-N 2.9Å; D289-K292 PolarHBondContact OD1-N 2.91Å; D289-K292 WeakPolarHBondContact OD2-CD 3.31Å; D289-K292 WeakPolarHBondContact OD2-CE 3.21Å; D289-K292 IonicContact OD2-NZ 3.73Å; D289-K292 PolarHBondContact OD2-NZ 3.22Å; K292-S294 VanDerWaalsContact C-N 3.25Å; K292-S294 PolarHBondContact O-N 3.29Å
293	S	93.2	Very high	94.5	Very high	75 Å²	75	48.9 Å²	48.9	52%	0.524	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	44.6	-172	-59.3	0	0	0	0	113	D289	D289-S293 WeakPolarHBondContact O-CA 3.46Å; D289-S293 PolarHBondContact O-N 3.38Å
294	S	95.5	Very high	94.6	Very high	48 Å²	48	50 Å²	50	34%	0.336	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.7	-174.7	65.1	0	0	0	0	113.7	W288 D289 K292 I296	W288-S294 CarbonylContact C-O 3.59Å; W288-S294 WeakPolarHBondContact CA-O 3.33Å; D289-S294 PolarHBondContact N-O 2.91Å; D289-S294 PolarHBondContact O-N 3.29Å; K292-S294 VanDerWaalsContact C-N 3.25Å; K292-S294 PolarHBondContact O-N 3.29Å; S294-I296 PolarHBondContact O-N 3.08Å
295	C	94.6	Very high	94.7	Very high	56 Å²	56	48.6 Å²	48.6	38%	0.378	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	118.5	173	-170.6	0	0	0	0	109.7	W288 R297	W288-C295 HydrophobicContact CD2-CB 4.05Å; W288-C295 HydrophobicContact CE3-CB 4.44Å; W288-C295 HydrophobicContact CH2-CB 4.19Å; W288-C295 HydrophobicContact CZ2-CB 3.77Å; C295-R297 PolarHBondContact SG-O 2.85Å; C295-R297 VanDerWaalsContact SG-O 3.41Å
296	I	93.7	Very high	94.8	Very high	67 Å²	67	48.5 Å²	48.5	34%	0.344	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-41.7	177.2	-46.2	175.5	0	0	0	110.3	I287 D289 S294	I287-I296 HydrophobicContact CG2-CD1 4.3Å; I287-I296 WeakPolarHBondContact O-CB 3.26Å; I287-I296 PolarHBondContact O-N 2.73Å; D289-I296 HydrophobicContact CB-CD1 3.81Å; D289-I296 HydrophobicContact CB-CG1 3.82Å; S294-I296 PolarHBondContact O-N 3.08Å
297	R	92.1	Very high	94.9	Very high	71 Å²	71	48 Å²	48	27%	0.268	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	143.4	-175.1	-76.5	177.6	-67.9	-89.1	-5.8	110.8	Q286 I287 C295 L299 T330	Q286-R297 CarbonylContact C-O 3.56Å; Q286-R297 WeakPolarHBondContact CA-O 3.3Å; I287-R297 HydrophobicContact CB-CB 4.48Å; I287-R297 HydrophobicContact CG1-CB 4.43Å; I287-R297 PolarHBondContact N-O 2.9Å; I287-R297 PolarHBondContact O-N 2.94Å; C295-R297 PolarHBondContact SG-O 2.85Å; C295-R297 VanDerWaalsContact SG-O 3.41Å; R297-L299 HydrophobicContact CB-CD2 4.35Å; R297-T330 PolarHBondContact NE-O 2.87Å; R297-T330 PolarHBondContact NH1-O 3.36Å; R297-T330 PolarHBondContact NH2-O 2.81Å; R297-T330 VanDerWaalsContact NH2-O 3.1Å
298	S	92.5	Very high	95	Very high	64 Å²	64	48 Å²	48	45%	0.448	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.2	158.7	-169.5	0	0	0	0	109
299	L	92.9	Very high	95	Very high	27 Å²	27	47.4 Å²	47.4	14%	0.141	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115.4	-176.6	-56.9	172.2	0	0	0	109.4	V285 I287 R297	V285-L299 HydrophobicContact CB-CB 4.25Å; V285-L299 PolarHBondContact N-O 2.99Å; V285-L299 WeakPolarHBondContact O-CB 3.23Å; V285-L299 PolarHBondContact O-N 2.79Å; I287-L299 HydrophobicContact CD1-CD1 4.16Å; I287-L299 HydrophobicContact CG1-CD1 4Å; R297-L299 HydrophobicContact CB-CD2 4.35Å
300	N	92.3	Very high	95.1	Very high	94 Å²	94	47.4 Å²	47.4	50%	0.503	27%	0.271	S	S	.	.			trans	-102.9	149	-176.1	-61.7	-18.5	0	0	0	111.2	H284 R328	H284-N300 PolarHBondContact ND1-OD1 2.83Å; N300-R328 PolarHBondContact O-NH2 3.39Å
301	G	90.8	Very high	95.3	Very high	22 Å²	22	47.7 Å²	47.7	23%	0.227	27%	0.269	C	S	.	.			trans	152.9	-20.3	168.8	0	0	0	0	0	116.1
302	H	95.8	Very high	95.4	Very high	13 Å²	13	43.2 Å²	43.2	6%	0.06	24%	0.241	C	C	.	.			trans	-72.3	153.3	163.2	-72.1	-68.1	0	0	0	110.1	V306 S318 S320 D322 Y324 L326	H302-V306 HydrophobicContact CB-CG2 4.23Å; H302-V306 VanDerWaalsContact CD2-CG2 3.46Å; H302-V306 WeakPolarHBondContact CD2-CG2 3.15Å; H302-S318 PolarHBondContact CE1-O 3.43Å; H302-S318 PolarHBondContact NE2-O 3.19Å; H302-S318 PolarHBondContact NE2-OG 2.79Å; H302-S320 VanDerWaalsContact CE1-CB 3.44Å; H302-S320 WeakPolarHBondContact CE1-CB 3.46Å; H302-S320 WeakPolarHBondContact ND1-CB 3.44Å; H302-D322 WeakPolarHBondContact CA-OD2 3.46Å; H302-D322 WeakPolarHBondContact CB-OD2 3.33Å; H302-D322 IonicContact CE1-OD1 3.4Å; H302-D322 IonicContact CG-OD2 3.32Å; H302-D322 IonicContact ND1-OD1 3.5Å; H302-D322 PolarHBondContact ND1-OD1 3.2Å; H302-D322 IonicContact ND1-OD2 2.73Å; H302-D322 PolarHBondContact ND1-OD2 3.12Å; H302-Y324 PolarHBondContact CE1-O 2.86Å; H302-L326 VanDerWaalsContact CE1-CG 3.49Å; H302-L326 WeakPolarHBondContact CE1-CG 3.35Å; H302-L326 WeakPolarHBondContact NE2-CD1 3.47Å
303	I	95.2	Very high	95.4	Very high	109 Å²	109	39 Å²	39	56%	0.559	23%	0.234	S	C	*	.	S	Bend	trans	-107.6	2.2	176.5	57.6	172.5	0	0	0	113.6	D322 R455	I303-D322 HydrophobicContact CD1-CB 4.25Å; I303-D322 HydrophobicContact CG1-CB 3.5Å; I303-D322 VanDerWaalsContact CG1-CB 3.5Å; I303-D322 PolarHBondContact N-OD2 3.19Å; I303-D322 VanDerWaalsContact N-OD2 3.11Å; I303-R455 VanDerWaalsContact CG2-NH2 3.34Å
304	A	96.7	Very high	95.4	Very high	25 Å²	25	38.1 Å²	38.1	21%	0.207	22%	0.223	C	C	.	.	S	Bend	trans	-151.8	170.1	178	0	0	0	0	0	110.1	G283 S320 R321 D322	G283-A304 VanDerWaalsContact CA-O 3.25Å; G283-A304 WeakPolarHBondContact CA-O 3.28Å; A304-S320 PolarHBondContact O-OG 2.92Å; A304-R321 HydrophobicContact CB-CB 3.85Å; A304-R321 HydrophobicContact CB-CG 4.42Å; A304-D322 HydrophobicContact CB-CB 4.29Å
305	R	97.7	Very high	95.4	Very high	17 Å²	17	37 Å²	37	6%	0.064	21%	0.213	C	C	.	.			trans	-44.8	139.4	-174.7	69.9	179.6	-178.4	-177.3	1.2	114.8	D219 T280 Y281 G307 S320 R321 E470	D219-R305 IonicContact OD2-CZ 3.74Å; D219-R305 IonicContact OD2-NH1 2.86Å; D219-R305 PolarHBondContact OD2-NH1 2.76Å; D219-R305 IonicContact OD2-NH2 3.84Å; T280-R305 WeakPolarHBondContact O-CA 3.26Å; Y281-R305 HydrophobicContact CD1-CB 4.24Å; Y281-R305 HydrophobicContact CG-CB 4.13Å; Y281-R305 WeakPolarHBondContact O-CA 3.29Å; Y281-R305 WeakPolarHBondContact O-CB 3.37Å; Y281-R305 PolarHBondContact O-N 2.97Å; Y281-R305 PolarHBondContact OH-NH1 2.78Å; Y281-R305 VanDerWaalsContact OH-NH1 3.09Å; R305-G307 PolarHBondContact O-N 3.15Å; R305-S320 VanDerWaalsContact O-CA 3.23Å; R305-S320 WeakPolarHBondContact O-CA 3.43Å; R305-S320 WeakPolarHBondContact O-CB 3.46Å; R305-S320 PolarHBondContact O-OG 3.34Å; R305-R321 HydrophobicContact CG-CB 3.78Å; R305-R321 PolarHBondContact O-N 2.65Å; R305-E470 IonicContact CZ-OE1 2.6Å; R305-E470 IonicContact CZ-OE2 3.5Å; R305-E470 IonicContact NE-OE1 3.77Å; R305-E470 PolarHBondContact NE-OE1 3Å; R305-E470 IonicContact NE-OE2 3.27Å; R305-E470 PolarHBondContact NE-OE2 2.89Å; R305-E470 IonicContact NH2-OE1 3.86Å; R305-E470 PolarHBondContact NH2-OE1 2.85Å; R305-E470 IonicContact NH2-OE2 3.91Å; R305-E470 PolarHBondContact NH2-OE2 3.04Å
306	V	98.5	Very high	95.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.			trans	-93.7	91.5	175.3	177.7	0	0	0	0	108.7	S265 S266 T280 V285 H302 L309 G319	S265-V306 CarbonylContact C-O 3.59Å; S265-V306 WeakPolarHBondContact CB-O 3.32Å; S265-V306 VanDerWaalsContact OG-C 3.32Å; S265-V306 PolarHBondContact OG-N 3.19Å; S265-V306 PolarHBondContact OG-O 2.99Å; S266-V306 WeakPolarHBondContact CB-O 3.25Å; S266-V306 PolarHBondContact OG-O 3.04Å; T280-V306 PolarHBondContact O-N 2.91Å; T280-V306 VanDerWaalsContact O-N 3.11Å; V285-V306 HydrophobicContact CG2-CB 4.26Å; V285-V306 HydrophobicContact CG2-CG1 4Å; V285-V306 HydrophobicContact CG2-CG2 3.77Å; H302-V306 HydrophobicContact CB-CG2 4.23Å; H302-V306 VanDerWaalsContact CD2-CG2 3.46Å; H302-V306 WeakPolarHBondContact CD2-CG2 3.15Å; V306-L309 HydrophobicContact CG1-CD2 3.86Å; V306-L309 HydrophobicContact CG1-CG 4.13Å; V306-G319 CarbonylContact C-O 3.57Å; V306-G319 WeakPolarHBondContact CA-O 3.42Å
307	G	98	Very high	95.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.			trans	-75.2	-25.9	-177.5	0	0	0	0	0	113.7	N223 S266 R305 G319	N223-G307 PolarHBondContact N-O 3.13Å; N223-G307 PolarHBondContact ND2-O 2.85Å; S266-G307 WeakPolarHBondContact CB-O 3.23Å; R305-G307 PolarHBondContact O-N 3.15Å; G307-G319 PolarHBondContact N-O 2.85Å; G307-G319 VanDerWaalsContact N-O 3.15Å
308	A	98.6	Very high	96	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.008	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	140.9	-175	0	0	0	0	0	113.2	G319 L474	A308-G319 PolarHBondContact N-O 3.34Å; A308-G319 PolarHBondContact O-N 3.37Å; A308-L474 HydrophobicContact CB-CB 3.64Å; A308-L474 HydrophobicContact CB-CD2 4.35Å
309	L	98.7	Very high	96.3	Very high	18 Å²	18	24.7 Å²	24.7	9%	0.094	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.6	179.1	-71.5	169.1	0	0	0	110	S266 A268 A277 V285 V306 L316 A317	S266-L309 VanDerWaalsContact OG-CD1 3.28Å; S266-L309 WeakPolarHBondContact OG-CD1 3.3Å; S266-L309 WeakPolarHBondContact OG-CG 3.1Å; A268-L309 HydrophobicContact CB-CB 3.57Å; A268-L309 HydrophobicContact CB-CD1 4.36Å; A277-L309 HydrophobicContact CB-CD1 3.91Å; V285-L309 HydrophobicContact CG1-CD2 3.9Å; V285-L309 HydrophobicContact CG2-CD2 4.43Å; V306-L309 HydrophobicContact CG1-CD2 3.86Å; V306-L309 HydrophobicContact CG1-CG 4.13Å; L309-L316 HydrophobicContact CD2-CD1 4.16Å; L309-L316 HydrophobicContact CD2-CD2 4.32Å; L309-L316 HydrophobicContact CD2-CG 4.4Å; L309-A317 CarbonylContact C-O 3.59Å; L309-A317 WeakPolarHBondContact CA-O 3.4Å
310	A	98.4	Very high	96.5	Very high	9 Å²	9	23.4 Å²	23.4	7%	0.074	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	126.3	175.1	0	0	0	0	0	112.1	A317 L474 W476 L483	A310-A317 HydrophobicContact CB-CB 4.47Å; A310-A317 PolarHBondContact N-O 3.42Å; A310-A317 PolarHBondContact O-N 2.95Å; A310-L474 HydrophobicContact CB-CB 4.41Å; A310-L474 HydrophobicContact CB-CD2 4.26Å; A310-L474 HydrophobicContact CB-CG 3.95Å; A310-W476 PolarHBondContact O-NE1 2.96Å; A310-W476 VanDerWaalsContact O-NE1 3.08Å; A310-L483 HydrophobicContact CB-CD1 4.49Å
311	W	97.9	Very high	96.8	Very high	33 Å²	33	26.1 Å²	26.1	13%	0.125	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	141.2	178.4	-72.8	96.6	0	0	0	113.1	A268 W269 A277 I287 L316 T330 W476	A268-W311 PolarHBondContact O-NE1 2.75Å; W269-W311 VanDerWaalsContact C-CD1 3.4Å; A277-W311 HydrophobicContact CB-CZ2 3.7Å; I287-W311 HydrophobicContact CD1-CH2 4.16Å; I287-W311 HydrophobicContact CD1-CZ2 4.17Å; I287-W311 HydrophobicContact CG2-CH2 4.23Å; I287-W311 HydrophobicContact CG2-CZ2 4.5Å; W311-L316 HydrophobicContact CD2-CD1 3.87Å; W311-L316 HydrophobicContact CE3-CB 4.21Å; W311-L316 HydrophobicContact CE3-CD1 4.38Å; W311-L316 HydrophobicContact CG-CD1 4.08Å; W311-L316 HydrophobicContact CZ2-CD1 4.45Å; W311-L316 HydrophobicContact CZ2-CD2 4.43Å; W311-L316 HydrophobicContact CZ3-CB 4.24Å; W311-T330 HydrophobicContact CH2-CG2 3.85Å; W311-T330 HydrophobicContact CZ3-CG2 3.66Å; W311-W476 VanDerWaalsContact C-CD1 3.42Å; W311-W476 VanDerWaalsContact O-CD1 3.3Å
312	N	96.6	Very high	97.1	Very high	12 Å²	12	25.6 Å²	25.6	6%	0.064	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	93.1	168.1	178.6	-0.1	0	0	0	108.7	D314 L315 W476 S480 Q497	N312-D314 PolarHBondContact O-N 2.83Å; N312-L315 HydrophobicContact CB-CB 4.39Å; N312-L315 PolarHBondContact N-O 2.86Å; N312-L315 WeakPolarHBondContact O-CB 3.44Å; N312-L315 PolarHBondContact O-N 2.9Å; N312-W476 HydrophobicContact CB-CB 4.47Å; N312-W476 HydrophobicContact CB-CD2 3.55Å; N312-W476 HydrophobicContact CB-CE3 4.07Å; N312-W476 HydrophobicContact CB-CG 3.71Å; N312-W476 HydrophobicContact CB-CZ2 4.08Å; N312-W476 VanDerWaalsContact ND2-CE3 3.27Å; N312-W476 VanDerWaalsContact ND2-CZ3 3.31Å; N312-W476 WeakPolarHBondContact ND2-CZ3 3.33Å; N312-S480 PolarHBondContact ND2-O 3.35Å; N312-S480 VanDerWaalsContact ND2-O 3.11Å; N312-S480 WeakPolarHBondContact OD1-CB 3.47Å; N312-S480 PolarHBondContact OD1-OG 2.87Å; N312-Q497 PolarHBondContact ND2-OE1 3.15Å
313	A	94	Very high	97.2	Very high	59 Å²	59	30.3 Å²	30.3	49%	0.488	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-110.8	-166.9	0	0	0	0	0	111.4
314	D	93.5	Very high	97.2	Very high	55 Å²	55	28.2 Å²	28.2	29%	0.294	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-7	-179.4	-54.9	-45.2	0	0	0	113.1	N312 T330 R331	N312-D314 PolarHBondContact O-N 2.83Å; D314-T330 WeakPolarHBondContact O-CB 3.32Å; D314-T330 WeakPolarHBondContact O-CG2 3.41Å; D314-T330 PolarHBondContact O-N 2.88Å; D314-T330 PolarHBondContact O-OG1 2.88Å; D314-R331 HydrophobicContact CB-CG 4.02Å; D314-R331 WeakPolarHBondContact OD2-CD 3.39Å; D314-R331 IonicContact OD2-CZ 3.46Å; D314-R331 VanDerWaalsContact OD2-CZ 3.32Å; D314-R331 IonicContact OD2-NE 2.96Å; D314-R331 PolarHBondContact OD2-NE 3.25Å; D314-R331 IonicContact OD2-NH1 3.68Å; D314-R331 PolarHBondContact OD2-NH1 2.87Å
315	L	94.9	Very high	97.2	Very high	24 Å²	24	27 Å²	27	13%	0.126	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.4	175	-171.5	75.7	0	0	0	109.9	N312 L327 W476	N312-L315 HydrophobicContact CB-CB 4.39Å; N312-L315 PolarHBondContact N-O 2.86Å; N312-L315 WeakPolarHBondContact O-CB 3.44Å; N312-L315 PolarHBondContact O-N 2.9Å; L315-L327 HydrophobicContact CD1-CB 4.29Å; L315-W476 HydrophobicContact CD2-CH2 3.83Å; L315-W476 HydrophobicContact CD2-CZ2 3.66Å
316	L	97	Very high	97.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.3	172.9	-179.6	60	0	0	0	110	A277 V285 I287 L309 W311 L327 R328 T330	A277-L316 HydrophobicContact CB-CD1 4.12Å; A277-L316 HydrophobicContact CB-CD2 3.75Å; V285-L316 HydrophobicContact CG1-CD2 3.7Å; I287-L316 HydrophobicContact CD1-CD2 3.47Å; I287-L316 VanDerWaalsContact CD1-CD2 3.47Å; L309-L316 HydrophobicContact CD2-CD1 4.16Å; L309-L316 HydrophobicContact CD2-CD2 4.32Å; L309-L316 HydrophobicContact CD2-CG 4.4Å; W311-L316 HydrophobicContact CD2-CD1 3.87Å; W311-L316 HydrophobicContact CE3-CB 4.21Å; W311-L316 HydrophobicContact CE3-CD1 4.38Å; W311-L316 HydrophobicContact CG-CD1 4.08Å; W311-L316 HydrophobicContact CZ2-CD1 4.45Å; W311-L316 HydrophobicContact CZ2-CD2 4.43Å; W311-L316 HydrophobicContact CZ3-CB 4.24Å; L316-L327 WeakPolarHBondContact O-CA 3.26Å; L316-R328 PolarHBondContact N-O 3.24Å; L316-R328 PolarHBondContact O-N 3.33Å; L316-T330 HydrophobicContact CB-CG2 3.81Å
317	A	97.7	Very high	97	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.7	166.7	0	0	0	0	0	109.4	L309 A310 I325 L326 L327 L474 W476 L483	L309-A317 CarbonylContact C-O 3.59Å; L309-A317 WeakPolarHBondContact CA-O 3.4Å; A310-A317 HydrophobicContact CB-CB 4.47Å; A310-A317 PolarHBondContact N-O 3.42Å; A310-A317 PolarHBondContact O-N 2.95Å; A317-I325 HydrophobicContact CB-CG2 4.28Å; A317-L326 WeakPolarHBondContact CA-O 3.37Å; A317-L327 HydrophobicContact CB-CD2 3.43Å; A317-L327 VanDerWaalsContact CB-CD2 3.43Å; A317-L474 HydrophobicContact CB-CD2 3.91Å; A317-W476 HydrophobicContact CB-CZ2 4.28Å; A317-L483 HydrophobicContact CB-CD1 4.49Å; A317-L483 HydrophobicContact CB-CD2 4.03Å
318	S	98.5	Very high	96.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.3	172.7	59.2	0	0	0	0	110.7	H302 I325 L326	H302-S318 PolarHBondContact CE1-O 3.43Å; H302-S318 PolarHBondContact NE2-O 3.19Å; H302-S318 PolarHBondContact NE2-OG 2.79Å; S318-I325 CarbonylContact O-C 3.54Å; S318-I325 VanDerWaalsContact O-CA 3.23Å; S318-I325 WeakPolarHBondContact O-CA 3.23Å; S318-L326 PolarHBondContact N-O 3.26Å; S318-L326 PolarHBondContact O-N 3.03Å
319	G	98.3	Very high	96.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.1	176.4	0	0	0	0	0	111	V306 G307 A308	V306-G319 CarbonylContact C-O 3.57Å; V306-G319 WeakPolarHBondContact CA-O 3.42Å; G307-G319 PolarHBondContact N-O 2.85Å; G307-G319 VanDerWaalsContact N-O 3.15Å; A308-G319 PolarHBondContact N-O 3.34Å; A308-G319 PolarHBondContact O-N 3.37Å
320	S	98.5	Very high	96.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.135	C	C	.	.			trans	-127.5	163.7	-171.6	169.8	0	0	0	0	113.4	H302 A304 R305 D322 R323 Y324 V471	H302-S320 VanDerWaalsContact CE1-CB 3.44Å; H302-S320 WeakPolarHBondContact CE1-CB 3.46Å; H302-S320 WeakPolarHBondContact ND1-CB 3.44Å; A304-S320 PolarHBondContact O-OG 2.92Å; R305-S320 VanDerWaalsContact O-CA 3.23Å; R305-S320 WeakPolarHBondContact O-CA 3.43Å; R305-S320 WeakPolarHBondContact O-CB 3.46Å; R305-S320 PolarHBondContact O-OG 3.34Å; S320-D322 VanDerWaalsContact CB-OD1 3.3Å; S320-D322 WeakPolarHBondContact CB-OD1 3.47Å; S320-D322 PolarHBondContact O-N 3.27Å; S320-D322 VanDerWaalsContact OG-CG 3.28Å; S320-D322 PolarHBondContact OG-N 3.23Å; S320-D322 PolarHBondContact OG-OD1 2.78Å; S320-R323 PolarHBondContact O-N 3.4Å; S320-Y324 PolarHBondContact N-O 2.89Å; S320-V471 PolarHBondContact O-N 2.94Å; S320-V471 VanDerWaalsContact O-N 3.14Å
321	R	98.2	Very high	95.8	Very high	150 Å²	150	36 Å²	36	57%	0.566	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.3	165.2	-171.9	165.7	-175.8	-164.2	0.5	113.8	A304 R305 R323 E470	A304-R321 HydrophobicContact CB-CB 3.85Å; A304-R321 HydrophobicContact CB-CG 4.42Å; R305-R321 HydrophobicContact CG-CB 3.78Å; R305-R321 PolarHBondContact O-N 2.65Å; R321-R323 PolarHBondContact O-N 3.27Å; R321-E470 HydrophobicContact CB-CB 4.21Å; R321-E470 HydrophobicContact CB-CG 3.96Å; R321-E470 WeakPolarHBondContact CD-OE2 3.07Å; R321-E470 HydrophobicContact CG-CB 4.15Å; R321-E470 HydrophobicContact CG-CG 4.33Å; R321-E470 IonicContact NE-OE2 3.71Å
322	D	96.6	Very high	95.2	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.064	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-2.7	172.8	71.6	14.7	0	0	0	114.6	H302 I303 A304 S320 Y324	H302-D322 WeakPolarHBondContact CA-OD2 3.46Å; H302-D322 WeakPolarHBondContact CB-OD2 3.33Å; H302-D322 IonicContact CE1-OD1 3.4Å; H302-D322 IonicContact CG-OD2 3.32Å; H302-D322 IonicContact ND1-OD1 3.5Å; H302-D322 PolarHBondContact ND1-OD1 3.2Å; H302-D322 IonicContact ND1-OD2 2.73Å; H302-D322 PolarHBondContact ND1-OD2 3.12Å; I303-D322 HydrophobicContact CD1-CB 4.25Å; I303-D322 HydrophobicContact CG1-CB 3.5Å; I303-D322 VanDerWaalsContact CG1-CB 3.5Å; I303-D322 PolarHBondContact N-OD2 3.19Å; I303-D322 VanDerWaalsContact N-OD2 3.11Å; A304-D322 HydrophobicContact CB-CB 4.29Å; S320-D322 VanDerWaalsContact CB-OD1 3.3Å; S320-D322 WeakPolarHBondContact CB-OD1 3.47Å; S320-D322 PolarHBondContact O-N 3.27Å; S320-D322 VanDerWaalsContact OG-CG 3.28Å; S320-D322 PolarHBondContact OG-N 3.23Å; S320-D322 PolarHBondContact OG-OD1 2.78Å; D322-Y324 VanDerWaalsContact C-N 3.3Å; D322-Y324 WeakPolarHBondContact OD1-CB 3.27Å; D322-Y324 PolarHBondContact OD1-N 2.77Å
323	R	97.1	Very high	94	Very high	111 Å²	111	39.3 Å²	39.3	42%	0.419	19%	0.193	S	C	.	.	S	Bend	trans	81.6	-1.8	178.1	-45.2	165.3	-78.2	-163.9	-4.4	114.5	S320 R321 H467 R468	S320-R323 PolarHBondContact O-N 3.4Å; R321-R323 PolarHBondContact O-N 3.27Å; R323-H467 WeakPolarHBondContact CB-O 3.41Å; R323-R468 WeakPolarHBondContact CD-O 3.43Å
324	Y	96.2	Very high	92.3	Very high	65 Å²	65	39.8 Å²	39.8	26%	0.255	20%	0.197	S	C	.	.			trans	-97.4	154.9	-179.1	-56.9	-35.9	0	0	0	112.4	H302 S320 D322 L464 K465	H302-Y324 PolarHBondContact CE1-O 2.86Å; S320-Y324 PolarHBondContact N-O 2.89Å; D322-Y324 VanDerWaalsContact C-N 3.3Å; D322-Y324 WeakPolarHBondContact OD1-CB 3.27Å; D322-Y324 PolarHBondContact OD1-N 2.77Å; Y324-L464 WeakPolarHBondContact CA-O 3.48Å; Y324-K465 HydrophobicContact CD1-CB 3.94Å; Y324-K465 HydrophobicContact CD1-CD 4.43Å; Y324-K465 HydrophobicContact CD1-CG 3.68Å; Y324-K465 HydrophobicContact CE1-CB 3.86Å; Y324-K465 HydrophobicContact CE1-CD 4.04Å; Y324-K465 HydrophobicContact CE1-CG 3.72Å; Y324-K465 HydrophobicContact CG-CG 4.46Å
325	I	96.9	Very high	90.4	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.3	165.7	-50.6	164.9	0	0	0	107.9	A317 S318 L327 L464 V471 L474 L483 S485 W495	A317-I325 HydrophobicContact CB-CG2 4.28Å; S318-I325 CarbonylContact O-C 3.54Å; S318-I325 VanDerWaalsContact O-CA 3.23Å; S318-I325 WeakPolarHBondContact O-CA 3.23Å; I325-L327 HydrophobicContact CG2-CD2 4.25Å; I325-L464 HydrophobicContact CB-CB 4.05Å; I325-L464 HydrophobicContact CB-CD1 4.08Å; I325-L464 HydrophobicContact CB-CG 4.32Å; I325-L464 HydrophobicContact CD1-CD1 4.32Å; I325-L464 HydrophobicContact CG2-CD1 4.19Å; I325-L464 PolarHBondContact N-O 2.91Å; I325-L464 PolarHBondContact O-N 2.72Å; I325-V471 HydrophobicContact CD1-CG1 4.18Å; I325-V471 HydrophobicContact CG1-CG1 4.09Å; I325-V471 HydrophobicContact CG1-CG2 4.03Å; I325-L474 HydrophobicContact CD1-CD1 3.94Å; I325-L474 HydrophobicContact CG1-CD1 4.44Å; I325-L474 HydrophobicContact CG2-CD1 4.16Å; I325-L474 HydrophobicContact CG2-CD2 4.28Å; I325-L483 HydrophobicContact CG2-CD2 4.36Å; I325-S485 VanDerWaalsContact CD1-CB 3.41Å; I325-S485 WeakPolarHBondContact CD1-OG 3.45Å; I325-W495 HydrophobicContact CD1-CZ2 4.34Å
326	L	95.6	Very high	88.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.6	177.5	-58.7	177	0	0	0	109.5	H302 A317 S318 R328 V457 A460 V463	H302-L326 VanDerWaalsContact CE1-CG 3.49Å; H302-L326 WeakPolarHBondContact CE1-CG 3.35Å; H302-L326 WeakPolarHBondContact NE2-CD1 3.47Å; A317-L326 WeakPolarHBondContact CA-O 3.37Å; S318-L326 PolarHBondContact N-O 3.26Å; S318-L326 PolarHBondContact O-N 3.03Å; L326-R328 VanDerWaalsContact CD1-NH2 3.34Å; L326-V457 HydrophobicContact CD1-CG1 4.12Å; L326-V457 HydrophobicContact CD2-CB 4.34Å; L326-V457 HydrophobicContact CD2-CG1 4.49Å; L326-V457 HydrophobicContact CD2-CG2 4.09Å; L326-A460 HydrophobicContact CD2-CB 4.4Å; L326-V463 HydrophobicContact CD2-CB 4.07Å; L326-V463 HydrophobicContact CD2-CG1 3.66Å; L326-V463 HydrophobicContact CD2-CG2 3.63Å
327	L	95.1	Very high	85.8	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.1	171.3	-55.5	-169	0	0	0	108.7	L315 L316 A317 I325 A460 V461 R462 L464 W476 L483	L315-L327 HydrophobicContact CD1-CB 4.29Å; L316-L327 WeakPolarHBondContact O-CA 3.26Å; A317-L327 HydrophobicContact CB-CD2 3.43Å; A317-L327 VanDerWaalsContact CB-CD2 3.43Å; I325-L327 HydrophobicContact CG2-CD2 4.25Å; L327-A460 CarbonylContact O-C 3.57Å; L327-V461 PolarHBondContact O-N 2.89Å; L327-R462 HydrophobicContact CB-CB 4.23Å; L327-R462 HydrophobicContact CD1-CB 4.16Å; L327-R462 HydrophobicContact CG-CB 4.34Å; L327-R462 PolarHBondContact N-O 3.36Å; L327-R462 PolarHBondContact O-N 3.23Å; L327-L464 HydrophobicContact CD1-CD1 4.44Å; L327-L464 HydrophobicContact CD2-CD1 4.48Å; L327-L464 HydrophobicContact CG-CD1 4.42Å; L327-W476 HydrophobicContact CD1-CH2 4.38Å; L327-W476 HydrophobicContact CD1-CZ2 4.49Å; L327-W476 HydrophobicContact CD2-CZ2 4.03Å; L327-L483 HydrophobicContact CD2-CD2 3.98Å
328	R	93.5	Very high	82.9	Confident	7 Å²	7	52 Å²	52	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.1	-174.9	-59.2	-179.3	178.3	-90.6	13.6	109.9	N300 L316 L326 T330 P458	N300-R328 PolarHBondContact O-NH2 3.39Å; L316-R328 PolarHBondContact N-O 3.24Å; L316-R328 PolarHBondContact O-N 3.33Å; L326-R328 VanDerWaalsContact CD1-NH2 3.34Å; R328-T330 PolarHBondContact O-N 2.82Å; R328-P458 PolarHBondContact NH1-O 3Å
329	D	93.2	Very high	79.8	Confident	41 Å²	41	54.4 Å²	54.4	22%	0.219	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	114.9	166.2	-174.4	-24.8	0	0	0	107	R331 A332 V461	D329-R331 PolarHBondContact O-N 3.12Å; D329-R331 WeakPolarHBondContact OD1-CB 3.37Å; D329-R331 IonicContact OD1-CZ 2.7Å; D329-R331 PolarHBondContact OD1-N 2.94Å; D329-R331 IonicContact OD1-NE 3.78Å; D329-R331 PolarHBondContact OD1-NE 3.33Å; D329-R331 IonicContact OD1-NH2 3.16Å; D329-R331 IonicContact OD2-CZ 2.79Å; D329-R331 IonicContact OD2-NE 2.76Å; D329-R331 PolarHBondContact OD2-NE 3.43Å; D329-R331 IonicContact OD2-NH2 3.95Å; D329-R331 PolarHBondContact OD2-NH2 3.46Å; D329-A332 HydrophobicContact CB-CB 4.28Å; D329-A332 PolarHBondContact O-N 3.47Å; D329-V461 HydrophobicContact CB-CG2 4.01Å
330	T	91.3	Very high	76.8	Confident	8 Å²	8	61 Å²	61	5%	0.049	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.9	-175.2	62.2	0	0	0	0	112.5	R297 W311 D314 L316 R328	R297-T330 PolarHBondContact NE-O 2.87Å; R297-T330 PolarHBondContact NH1-O 3.36Å; R297-T330 PolarHBondContact NH2-O 2.81Å; R297-T330 VanDerWaalsContact NH2-O 3.1Å; W311-T330 HydrophobicContact CH2-CG2 3.85Å; W311-T330 HydrophobicContact CZ3-CG2 3.66Å; D314-T330 WeakPolarHBondContact O-CB 3.32Å; D314-T330 WeakPolarHBondContact O-CG2 3.41Å; D314-T330 PolarHBondContact O-N 2.88Å; D314-T330 PolarHBondContact O-OG1 2.88Å; L316-T330 HydrophobicContact CB-CG2 3.81Å; R328-T330 PolarHBondContact O-N 2.82Å
331	R	91.1	Very high	73.8	Confident	165 Å²	165	65.7 Å²	65.7	62%	0.623	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.2	177.5	-55.9	162.7	-62.3	178.4	21.4	113	D314 D329	D314-R331 HydrophobicContact CB-CG 4.02Å; D314-R331 WeakPolarHBondContact OD2-CD 3.39Å; D314-R331 IonicContact OD2-CZ 3.46Å; D314-R331 VanDerWaalsContact OD2-CZ 3.32Å; D314-R331 IonicContact OD2-NE 2.96Å; D314-R331 PolarHBondContact OD2-NE 3.25Å; D314-R331 IonicContact OD2-NH1 3.68Å; D314-R331 PolarHBondContact OD2-NH1 2.87Å; D329-R331 PolarHBondContact O-N 3.12Å; D329-R331 WeakPolarHBondContact OD1-CB 3.37Å; D329-R331 IonicContact OD1-CZ 2.7Å; D329-R331 PolarHBondContact OD1-N 2.94Å; D329-R331 IonicContact OD1-NE 3.78Å; D329-R331 PolarHBondContact OD1-NE 3.33Å; D329-R331 IonicContact OD1-NH2 3.16Å; D329-R331 IonicContact OD2-CZ 2.79Å; D329-R331 IonicContact OD2-NE 2.76Å; D329-R331 PolarHBondContact OD2-NE 3.43Å; D329-R331 IonicContact OD2-NH2 3.95Å; D329-R331 PolarHBondContact OD2-NH2 3.46Å
332	A	85	Confident	70.7	Confident	39 Å²	39	61.7 Å²	61.7	32%	0.322	41%	0.405	S	S	.	.	S	Bend	trans	-65.8	143.2	179.4	0	0	0	0	0	110.8	D329	D329-A332 HydrophobicContact CB-CB 4.28Å; D329-A332 PolarHBondContact O-N 3.47Å
333	S	72.4	Confident	67.6	Low	76 Å²	76	69.7 Å²	69.7	53%	0.531	44%	0.441	S	S	.	.			trans	-66.9	153.2	167	-176.1	0	0	0	0	109.5	N335 S336	S333-N335 PolarHBondContact O-N 3.03Å; S333-S336 WeakPolarHBondContact CB-OG 3.19Å; S333-S336 WeakPolarHBondContact O-CB 3.36Å; S333-S336 PolarHBondContact O-N 2.79Å
334	A	58.6	Low	64.7	Low	70 Å²	70	71.7 Å²	71.7	58%	0.579	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.8	-177.8	0	0	0	0	0	113
335	N	53.3	Low	61.8	Low	158 Å²	158	73.2 Å²	73.2	85%	0.845	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-1.6	179.5	-63.3	15.9	0	0	0	113.5	S333	S333-N335 PolarHBondContact O-N 3.03Å
336	S	52.6	Low	59	Low	77 Å²	77	80.9 Å²	80.9	54%	0.538	52%	0.517	S	S	.	.			trans	-95.4	14.7	-175.6	-53.2	0	0	0	0	114.1	S333 G338	S333-S336 WeakPolarHBondContact CB-OG 3.19Å; S333-S336 WeakPolarHBondContact O-CB 3.36Å; S333-S336 PolarHBondContact O-N 2.79Å; S336-G338 PolarHBondContact O-N 2.7Å; S336-G338 VanDerWaalsContact O-N 3.12Å
337	G	41.5	Very low	56.2	Low	36 Å²	36	86.5 Å²	86.5	37%	0.371	55%	0.551	S	S	.	*			trans	-69.2	103.1	179.4	0	0	0	0	0	112.1	G339	G337-G339 PolarHBondContact O-N 2.88Å
338	G	37	Very low	53.1	Low	65 Å²	65	93.2 Å²	93.2	67%	0.67	59%	0.587	S	S	*	*			trans	-76.5	112.9	-171	0	0	0	0	0	115	S336	S336-G338 PolarHBondContact O-N 2.7Å; S336-G338 VanDerWaalsContact O-N 3.12Å
339	G	34.3	Very low	50.7	Low	51 Å²	51	98.9 Å²	98.9	53%	0.526	63%	0.625	S	S	.	*			trans	-84.5	167.5	138	0	0	0	0	0	110.1	G337 A341	G337-G339 PolarHBondContact O-N 2.88Å; G339-A341 VanDerWaalsContact C-N 3.27Å; G339-A341 PolarHBondContact O-N 2.83Å
340	P	34.8	Very low	48.1	Very low	139 Å²	139	101.5 Å²	101.5	90%	0.903	65%	0.646	S	S	*	*			trans	-70.8	87.6	169.5	30.9	-32.9	0	0	0	108.9	G342	P340-G342 VanDerWaalsContact C-N 3.34Å; P340-G342 PolarHBondContact O-N 3.22Å
341	A	36.6	Very low	45.5	Very low	97 Å²	97	107.8 Å²	107.8	80%	0.802	68%	0.679	S	S	*	*			trans	-67.2	95.4	171.5	0	0	0	0	0	108.6	G339 H343	G339-A341 VanDerWaalsContact C-N 3.27Å; G339-A341 PolarHBondContact O-N 2.83Å; A341-H343 PolarHBondContact O-N 2.97Å; A341-H343 VanDerWaalsContact O-N 3.15Å
342	G	31.9	Very low	43	Very low	67 Å²	67	106.1 Å²	106.1	69%	0.691	69%	0.688	S	S	*	*			trans	-55.9	118.4	174.3	0	0	0	0	0	109.9	P340 L344	P340-G342 VanDerWaalsContact C-N 3.34Å; P340-G342 PolarHBondContact O-N 3.22Å; G342-L344 VanDerWaalsContact C-N 3.27Å; G342-L344 PolarHBondContact O-N 3.27Å
343	H	32.4	Very low	40.7	Very low	179 Å²	179	109 Å²	109	83%	0.829	71%	0.706	S	S	*	*			trans	-73.4	77.9	-176.7	-165.4	-56.7	0	0	0	110.4	A341	A341-H343 PolarHBondContact O-N 2.97Å; A341-H343 VanDerWaalsContact O-N 3.15Å
344	L	35.1	Very low	39.1	Very low	154 Å²	154	111.1 Å²	111.1	81%	0.806	72%	0.715	S	S	*	*			trans	-78.9	121.2	170.2	-70.6	177.4	0	0	0	109.4	G342 I346	G342-L344 VanDerWaalsContact C-N 3.27Å; G342-L344 PolarHBondContact O-N 3.27Å; L344-I346 PolarHBondContact O-N 3.4Å
345	P	36.2	Very low	38	Very low	96 Å²	96	115.4 Å²	115.4	62%	0.623	73%	0.727	S	S	*	*			trans	-71.4	124.7	174.3	29.6	-32.2	0	0	0	109.4	T347	P345-T347 PolarHBondContact O-N 3.31Å
346	I	37.3	Very low	37.2	Very low	163 Å²	163	113.8 Å²	113.8	84%	0.836	72%	0.724	S	S	*	*			trans	-71.4	102.8	170.8	-64.2	175.5	0	0	0	107.8	L344	L344-I346 PolarHBondContact O-N 3.4Å
347	T	37.3	Very low	36.5	Very low	119 Å²	119	114.3 Å²	114.3	73%	0.73	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-79.2	119.8	167.8	50.4	0	0	0	0	109.6	P345	P345-T347 PolarHBondContact O-N 3.31Å
348	N	30.8	Very low	36.2	Very low	151 Å²	151	121.1 Å²	121.1	81%	0.807	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-57.8	135	171.5	-76.3	-18.6	0	0	0	111.8
349	P	42.9	Very low	36.3	Very low	126 Å²	126	125.6 Å²	125.6	82%	0.818	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-91.7	125.9	149.8	32	-24.1	0	0	0	109.7
350	S	38.4	Very low	36.4	Very low	96 Å²	96	127 Å²	127	67%	0.671	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-83.6	157	-178.5	54.3	0	0	0	0	114.1
351	N	37.1	Very low	36.6	Very low	139 Å²	139	126.7 Å²	126.7	74%	0.743	76%	0.76	S	S	*	*			trans	94.5	145.1	146.8	-64.5	-20.5	0	0	0	121.6
352	T	36.9	Very low	36.6	Very low	130 Å²	130	132 Å²	132	80%	0.798	76%	0.759	S	S	*	*			trans	76.9	129.5	167.8	65.5	0	0	0	0	118
353	S	37.7	Very low	36.9	Very low	100 Å²	100	136.3 Å²	136.3	70%	0.699	77%	0.767	S	S	*	*			cis	-175.7	168.9	-18.7	38.4	0	0	0	0	110.6
354	V	38	Very low	37	Very low	120 Å²	120	136.6 Å²	136.6	73%	0.727	77%	0.768	S	S	*	*			trans	81.3	98.7	166.3	-166.4	0	0	0	0	114.3
355	L	36.5	Very low	37.4	Very low	160 Å²	160	137.6 Å²	137.6	84%	0.838	77%	0.772	S	S	*	*				65.2	133.2	83.7	-62.1	168	0	0	0	112.6
356	T	36.2	Very low	37.1	Very low	125 Å²	125	141 Å²	141	77%	0.767	78%	0.782	S	S	*	*			cis	-149	137.7	16.5	41.7	0	0	0	0	109.3
357	A	36.8	Very low	37.2	Very low	88 Å²	88	138.9 Å²	138.9	73%	0.727	78%	0.777	S	S	*	*				87.2	144.2	72.2	0	0	0	0	0	116.2
358	E	36.5	Very low	37.2	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	78%	0.775	S	S	*	*			trans	73.3	144.8	173.8	-57.1	-169.7	121.2	0	0	118.8
359	L	38.3	Very low	37.6	Very low	158 Å²	158	140.2 Å²	140.2	83%	0.827	77%	0.772	S	S	*	*			cis	-158.5	174.8	-16.3	-113.6	169.2	0	0	0	109.2
360	A	36.1	Very low	37.4	Very low	82 Å²	82	140.8 Å²	140.8	68%	0.678	77%	0.768	S	S	*	*			trans	-124	149.4	-175.7	0	0	0	0	0	113.8
361	D	39.2	Very low	37.4	Very low	131 Å²	131	140.2 Å²	140.2	70%	0.701	76%	0.764	S	S	*	*			trans	175.2	126.6	145.3	-100.8	-25.1	0	0	0	108.7
362	R	37.1	Very low	37.4	Very low	208 Å²	208	141.1 Å²	141.1	79%	0.785	77%	0.767	S	S	*	*				74.4	123.2	90.4	-81.2	-173.2	170.2	144	-10.1	116.4
363	D	39.2	Very low	37.4	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	77%	0.766	S	S	*	*				179.5	155.5	102	-95.9	-23.4	0	0	0	113.6
364	E	34	Very low	37.2	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	77%	0.768	S	S	*	*			trans	-90	167.5	173.2	-60.7	177.9	129.7	0	0	111.7
365	I	42.3	Very low	37.7	Very low	175 Å²	175	140 Å²	140	90%	0.897	77%	0.767	S	S	*	*			trans	-162.1	144	140.9	-100	146.6	0	0	0	110.1
366	M	31.2	Very low	37.8	Very low	168 Å²	168	137.9 Å²	137.9	83%	0.828	77%	0.766	S	S	*	*			trans	-124.4	-169.9	-175.2	-158.2	-179.2	-178.1	0	0	109.9
367	T	37.8	Very low	37.8	Very low	119 Å²	119	140.1 Å²	140.1	73%	0.73	77%	0.767	S	S	*	*			trans	87.1	145.4	173.1	77.2	0	0	0	0	117
368	D	38.4	Very low	38	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	77%	0.766	S	S	*	*			cis	-167.6	179.9	-22.3	-102.3	-28.8	0	0	0	111
369	F	38.6	Very low	38.1	Very low	171 Å²	171	139.7 Å²	139.7	75%	0.75	76%	0.757	S	S	*	*			trans	98.2	100.5	154.3	-74.5	-80.7	0	0	0	121.9
370	N	39	Very low	37.8	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	76%	0.757	S	S	*	*				62.1	144.7	123.9	-73.8	5.7	0	0	0	121.9
371	S	38.5	Very low	37.9	Very low	83 Å²	83	142.8 Å²	142.8	58%	0.58	76%	0.761	S	S	*	*			cis	-178.4	148	-4.4	47.8	0	0	0	0	112.3
372	I	37.2	Very low	37.6	Very low	159 Å²	159	145 Å²	145	82%	0.815	77%	0.767	S	S	*	*			trans	61.9	135.4	140.2	-64.2	167.2	0	0	0	117.6
373	S	37.9	Very low	37.7	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	76%	0.763	S	S	*	*			cis	-165.1	166.1	-1	45.1	0	0	0	0	111.6
374	S	32.4	Very low	37.5	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	76%	0.76	S	S	*	*			trans	-107.6	-164.5	174.8	62.9	0	0	0	0	111.5
375	P	48.4	Very low	37.7	Very low	109 Å²	109	135.5 Å²	135.5	71%	0.708	75%	0.754	S	S	*	*			cis	-135.6	-157.8	-21.6	34.1	-11.1	0	0	0	113.7
376	S	38.7	Very low	37.5	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	75%	0.751	S	S	*	*			trans	84	153.5	160.4	80.8	0	0	0	0	118.5
377	H	37.4	Very low	37.7	Very low	172 Å²	172	137 Å²	137	80%	0.796	75%	0.753	S	S	*	*			cis	-169.7	173.7	-32.2	-157.3	-70	0	0	0	106.8
378	I	40.2	Very low	38	Very low	137 Å²	137	137.4 Å²	137.4	70%	0.703	76%	0.757	S	S	*	*			trans	108.5	110.9	158.2	-62.5	164.5	0	0	0	118.6
379	D	37.8	Very low	37.7	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	77%	0.766	S	S	*	*			trans	51.8	116.8	134.1	-51.1	-15.7	0	0	0	122.2
380	Q	33.3	Very low	37.7	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	77%	0.773	S	S	*	*				69.8	122.4	91	-64.9	-166.5	-0.3	0	0	116.1
381	V	37.9	Very low	37.4	Very low	126 Å²	126	137.4 Å²	137.4	76%	0.764	77%	0.771	S	S	*	*				172.7	151.7	115	156.7	0	0	0	0	110.4
382	E	33.4	Very low	37.4	Very low	177 Å²	177	140.3 Å²	140.3	83%	0.827	79%	0.785	S	S	*	*			trans	-35.9	161.1	173.5	-50.2	163.3	143.3	0	0	115.6
383	S	38	Very low	37.4	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	78%	0.781	S	S	*	*			cis	-172.6	165.1	42	48.6	0	0	0	0	114.7
384	D	36.1	Very low	37.4	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	79%	0.789	S	S	*	*			trans	57.3	112.5	143.3	-66.9	-9.9	0	0	0	124.7
385	S	37.9	Very low	37.6	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	79%	0.787	S	S	*	*				137.7	148.7	101.5	66.5	0	0	0	0	118.7
386	N	37	Very low	36.7	Very low	156 Å²	156	142.5 Å²	142.5	83%	0.834	79%	0.791	S	S	*	*			trans	75.4	101.8	156.3	-66.4	-28	0	0	0	122.7
387	Y	35.4	Very low	36.6	Very low	219 Å²	219	144.2 Å²	144.2	86%	0.859	79%	0.79	S	S	*	*			trans	-58.3	162	146.9	-81.1	-93	0	0	0	112.3
388	P	43.9	Very low	36.3	Very low	127 Å²	127	141 Å²	141	83%	0.825	79%	0.787	S	S	*	*				-137.9	157.9	94.5	31.8	-15.5	0	0	0	116.4
389	R	32.8	Very low	36.3	Very low	230 Å²	230	139.4 Å²	139.4	87%	0.868	79%	0.787	S	S	*	*			trans	-76	139	177.3	174.1	-168.6	-167.7	174.9	2.5	111.8
390	A	39.1	Very low	36.2	Very low	107 Å²	107	141 Å²	141	88%	0.884	80%	0.796	S	S	*	*			trans	-136.1	132.6	162.4	0	0	0	0	0	110.7
391	S	32.4	Very low	36.5	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	80%	0.797	S	S	*	*			trans	-132.7	131.3	-176.8	52.2	0	0	0	0	109.7
392	T	38.8	Very low	36.8	Very low	143 Å²	143	139.6 Å²	139.6	88%	0.877	80%	0.795	S	S	*	*			trans	-143.1	143.9	167.1	32.6	0	0	0	0	111
393	P	37	Very low	36.9	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	80%	0.797	S	S	*	*			trans	-99.4	155.4	178.8	38	-33	0	0	0	112.4
394	M	38.3	Very low	37.2	Very low	188 Å²	188	141.5 Å²	141.5	93%	0.926	80%	0.801	S	S	*	*			trans	-134.9	109.9	152.7	-76.5	-150.8	-178.6	0	0	107.9
395	V	36.5	Very low	37.5	Very low	117 Å²	117	141.1 Å²	141.1	71%	0.709	80%	0.799	S	S	*	*				79.4	103.7	79.1	170.8	0	0	0	0	110.8
396	S	29.8	Very low	38.8	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	80%	0.8	S	S	*	*			trans	-65.9	130.8	169	48.2	0	0	0	0	111.3
397	I	36.2	Very low	39.5	Very low	152 Å²	152	140.3 Å²	140.3	78%	0.779	80%	0.8	S	S	*	*			trans	-113.7	105.3	159.2	-64.8	176.8	0	0	0	107
398	S	31.4	Very low	39.8	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	80%	0.796	S	S	*	*			trans	-71.4	130	162.6	43.7	0	0	0	0	109.2
399	S	38.6	Very low	39.6	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	80%	0.797	S	S	*	*			trans	-135	106.2	165.1	56.7	0	0	0	0	107.9
400	D	35.4	Very low	40	Very low	155 Å²	155	130.3 Å²	130.3	83%	0.829	79%	0.792	S	S	*	*			trans	-65.8	135.1	174.5	-55.1	-70.5	0	0	0	110.4
401	L	41.1	Very low	40	Very low	165 Å²	165	129.8 Å²	129.8	86%	0.864	79%	0.788	S	S	*	*			trans	-132	135.9	161	-80.5	174.7	0	0	0	108.6
402	P	44.1	Very low	40.1	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	79%	0.79	S	S	*	*			trans	-81	154.8	-161.7	32	-36.7	0	0	0	113.8
403	E	35.4	Very low	40	Very low	189 Å²	189	134.9 Å²	134.9	88%	0.883	79%	0.793	S	S	*	*			trans	-55.8	135.6	164.9	-139.4	162.2	-174.4	0	0	110.3
404	V	44.1	Very low	39.8	Very low	129 Å²	129	135.7 Å²	135.7	78%	0.782	79%	0.791	S	S	*	*			trans	-124.1	110.2	174.3	177.5	0	0	0	0	108.3
405	D	43.1	Very low	39.8	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.1	141.7	177.5	-70.4	-56.4	0	0	0	112.4
406	P	64.9	Low	39.6	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75	136.4	164.1	31.3	-31.9	0	0	0	110.4
407	P	52.1	Low	39.8	Very low	128 Å²	128	137.7 Å²	137.7	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74	157.6	-175.3	30.2	-35.7	0	0	0	113.6
408	S	40.8	Very low	39.8	Very low	113 Å²	113	138 Å²	138	79%	0.79	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72.3	164.9	-177.6	40.8	0	0	0	0	115
409	T	40.1	Very low	39.8	Very low	135 Å²	135	136 Å²	136	83%	0.828	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-49	160.7	175.8	42.9	0	0	0	0	115.6
410	P	41.6	Very low	39.7	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	80%	0.797	S	S	*	*				-136.7	155.1	123.8	38.1	-28.8	0	0	0	116.2
411	A	39	Very low	39.7	Very low	96 Å²	96	143.8 Å²	143.8	79%	0.793	80%	0.795	S	S	*	*			trans	68.6	110.2	146.5	0	0	0	0	0	121.2
412	Q	34.1	Very low	39.5	Very low	158 Å²	158	142 Å²	142	74%	0.738	79%	0.786	S	S	*	*			trans	-47.9	148.6	150.5	-70.9	145.2	-90	0	0	113.7
413	M	37.2	Very low	39.2	Very low	192 Å²	192	140.9 Å²	140.9	95%	0.946	79%	0.786	S	S	*	*			trans	-136	121.9	135.8	-74.3	-166.6	173.8	0	0	108.7
414	D	31.3	Very low	39.3	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	78%	0.779	S	S	*	*			trans	-82.2	136.3	177.1	-52	-65.8	0	0	0	110.6
415	I	38	Very low	39.1	Very low	175 Å²	175	141 Å²	141	90%	0.897	78%	0.782	S	S	*	*			trans	-138.2	126.3	144.7	-63.6	-171.6	0	0	0	107.8
416	D	33.9	Very low	38.8	Very low	133 Å²	133	137.7 Å²	137.7	71%	0.711	78%	0.78	S	S	*	*			trans	-100.9	162.6	-169.2	-130.7	-23.5	0	0	0	113.1
417	M	33.6	Very low	37.5	Very low	151 Å²	151	137.4 Å²	137.4	74%	0.744	78%	0.782	S	S	*	*			trans	81	142.3	144.6	-100.4	-170.7	-73.5	0	0	124.2
418	L	36.2	Very low	36.6	Very low	158 Å²	158	136 Å²	136	83%	0.827	77%	0.774	S	S	*	*			trans	69.9	117.2	167.6	-39.9	-174.3	0	0	0	116.2
419	G	30.6	Very low	36.4	Very low	64 Å²	64	142.2 Å²	142.2	66%	0.66	78%	0.781	S	S	*	*			cis	99.5	91.6	1.5	0	0	0	0	0	113.8
420	F	37.1	Very low	36.1	Very low	216 Å²	216	140.5 Å²	140.5	95%	0.947	78%	0.775	S	S	*	*			trans	-157.5	168	152.1	-109.3	-73.1	0	0	0	110.8
421	R	35.3	Very low	35.9	Very low	204 Å²	204	139.2 Å²	139.2	77%	0.77	77%	0.774	S	S	*	*			trans	-121.5	160.9	-156.6	-59.9	165.9	55	159.6	1.6	113.9
422	D	36.6	Very low	35.9	Very low	127 Å²	127	138.9 Å²	138.9	68%	0.679	77%	0.771	S	S	*	*			trans	71	123.7	145.3	-58.8	-29.7	0	0	0	121
423	A	38.6	Very low	35.9	Very low	87 Å²	87	142.9 Å²	142.9	72%	0.719	78%	0.779	S	S	*	*			trans	97.1	121.2	133.4	0	0	0	0	0	122.7
424	D	37.5	Very low	36	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	78%	0.779	S	S	*	*			trans	89.2	115.9	130.7	-67.6	2.4	0	0	0	124.8
425	H	39.9	Very low	36.1	Very low	183 Å²	183	140.3 Å²	140.3	85%	0.847	78%	0.784	S	S	*	*			trans	61.8	122.6	135.5	-64.6	-54.7	0	0	0	122.8
426	G	36.8	Very low	36.3	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	78%	0.781	S	S	*	*			trans	135.2	112.1	130.7	0	0	0	0	0	118.8
427	S	38	Very low	36.5	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	79%	0.789	S	S	*	*			trans	28	108.7	142.6	54.2	0	0	0	0	119.7
428	S	33.2	Very low	36.7	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	79%	0.791	S	S	*	*				100.6	169.7	76.3	77.9	0	0	0	0	113.5
429	W	35.7	Very low	36.9	Very low	244 Å²	244	135.2 Å²	135.2	92%	0.924	79%	0.79	S	S	*	*			trans	99.2	131.2	178.2	-64.4	87	0	0	0	118.9
430	S	34.3	Very low	37.2	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	80%	0.795	S	S	*	*			trans	-94.2	160.2	-169.5	52.2	0	0	0	0	114.6
431	A	37.3	Very low	37.2	Very low	92 Å²	92	134.5 Å²	134.5	76%	0.76	79%	0.791	S	S	*	*				140.1	155.1	114.5	0	0	0	0	0	116.1
432	A	37.7	Very low	37.1	Very low	89 Å²	89	133.2 Å²	133.2	74%	0.736	79%	0.793	S	S	*	*			trans	61.4	108.4	165.8	0	0	0	0	0	117.8
433	R	34.5	Very low	37.2	Very low	242 Å²	242	133.2 Å²	133.2	91%	0.913	80%	0.798	S	S	*	*				59.2	108	76.3	-69.5	-167.3	-165.6	-155.5	5.2	115.3
434	T	39.1	Very low	37.1	Very low	154 Å²	154	135.8 Å²	135.8	95%	0.945	81%	0.805	S	S	*	*				-161.3	157	116.6	17.8	0	0	0	0	111.5
435	S	35.2	Very low	36.9	Very low	115 Å²	115	133.6 Å²	133.6	80%	0.804	81%	0.806	S	S	*	*			trans	-103	147.9	-168.6	51.1	0	0	0	0	114.3
436	A	41.7	Very low	36.5	Very low	100 Å²	100	133.6 Å²	133.6	83%	0.826	81%	0.812	S	S	*	*			trans	-150.8	142.4	155	0	0	0	0	0	110.9
437	N	37.6	Very low	36.2	Very low	166 Å²	166	138.7 Å²	138.7	89%	0.888	82%	0.817	S	S	*	*			trans	-93.8	142.1	-177.4	-69.6	-30.7	0	0	0	112.3
438	S	38.6	Very low	35.8	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	82%	0.82	S	S	*	*			trans	-161.9	107.1	146.3	49	0	0	0	0	114
439	T	38.9	Very low	35.7	Very low	132 Å²	132	142.8 Å²	142.8	81%	0.81	83%	0.83	S	S	*	*			trans	26	102.1	141	51.1	0	0	0	0	121.1
440	V	37.4	Very low	35.5	Very low	125 Å²	125	139.3 Å²	139.3	76%	0.758	82%	0.824	S	S	*	*			trans	18.5	116.6	131.1	-171.5	0	0	0	0	119.1	Q442	V440-Q442 HydrophobicContact CG1-CG 4.19Å
441	T	37.4	Very low	35.2	Very low	139 Å²	139	142.9 Å²	142.9	85%	0.853	84%	0.835	S	S	*	*			trans	-132.8	123.5	141.6	46.1	0	0	0	0	109
442	Q	33.9	Very low	34.9	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	84%	0.839	S	S	*	*			trans	-88.7	111.3	-177.1	-70.3	178.6	-7.3	0	0	112.3	V440	V440-Q442 HydrophobicContact CG1-CG 4.19Å
443	T	37.8	Very low	35	Very low	128 Å²	128	144.6 Å²	144.6	79%	0.785	84%	0.844	S	S	*	*			trans	-162.1	153.9	149.9	2.7	0	0	0	0	111.1
444	T	36.2	Very low	35.8	Very low	140 Å²	140	139.1 Å²	139.1	86%	0.859	83%	0.833	S	S	*	*			trans	54.4	93.4	167.5	48	0	0	0	0	118.8
445	A	34.4	Very low	36.7	Very low	92 Å²	92	137.8 Å²	137.8	76%	0.76	81%	0.81	S	S	*	*			trans	179.5	105.2	134.8	0	0	0	0	0	111.4
446	L	31.9	Very low	38.2	Very low	183 Å²	183	139.6 Å²	139.6	96%	0.958	81%	0.811	S	S	*	*			trans	-115.9	64.4	165.1	-78.6	179.5	0	0	0	110.3
447	Q	30.3	Very low	39.9	Very low	175 Å²	175	135.7 Å²	135.7	82%	0.818	78%	0.776	S	S	*	*	S	Bend	trans	-149	143	166	-97.7	168.3	19.4	0	0	108.7
448	S	29.2	Very low	41.7	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	77%	0.766	S	S	*	*			trans	66.6	71	177.1	65.8	0	0	0	0	119.5
449	I	31.3	Very low	43.6	Very low	173 Å²	173	128.2 Å²	128.2	89%	0.887	74%	0.738	S	S	*	*			trans	-134.9	64.2	149.3	-46.4	178.8	0	0	0	109.9
450	E	30.6	Very low	45.8	Very low	171 Å²	171	122.6 Å²	122.6	80%	0.799	71%	0.705	S	S	*	*			trans	-137.1	69.8	170.2	-75	-158.6	157.5	0	0	111.1
451	N	28.8	Very low	48.2	Very low	175 Å²	175	120.6 Å²	120.6	94%	0.936	69%	0.692	S	S	*	*	S	Bend	trans	-162.4	121.1	163.6	-88.5	-43.2	0	0	0	108.5
452	G	31.2	Very low	50.8	Low	82 Å²	82	115.1 Å²	115.1	85%	0.845	66%	0.656	S	S	*	*			trans	135	-14.7	157.4	0	0	0	0	0	119.8
453	T	39.6	Very low	53.5	Low	135 Å²	135	108.3 Å²	108.3	83%	0.828	63%	0.627	S	S	*	*			trans	-94.1	117.5	173.6	52.8	0	0	0	0	111.1	R455	T453-R455 VanDerWaalsContact C-N 3.31Å; T453-R455 PolarHBondContact O-N 2.8Å
454	D	51.6	Low	56.2	Low	128 Å²	128	102.5 Å²	102.5	68%	0.684	59%	0.591	S	S	*	*			trans	-71	90.5	177.1	-160.4	15.4	0	0	0	108.7	L456 K465	D454-L456 VanDerWaalsContact C-N 3.35Å; D454-L456 PolarHBondContact O-N 3.44Å; D454-K465 IonicContact OD1-NZ 3.73Å; D454-K465 PolarHBondContact OD1-NZ 3.16Å
455	R	57	Low	59	Low	125 Å²	125	99.4 Å²	99.4	47%	0.472	57%	0.565	S	S	.	*			trans	-60.3	93.7	-174.4	-170.2	177.7	-175.4	173	-1.3	110.5	I303 T453 V457	I303-R455 VanDerWaalsContact CG2-NH2 3.34Å; T453-R455 VanDerWaalsContact C-N 3.31Å; T453-R455 PolarHBondContact O-N 2.8Å; R455-V457 HydrophobicContact CG-CG2 4.41Å; R455-V457 PolarHBondContact O-N 3.23Å; R455-V457 VanDerWaalsContact O-N 3.09Å
456	L	66.8	Low	61.8	Low	154 Å²	154	97.5 Å²	97.5	81%	0.806	54%	0.542	S	S	*	.			trans	-61	106.3	168	-75.6	163.1	0	0	0	107.7	D454 P458	D454-L456 VanDerWaalsContact C-N 3.35Å; D454-L456 PolarHBondContact O-N 3.44Å; L456-P458 WeakPolarHBondContact O-CD 3.26Å
457	V	78	Confident	65	Low	17 Å²	17	89.1 Å²	89.1	10%	0.103	50%	0.498	C	S	.	.			trans	-89.4	117.2	175.7	178.3	0	0	0	0	108.1	L326 R455 G459 A460 V463	L326-V457 HydrophobicContact CD1-CG1 4.12Å; L326-V457 HydrophobicContact CD2-CB 4.34Å; L326-V457 HydrophobicContact CD2-CG1 4.49Å; L326-V457 HydrophobicContact CD2-CG2 4.09Å; R455-V457 HydrophobicContact CG-CG2 4.41Å; R455-V457 PolarHBondContact O-N 3.23Å; R455-V457 VanDerWaalsContact O-N 3.09Å; V457-G459 PolarHBondContact O-N 2.98Å; V457-A460 HydrophobicContact CB-CB 4Å; V457-A460 HydrophobicContact CG1-CB 4.25Å; V457-A460 WeakPolarHBondContact O-CB 3.26Å; V457-A460 PolarHBondContact O-N 3.37Å; V457-A460 VanDerWaalsContact O-N 3.07Å; V457-V463 HydrophobicContact CB-CG2 4.46Å; V457-V463 HydrophobicContact CG2-CG2 4.39Å
458	P	74	Confident	68.1	Low	104 Å²	104	89.5 Å²	89.5	68%	0.675	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	137.5	178.7	-27.5	36.3	0	0	0	112.3	R328 L456 A460	R328-P458 PolarHBondContact NH1-O 3Å; L456-P458 WeakPolarHBondContact O-CD 3.26Å; P458-A460 PolarHBondContact O-N 3Å
459	G	79.2	Confident	71.4	Confident	18 Å²	18	86.7 Å²	86.7	19%	0.186	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	9.1	-177.4	0	0	0	0	0	115.7	V457	V457-G459 PolarHBondContact O-N 2.98Å
460	A	84.8	Confident	74.6	Confident	14 Å²	14	79 Å²	79	12%	0.116	43%	0.426	C	S	.	.			trans	-88.6	129.4	167.2	0	0	0	0	0	110.1	L326 L327 V457 P458 V463	L326-A460 HydrophobicContact CD2-CB 4.4Å; L327-A460 CarbonylContact O-C 3.57Å; V457-A460 HydrophobicContact CB-CB 4Å; V457-A460 HydrophobicContact CG1-CB 4.25Å; V457-A460 WeakPolarHBondContact O-CB 3.26Å; V457-A460 PolarHBondContact O-N 3.37Å; V457-A460 VanDerWaalsContact O-N 3.07Å; P458-A460 PolarHBondContact O-N 3Å; A460-V463 HydrophobicContact CB-CG2 4.12Å
461	V	88.7	Confident	77.8	Confident	82 Å²	82	70.9 Å²	70.9	50%	0.497	39%	0.388	S	S	.	.	S	Bend	trans	-77.4	-34.2	173	-179	0	0	0	0	110.4	L327 D329	L327-V461 PolarHBondContact O-N 2.89Å; D329-V461 HydrophobicContact CB-CG2 4.01Å
462	R	90.7	Very high	81.1	Confident	24 Å²	24	62.6 Å²	62.6	9%	0.091	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	148.6	174.5	-165.1	172.5	172.1	-158	-6.4	110.2	L327 L464 S496 P500 G503	L327-R462 HydrophobicContact CB-CB 4.23Å; L327-R462 HydrophobicContact CD1-CB 4.16Å; L327-R462 HydrophobicContact CG-CB 4.34Å; L327-R462 PolarHBondContact N-O 3.36Å; L327-R462 PolarHBondContact O-N 3.23Å; R462-L464 HydrophobicContact CG-CD2 3.8Å; R462-S496 PolarHBondContact NH1-O 3.14Å; R462-P500 PolarHBondContact NH2-O 2.89Å; R462-G503 PolarHBondContact NH2-O 3Å
463	V	92.3	Very high	84.3	Confident	35 Å²	35	58.8 Å²	58.8	21%	0.212	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120	174.2	-174.5	0	0	0	0	107.9	L326 V457 A460 K465	L326-V463 HydrophobicContact CD2-CB 4.07Å; L326-V463 HydrophobicContact CD2-CG1 3.66Å; L326-V463 HydrophobicContact CD2-CG2 3.63Å; V457-V463 HydrophobicContact CB-CG2 4.46Å; V457-V463 HydrophobicContact CG2-CG2 4.39Å; A460-V463 HydrophobicContact CB-CG2 4.12Å; V463-K465 HydrophobicContact CG1-CD 4.18Å; V463-K465 HydrophobicContact CG1-CG 3.8Å
464	L	94.5	Very high	87.1	Confident	6 Å²	6	53 Å²	53	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.4	-179.7	-44.5	174.5	0	0	0	108.9	Y324 I325 L327 R462 L483 W495	Y324-L464 WeakPolarHBondContact CA-O 3.48Å; I325-L464 HydrophobicContact CB-CB 4.05Å; I325-L464 HydrophobicContact CB-CD1 4.08Å; I325-L464 HydrophobicContact CB-CG 4.32Å; I325-L464 HydrophobicContact CD1-CD1 4.32Å; I325-L464 HydrophobicContact CG2-CD1 4.19Å; I325-L464 PolarHBondContact N-O 2.91Å; I325-L464 PolarHBondContact O-N 2.72Å; L327-L464 HydrophobicContact CD1-CD1 4.44Å; L327-L464 HydrophobicContact CD2-CD1 4.48Å; L327-L464 HydrophobicContact CG-CD1 4.42Å; R462-L464 HydrophobicContact CG-CD2 3.8Å; L464-L483 HydrophobicContact CD1-CD2 4.15Å; L464-W495 HydrophobicContact CB-CD2 4.45Å; L464-W495 HydrophobicContact CB-CE3 4.21Å; L464-W495 HydrophobicContact CB-CH2 3.67Å; L464-W495 HydrophobicContact CB-CZ2 3.95Å; L464-W495 HydrophobicContact CB-CZ3 3.83Å; L464-W495 HydrophobicContact CD1-CB 4.47Å; L464-W495 HydrophobicContact CD1-CD2 3.76Å; L464-W495 HydrophobicContact CD1-CE3 4.07Å; L464-W495 HydrophobicContact CD1-CG 3.95Å; L464-W495 HydrophobicContact CD1-CZ2 4.47Å; L464-W495 HydrophobicContact CD2-CD2 4.45Å; L464-W495 HydrophobicContact CD2-CE3 3.92Å; L464-W495 HydrophobicContact CD2-CZ3 4.09Å; L464-W495 HydrophobicContact CG-CD2 4.45Å; L464-W495 HydrophobicContact CG-CE3 4.29Å; L464-W495 HydrophobicContact CG-CZ3 4.37Å
465	K	93	Very high	89.3	Confident	74 Å²	74	52.1 Å²	52.1	32%	0.322	26%	0.259	S	S	.	.			trans	-131.6	32.3	-162	-55.4	-174.8	178.2	175.8	0	115.2	Y324 D454 V463	Y324-K465 HydrophobicContact CD1-CB 3.94Å; Y324-K465 HydrophobicContact CD1-CD 4.43Å; Y324-K465 HydrophobicContact CD1-CG 3.68Å; Y324-K465 HydrophobicContact CE1-CB 3.86Å; Y324-K465 HydrophobicContact CE1-CD 4.04Å; Y324-K465 HydrophobicContact CE1-CG 3.72Å; Y324-K465 HydrophobicContact CG-CG 4.46Å; D454-K465 IonicContact OD1-NZ 3.73Å; D454-K465 PolarHBondContact OD1-NZ 3.16Å; V463-K465 HydrophobicContact CG1-CD 4.18Å; V463-K465 HydrophobicContact CG1-CG 3.8Å
466	D	94.9	Very high	91.3	Very high	52 Å²	52	47.2 Å²	47.2	28%	0.278	24%	0.24	S	C	.	.			trans	-100	-24.5	-173.3	-159.4	-73.9	0	0	0	113.6	R491 L493 W495 P505	D466-R491 PolarHBondContact O-NH1 2.88Å; D466-R491 IonicContact OD1-CZ 3.03Å; D466-R491 IonicContact OD1-NH1 2.92Å; D466-R491 PolarHBondContact OD1-NH1 2.93Å; D466-R491 IonicContact OD1-NH2 3.93Å; D466-R491 PolarHBondContact OD1-NH2 2.87Å; D466-L493 HydrophobicContact CB-CD1 3.78Å; D466-W495 HydrophobicContact CB-CH2 3.49Å; D466-W495 VanDerWaalsContact CB-CH2 3.49Å; D466-W495 HydrophobicContact CB-CZ2 4.16Å; D466-W495 HydrophobicContact CB-CZ3 4.37Å; D466-P505 HydrophobicContact CB-CG 4.4Å; D466-P505 VanDerWaalsContact OD2-CD 3.26Å; D466-P505 WeakPolarHBondContact OD2-CD 3.43Å
467	H	97.5	Very high	92.7	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.037	20%	0.204	C	C	.	.			trans	-67.3	146.5	174.3	-79.4	-68	0	0	0	111.8	R323 V471 S485 G487 D489 R491	R323-H467 WeakPolarHBondContact CB-O 3.41Å; H467-V471 HydrophobicContact CB-CG2 4.05Å; H467-S485 PolarHBondContact NE2-OG 2.81Å; H467-G487 PolarHBondContact CE1-N 3.13Å; H467-D489 VanDerWaalsContact CA-OD2 3.26Å; H467-D489 WeakPolarHBondContact CA-OD2 3.29Å; H467-D489 IonicContact CE1-OD1 3.58Å; H467-D489 IonicContact CG-OD2 3.39Å; H467-D489 IonicContact ND1-OD1 2.9Å; H467-D489 PolarHBondContact ND1-OD1 3.02Å; H467-D489 IonicContact ND1-OD2 3.81Å; H467-D489 PolarHBondContact ND1-OD2 3.39Å; H467-D489 VanDerWaalsContact ND1-OD2 3.16Å; H467-R491 PolarHBondContact CE1-O 2.89Å
468	R	97.1	Very high	93.5	Very high	183 Å²	183	43 Å²	43	69%	0.691	22%	0.222	S	C	*	.	S	Bend	trans	-104.2	-9.9	-179.4	-58.3	-177	-174.1	174	4.2	113.7	R323 D489	R323-R468 WeakPolarHBondContact CD-O 3.43Å; R468-D489 HydrophobicContact CB-CB 4Å; R468-D489 PolarHBondContact N-OD2 3.27Å
469	Q	97.4	Very high	94.5	Very high	60 Å²	60	40.7 Å²	40.7	28%	0.28	20%	0.204	S	C	.	.	S	Bend	trans	-142.8	-173.5	175.5	-58.7	-165.5	45	0	0	110.4	V471 N488 D489	Q469-V471 PolarHBondContact O-N 3.45Å; Q469-N488 HydrophobicContact CB-CB 3.86Å; Q469-N488 VanDerWaalsContact CD-O 3.26Å; Q469-N488 PolarHBondContact NE2-O 3.16Å; Q469-N488 PolarHBondContact OE1-ND2 2.85Å; Q469-N488 PolarHBondContact OE1-O 2.84Å; Q469-D489 HydrophobicContact CB-CB 4.15Å; Q469-D489 HydrophobicContact CG-CB 4.15Å
470	E	98.1	Very high	95.2	Very high	13 Å²	13	41.4 Å²	41.4	6%	0.061	21%	0.207	C	C	.	.			trans	-53.3	130.5	-176.4	178.6	156.6	-156.9	0	0	113.8	R305 R321 C472 G487 N488	R305-E470 IonicContact CZ-OE1 2.6Å; R305-E470 IonicContact CZ-OE2 3.5Å; R305-E470 IonicContact NE-OE1 3.77Å; R305-E470 PolarHBondContact NE-OE1 3Å; R305-E470 IonicContact NE-OE2 3.27Å; R305-E470 PolarHBondContact NE-OE2 2.89Å; R305-E470 IonicContact NH2-OE1 3.86Å; R305-E470 PolarHBondContact NH2-OE1 2.85Å; R305-E470 IonicContact NH2-OE2 3.91Å; R305-E470 PolarHBondContact NH2-OE2 3.04Å; R321-E470 HydrophobicContact CB-CB 4.21Å; R321-E470 HydrophobicContact CB-CG 3.96Å; R321-E470 WeakPolarHBondContact CD-OE2 3.07Å; R321-E470 HydrophobicContact CG-CB 4.15Å; R321-E470 HydrophobicContact CG-CG 4.33Å; R321-E470 IonicContact NE-OE2 3.71Å; E470-C472 PolarHBondContact O-N 3.48Å; E470-G487 CarbonylContact O-C 3.53Å; E470-G487 WeakPolarHBondContact O-CA 3.3Å; E470-N488 HydrophobicContact CB-CB 4.43Å; E470-N488 PolarHBondContact O-N 3.34Å
471	V	98.7	Very high	95.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.1	173.4	-173.1	0	0	0	0	109.1	S320 I325 H467 Q469 L474	S320-V471 PolarHBondContact O-N 2.94Å; S320-V471 VanDerWaalsContact O-N 3.14Å; I325-V471 HydrophobicContact CD1-CG1 4.18Å; I325-V471 HydrophobicContact CG1-CG1 4.09Å; I325-V471 HydrophobicContact CG1-CG2 4.03Å; H467-V471 HydrophobicContact CB-CG2 4.05Å; Q469-V471 PolarHBondContact O-N 3.45Å; V471-L474 HydrophobicContact CG1-CD1 4.47Å
472	C	98.3	Very high	96	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-22.9	-172.8	61.3	0	0	0	0	114	Y221 N223 E470 G486	Y221-C472 HydrophobicContact CD1-CB 3.88Å; N223-C472 PolarHBondContact ND2-O 3.01Å; E470-C472 PolarHBondContact O-N 3.48Å; C472-G486 PolarHBondContact N-O 2.88Å
473	G	98.3	Very high	96.3	Very high	3 Å²	3	41.7 Å²	41.7	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.3	167.8	0	0	0	0	0	110.9	S485 G486 K517	G473-S485 CarbonylContact O-C 3.59Å; G473-S485 VanDerWaalsContact O-CA 3.32Å; G473-S485 WeakPolarHBondContact O-CA 3.49Å; G473-G486 PolarHBondContact N-O 2.95Å; G473-G486 PolarHBondContact O-N 2.84Å; G473-K517 VanDerWaalsContact CA-O 3.26Å; G473-K517 WeakPolarHBondContact CA-O 3.3Å
474	L	98.5	Very high	96.6	Very high	14 Å²	14	40 Å²	40	7%	0.073	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	122.1	177.1	-162.3	63.8	0	0	0	110.2	A308 A310 A317 I325 V471 L483 A484	A308-L474 HydrophobicContact CB-CB 3.64Å; A308-L474 HydrophobicContact CB-CD2 4.35Å; A310-L474 HydrophobicContact CB-CB 4.41Å; A310-L474 HydrophobicContact CB-CD2 4.26Å; A310-L474 HydrophobicContact CB-CG 3.95Å; A317-L474 HydrophobicContact CB-CD2 3.91Å; I325-L474 HydrophobicContact CD1-CD1 3.94Å; I325-L474 HydrophobicContact CG1-CD1 4.44Å; I325-L474 HydrophobicContact CG2-CD1 4.16Å; I325-L474 HydrophobicContact CG2-CD2 4.28Å; V471-L474 HydrophobicContact CG1-CD1 4.47Å; L474-L483 HydrophobicContact CD1-CD1 3.77Å; L474-L483 HydrophobicContact CD1-CD2 4.11Å; L474-L483 HydrophobicContact CD1-CG 4.09Å; L474-L483 HydrophobicContact CG-CD1 4.04Å; L474-A484 WeakPolarHBondContact CA-O 3.4Å
475	K	98.5	Very high	96.8	Very high	108 Å²	108	39.7 Å²	39.7	47%	0.47	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	121	-176.4	-151.6	84.6	177.1	-172.9	0	112.4	A484 I519 W521	K475-A484 PolarHBondContact N-O 3.33Å; K475-A484 PolarHBondContact O-N 3.42Å; K475-I519 HydrophobicContact CB-CB 4.41Å; K475-I519 HydrophobicContact CB-CG2 3.9Å; K475-W521 PolarHBondContact O-NE1 2.99Å
476	W	97.8	Very high	97.1	Very high	23 Å²	23	36.2 Å²	36.2	9%	0.087	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	148.9	167.3	-72.7	103.4	0	0	0	111.6	A310 W311 N312 L315 A317 L327 Y482 L483 Q497	A310-W476 PolarHBondContact O-NE1 2.96Å; A310-W476 VanDerWaalsContact O-NE1 3.08Å; W311-W476 VanDerWaalsContact C-CD1 3.42Å; W311-W476 VanDerWaalsContact O-CD1 3.3Å; N312-W476 HydrophobicContact CB-CB 4.47Å; N312-W476 HydrophobicContact CB-CD2 3.55Å; N312-W476 HydrophobicContact CB-CE3 4.07Å; N312-W476 HydrophobicContact CB-CG 3.71Å; N312-W476 HydrophobicContact CB-CZ2 4.08Å; N312-W476 VanDerWaalsContact ND2-CE3 3.27Å; N312-W476 VanDerWaalsContact ND2-CZ3 3.31Å; N312-W476 WeakPolarHBondContact ND2-CZ3 3.33Å; L315-W476 HydrophobicContact CD2-CH2 3.83Å; L315-W476 HydrophobicContact CD2-CZ2 3.66Å; A317-W476 HydrophobicContact CB-CZ2 4.28Å; L327-W476 HydrophobicContact CD1-CH2 4.38Å; L327-W476 HydrophobicContact CD1-CZ2 4.49Å; L327-W476 HydrophobicContact CD2-CZ2 4.03Å; W476-Y482 CarbonylContact C-O 3.58Å; W476-Y482 WeakPolarHBondContact CA-O 3.42Å; W476-L483 HydrophobicContact CD2-CB 4.04Å; W476-L483 HydrophobicContact CD2-CD1 3.88Å; W476-L483 HydrophobicContact CD2-CG 4.46Å; W476-L483 HydrophobicContact CE3-CB 3.79Å; W476-L483 HydrophobicContact CE3-CD1 4.48Å; W476-L483 HydrophobicContact CG-CD1 3.99Å; W476-L483 HydrophobicContact CH2-CB 4.05Å; W476-L483 HydrophobicContact CH2-CD2 4.39Å; W476-L483 HydrophobicContact CZ2-CB 4.29Å; W476-L483 HydrophobicContact CZ2-CD1 4.48Å; W476-L483 HydrophobicContact CZ2-CD2 4.06Å; W476-L483 HydrophobicContact CZ3-CB 3.79Å; W476-Q497 HydrophobicContact CZ3-CB 4.18Å
477	S	97	Very high	97.2	Very high	6 Å²	6	33.7 Å²	33.7	4%	0.042	16%	0.159	C	C	.	.			trans	-71.1	153.1	173.4	71.9	0	0	0	0	111	D479 S480 Q481 Y482	S477-D479 WeakPolarHBondContact CB-OD1 3.41Å; S477-D479 PolarHBondContact O-N 3.34Å; S477-D479 VanDerWaalsContact O-N 3.16Å; S477-D479 PolarHBondContact OG-OD1 3.41Å; S477-S480 PolarHBondContact O-N 2.73Å; S477-Q481 PolarHBondContact OG-N 3.27Å; S477-Y482 WeakPolarHBondContact CB-O 3.43Å; S477-Y482 PolarHBondContact N-O 2.51Å; S477-Y482 PolarHBondContact OG-N 3.09Å; S477-Y482 VanDerWaalsContact OG-N 3.1Å; S477-Y482 PolarHBondContact OG-O 2.79Å
478	P	95	Very high	97.3	Very high	75 Å²	75	34.8 Å²	34.8	49%	0.487	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.7	-175.4	-24.4	35.2	0	0	0	114.3	W521	P478-W521 HydrophobicContact CG-CB 4.21Å
479	D	93.5	Very high	97.3	Very high	56 Å²	56	27 Å²	27	30%	0.299	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	6.1	177.4	69.1	-53.2	0	0	0	113.5	S477 Q481 H526	S477-D479 WeakPolarHBondContact CB-OD1 3.41Å; S477-D479 PolarHBondContact O-N 3.34Å; S477-D479 VanDerWaalsContact O-N 3.16Å; S477-D479 PolarHBondContact OG-OD1 3.41Å; D479-Q481 PolarHBondContact O-N 2.82Å; D479-Q481 WeakPolarHBondContact OD2-CB 3.15Å; D479-Q481 WeakPolarHBondContact OD2-CG 3.43Å; D479-Q481 PolarHBondContact OD2-NE2 2.68Å; D479-H526 IonicContact OD1-CE1 3.49Å; D479-H526 IonicContact OD1-ND1 3.66Å; D479-H526 IonicContact OD2-CE1 3.51Å; D479-H526 PolarHBondContact OD2-CE1 3.11Å; D479-H526 IonicContact OD2-ND1 2.73Å; D479-H526 PolarHBondContact OD2-ND1 2.97Å
480	S	94	Very high	97.4	Very high	34 Å²	34	26.7 Å²	26.7	24%	0.238	14%	0.138	C	C	.	.	S	Bend	trans	66.8	-7	177	-70.4	0	0	0	0	117.4	N312 S477 Y482 Q497	N312-S480 PolarHBondContact ND2-O 3.35Å; N312-S480 VanDerWaalsContact ND2-O 3.11Å; N312-S480 WeakPolarHBondContact OD1-CB 3.47Å; N312-S480 PolarHBondContact OD1-OG 2.87Å; S477-S480 PolarHBondContact O-N 2.73Å; S480-Y482 PolarHBondContact O-N 2.67Å; S480-Q497 PolarHBondContact O-OE1 3.37Å
481	Q	93.8	Very high	97.4	Very high	82 Å²	82	27.2 Å²	27.2	38%	0.383	14%	0.139	S	C	.	.	S	Bend	trans	-71.1	-30.6	-174.5	-64.8	-178.4	19.8	0	0	114.6	S477 D479 Q497	S477-Q481 PolarHBondContact OG-N 3.27Å; D479-Q481 PolarHBondContact O-N 2.82Å; D479-Q481 WeakPolarHBondContact OD2-CB 3.15Å; D479-Q481 WeakPolarHBondContact OD2-CG 3.43Å; D479-Q481 PolarHBondContact OD2-NE2 2.68Å; Q481-Q497 PolarHBondContact O-N 3.21Å
482	Y	96.4	Very high	97.4	Very high	42 Å²	42	27.2 Å²	27.2	17%	0.165	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.1	-172.5	-59.7	-83.5	0	0	0	112.4	W476 S477 S480 V494 W495 W521	W476-Y482 CarbonylContact C-O 3.58Å; W476-Y482 WeakPolarHBondContact CA-O 3.42Å; S477-Y482 WeakPolarHBondContact CB-O 3.43Å; S477-Y482 PolarHBondContact N-O 2.51Å; S477-Y482 PolarHBondContact OG-N 3.09Å; S477-Y482 VanDerWaalsContact OG-N 3.1Å; S477-Y482 PolarHBondContact OG-O 2.79Å; S480-Y482 PolarHBondContact O-N 2.67Å; Y482-V494 HydrophobicContact CD1-CG1 3.92Å; Y482-V494 HydrophobicContact CG-CG1 4.3Å; Y482-W495 CarbonylContact C-O 3.38Å; Y482-W495 VanDerWaalsContact CA-O 3.28Å; Y482-W495 WeakPolarHBondContact CA-O 3.45Å; Y482-W521 HydrophobicContact CG-CH2 4.38Å
483	L	97.7	Very high	97.4	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.3	167.1	176.8	60.4	0	0	0	108.1	A310 A317 I325 L327 L464 L474 W476 V494 W495	A310-L483 HydrophobicContact CB-CD1 4.49Å; A317-L483 HydrophobicContact CB-CD1 4.49Å; A317-L483 HydrophobicContact CB-CD2 4.03Å; I325-L483 HydrophobicContact CG2-CD2 4.36Å; L327-L483 HydrophobicContact CD2-CD2 3.98Å; L464-L483 HydrophobicContact CD1-CD2 4.15Å; L474-L483 HydrophobicContact CD1-CD1 3.77Å; L474-L483 HydrophobicContact CD1-CD2 4.11Å; L474-L483 HydrophobicContact CD1-CG 4.09Å; L474-L483 HydrophobicContact CG-CD1 4.04Å; W476-L483 HydrophobicContact CD2-CB 4.04Å; W476-L483 HydrophobicContact CD2-CD1 3.88Å; W476-L483 HydrophobicContact CD2-CG 4.46Å; W476-L483 HydrophobicContact CE3-CB 3.79Å; W476-L483 HydrophobicContact CE3-CD1 4.48Å; W476-L483 HydrophobicContact CG-CD1 3.99Å; W476-L483 HydrophobicContact CH2-CB 4.05Å; W476-L483 HydrophobicContact CH2-CD2 4.39Å; W476-L483 HydrophobicContact CZ2-CB 4.29Å; W476-L483 HydrophobicContact CZ2-CD1 4.48Å; W476-L483 HydrophobicContact CZ2-CD2 4.06Å; W476-L483 HydrophobicContact CZ3-CB 3.79Å; L483-V494 CarbonylContact O-C 3.59Å; L483-V494 WeakPolarHBondContact O-CA 3.14Å; L483-W495 HydrophobicContact CB-CB 4.3Å; L483-W495 PolarHBondContact N-O 3.22Å; L483-W495 PolarHBondContact O-N 3.25Å
484	A	98.5	Very high	97.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.6	167.3	0	0	0	0	0	109.4	L474 K475 L493 I519 W521 L529	L474-A484 WeakPolarHBondContact CA-O 3.4Å; K475-A484 PolarHBondContact N-O 3.33Å; K475-A484 PolarHBondContact O-N 3.42Å; A484-L493 CarbonylContact C-O 3.59Å; A484-L493 WeakPolarHBondContact CA-O 3.41Å; A484-I519 HydrophobicContact CB-CG2 3.64Å; A484-W521 HydrophobicContact CB-CZ2 3.79Å; A484-L529 HydrophobicContact CB-CD1 4.12Å; A484-L529 HydrophobicContact CB-CD2 3.96Å
485	S	98.7	Very high	97.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.2	173.2	67.7	0	0	0	0	111.4	I325 H467 G473 L492 L493 W495	I325-S485 VanDerWaalsContact CD1-CB 3.41Å; I325-S485 WeakPolarHBondContact CD1-OG 3.45Å; H467-S485 PolarHBondContact NE2-OG 2.81Å; G473-S485 CarbonylContact O-C 3.59Å; G473-S485 VanDerWaalsContact O-CA 3.32Å; G473-S485 WeakPolarHBondContact O-CA 3.49Å; S485-L492 WeakPolarHBondContact O-CA 3.26Å; S485-L493 PolarHBondContact N-O 2.87Å; S485-L493 PolarHBondContact O-N 2.78Å; S485-W495 PolarHBondContact OG-NE1 3.17Å
486	G	98.7	Very high	97	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.9	178.8	0	0	0	0	0	110.6	C472 G473 R491 V516 I519	C472-G486 PolarHBondContact N-O 2.88Å; G473-G486 PolarHBondContact N-O 2.95Å; G473-G486 PolarHBondContact O-N 2.84Å; G486-R491 WeakPolarHBondContact CA-O 3.45Å; G486-V516 CarbonylContact C-O 3.49Å; G486-V516 VanDerWaalsContact C-O 3.28Å; G486-V516 VanDerWaalsContact CA-O 3.26Å; G486-V516 WeakPolarHBondContact CA-O 3.39Å; G486-I519 VanDerWaalsContact N-CD1 3.29Å
487	G	98.3	Very high	96.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	170.2	-171	0	0	0	0	0	113.9	H467 E470 D489 N490 R491 A515 V516	H467-G487 PolarHBondContact CE1-N 3.13Å; E470-G487 CarbonylContact O-C 3.53Å; E470-G487 WeakPolarHBondContact O-CA 3.3Å; G487-D489 WeakPolarHBondContact CA-OD1 3.43Å; G487-D489 PolarHBondContact O-N 3.19Å; G487-N490 PolarHBondContact O-N 2.76Å; G487-R491 PolarHBondContact N-O 2.82Å; G487-A515 WeakPolarHBondContact O-CA 3.2Å; G487-V516 PolarHBondContact O-N 3.28Å; G487-V516 VanDerWaalsContact O-N 3.08Å
488	N	98.5	Very high	96.2	Very high	30 Å²	30	32 Å²	32	16%	0.16	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	3.3	165	-162.2	53.2	0	0	0	112.9	Y221 Q469 E470 N490 A515	Y221-N488 HydrophobicContact CE1-CB 3.92Å; Y221-N488 VanDerWaalsContact CE1-OD1 3.31Å; Y221-N488 WeakPolarHBondContact CE1-OD1 3.46Å; Y221-N488 PolarHBondContact OH-OD1 3.2Å; Q469-N488 HydrophobicContact CB-CB 3.86Å; Q469-N488 VanDerWaalsContact CD-O 3.26Å; Q469-N488 PolarHBondContact NE2-O 3.16Å; Q469-N488 PolarHBondContact OE1-ND2 2.85Å; Q469-N488 PolarHBondContact OE1-O 2.84Å; E470-N488 HydrophobicContact CB-CB 4.43Å; E470-N488 PolarHBondContact O-N 3.34Å; N488-N490 VanDerWaalsContact C-N 3.25Å; N488-A515 HydrophobicContact CB-CB 4.48Å; N488-A515 WeakPolarHBondContact OD1-CB 3.45Å
489	D	98.2	Very high	95.5	Very high	21 Å²	21	29.6 Å²	29.6	11%	0.112	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	9.6	168.4	63.3	-11.8	0	0	0	112.5	H467 R468 Q469 G487 R491	H467-D489 VanDerWaalsContact CA-OD2 3.26Å; H467-D489 WeakPolarHBondContact CA-OD2 3.29Å; H467-D489 IonicContact CE1-OD1 3.58Å; H467-D489 IonicContact CG-OD2 3.39Å; H467-D489 IonicContact ND1-OD1 2.9Å; H467-D489 PolarHBondContact ND1-OD1 3.02Å; H467-D489 IonicContact ND1-OD2 3.81Å; H467-D489 PolarHBondContact ND1-OD2 3.39Å; H467-D489 VanDerWaalsContact ND1-OD2 3.16Å; R468-D489 HydrophobicContact CB-CB 4Å; R468-D489 PolarHBondContact N-OD2 3.27Å; Q469-D489 HydrophobicContact CB-CB 4.15Å; Q469-D489 HydrophobicContact CG-CB 4.15Å; G487-D489 WeakPolarHBondContact CA-OD1 3.43Å; G487-D489 PolarHBondContact O-N 3.19Å; D489-R491 PolarHBondContact O-N 3.44Å; D489-R491 PolarHBondContact OD1-N 2.87Å; D489-R491 IonicContact OD2-NH1 3.1Å
490	N	98.3	Very high	94.8	Very high	53 Å²	53	31 Å²	31	28%	0.283	16%	0.162	S	C	.	.	S	Bend	trans	65.7	8.3	-179.9	-48.9	-15.9	0	0	0	115.1	G487 N488 H512 V513 A514 A515	G487-N490 PolarHBondContact O-N 2.76Å; N488-N490 VanDerWaalsContact C-N 3.25Å; N490-H512 WeakPolarHBondContact CB-O 3.5Å; N490-V513 VanDerWaalsContact ND2-C 3.31Å; N490-V513 PolarHBondContact ND2-O 2.87Å; N490-A514 VanDerWaalsContact CG-C 3.48Å; N490-A514 VanDerWaalsContact CG-CA 3.48Å; N490-A514 WeakPolarHBondContact OD1-CA 3.32Å; N490-A514 PolarHBondContact OD1-O 2.88Å; N490-A515 PolarHBondContact OD1-N 2.81Å; N490-A515 VanDerWaalsContact OD1-N 3.14Å
491	R	98.3	Very high	93.7	Very high	24 Å²	24	33.8 Å²	33.8	9%	0.091	18%	0.182	C	C	.	.			trans	-95.8	142.5	-176.4	-64.1	168	77.4	-128.7	0.9	110.6	D466 H467 G486 G487 D489 L493 E510	D466-R491 PolarHBondContact O-NH1 2.88Å; D466-R491 IonicContact OD1-CZ 3.03Å; D466-R491 IonicContact OD1-NH1 2.92Å; D466-R491 PolarHBondContact OD1-NH1 2.93Å; D466-R491 IonicContact OD1-NH2 3.93Å; D466-R491 PolarHBondContact OD1-NH2 2.87Å; H467-R491 PolarHBondContact CE1-O 2.89Å; G486-R491 WeakPolarHBondContact CA-O 3.45Å; G487-R491 PolarHBondContact N-O 2.82Å; D489-R491 PolarHBondContact O-N 3.44Å; D489-R491 PolarHBondContact OD1-N 2.87Å; D489-R491 IonicContact OD2-NH1 3.1Å; R491-L493 HydrophobicContact CB-CD2 4.33Å; R491-E510 HydrophobicContact CG-CG 4.15Å; R491-E510 IonicContact CZ-OE1 3.57Å; R491-E510 IonicContact NE-OE1 3.02Å; R491-E510 PolarHBondContact NE-OE1 3.14Å; R491-E510 IonicContact NH2-OE1 2.67Å; R491-E510 PolarHBondContact NH2-OE1 2.93Å
492	L	98.6	Very high	92.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.9	168.1	172.6	73.7	0	0	0	108.2	S485 Y509 V516 I519 L529 W543	S485-L492 WeakPolarHBondContact O-CA 3.26Å; L492-Y509 HydrophobicContact CB-CD2 4.5Å; L492-Y509 HydrophobicContact CD2-CD2 3.88Å; L492-Y509 HydrophobicContact CG-CD2 4.15Å; L492-Y509 PolarHBondContact N-O 3.14Å; L492-Y509 PolarHBondContact O-N 2.69Å; L492-V516 HydrophobicContact CB-CG1 4.37Å; L492-V516 HydrophobicContact CD1-CG1 4.26Å; L492-I519 HydrophobicContact CD1-CD1 3.77Å; L492-I519 HydrophobicContact CD1-CG1 4.16Å; L492-L529 HydrophobicContact CD1-CD2 4.39Å; L492-L529 HydrophobicContact CD2-CD2 4.01Å; L492-L529 HydrophobicContact CG-CD2 4.5Å; L492-W543 HydrophobicContact CD2-CD2 4.45Å; L492-W543 HydrophobicContact CD2-CG 4.41Å; L492-W543 HydrophobicContact CD2-CZ2 4.25Å; L492-W543 VanDerWaalsContact CD2-NE1 3.31Å
493	L	98.3	Very high	91.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.4	-176.6	-53.7	-177.3	0	0	0	110.3	D466 A484 S485 R491 W495 P505 L507 T508	D466-L493 HydrophobicContact CB-CD1 3.78Å; A484-L493 CarbonylContact C-O 3.59Å; A484-L493 WeakPolarHBondContact CA-O 3.41Å; S485-L493 PolarHBondContact N-O 2.87Å; S485-L493 PolarHBondContact O-N 2.78Å; R491-L493 HydrophobicContact CB-CD2 4.33Å; L493-W495 HydrophobicContact CB-CZ2 4.16Å; L493-W495 HydrophobicContact CD1-CH2 4.21Å; L493-W495 HydrophobicContact CD1-CZ2 3.58Å; L493-P505 HydrophobicContact CB-CB 4.14Å; L493-P505 HydrophobicContact CD2-CB 4.47Å; L493-P505 HydrophobicContact CD2-CG 4.28Å; L493-L507 WeakPolarHBondContact CA-O 3.45Å; L493-T508 HydrophobicContact CD2-CG2 3.71Å; L493-T508 WeakPolarHBondContact CD2-OG1 3.23Å
494	V	97.9	Very high	90.9	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.7	173.6	-173.7	0	0	0	0	109.3	Y482 L483 V506 L507 Y509 W521 L529 T545	Y482-V494 HydrophobicContact CD1-CG1 3.92Å; Y482-V494 HydrophobicContact CG-CG1 4.3Å; L483-V494 CarbonylContact O-C 3.59Å; L483-V494 WeakPolarHBondContact O-CA 3.14Å; V494-V506 PolarHBondContact O-N 3.41Å; V494-L507 HydrophobicContact CB-CB 4.1Å; V494-L507 HydrophobicContact CG2-CB 4.31Å; V494-L507 PolarHBondContact N-O 2.65Å; V494-L507 PolarHBondContact O-N 3.49Å; V494-Y509 HydrophobicContact CG2-CE2 4.1Å; V494-W521 HydrophobicContact CG1-CH2 4.03Å; V494-W521 HydrophobicContact CG1-CZ2 4.29Å; V494-L529 HydrophobicContact CG2-CD2 4.04Å; V494-T545 HydrophobicContact CG2-CG2 4.16Å
495	W	96.4	Very high	90.7	Very high	7 Å²	7	38.8 Å²	38.8	3%	0.027	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.6	-177	-44.7	85.9	0	0	0	109.5	I325 L464 D466 Y482 L483 S485 L493 P505	I325-W495 HydrophobicContact CD1-CZ2 4.34Å; L464-W495 HydrophobicContact CB-CD2 4.45Å; L464-W495 HydrophobicContact CB-CE3 4.21Å; L464-W495 HydrophobicContact CB-CH2 3.67Å; L464-W495 HydrophobicContact CB-CZ2 3.95Å; L464-W495 HydrophobicContact CB-CZ3 3.83Å; L464-W495 HydrophobicContact CD1-CB 4.47Å; L464-W495 HydrophobicContact CD1-CD2 3.76Å; L464-W495 HydrophobicContact CD1-CE3 4.07Å; L464-W495 HydrophobicContact CD1-CG 3.95Å; L464-W495 HydrophobicContact CD1-CZ2 4.47Å; L464-W495 HydrophobicContact CD2-CD2 4.45Å; L464-W495 HydrophobicContact CD2-CE3 3.92Å; L464-W495 HydrophobicContact CD2-CZ3 4.09Å; L464-W495 HydrophobicContact CG-CD2 4.45Å; L464-W495 HydrophobicContact CG-CE3 4.29Å; L464-W495 HydrophobicContact CG-CZ3 4.37Å; D466-W495 HydrophobicContact CB-CH2 3.49Å; D466-W495 VanDerWaalsContact CB-CH2 3.49Å; D466-W495 HydrophobicContact CB-CZ2 4.16Å; D466-W495 HydrophobicContact CB-CZ3 4.37Å; Y482-W495 CarbonylContact C-O 3.38Å; Y482-W495 VanDerWaalsContact CA-O 3.28Å; Y482-W495 WeakPolarHBondContact CA-O 3.45Å; L483-W495 HydrophobicContact CB-CB 4.3Å; L483-W495 PolarHBondContact N-O 3.22Å; L483-W495 PolarHBondContact O-N 3.25Å; S485-W495 PolarHBondContact OG-NE1 3.17Å; L493-W495 HydrophobicContact CB-CZ2 4.16Å; L493-W495 HydrophobicContact CD1-CH2 4.21Å; L493-W495 HydrophobicContact CD1-CZ2 3.58Å; W495-P505 HydrophobicContact CD2-CB 4.15Å; W495-P505 HydrophobicContact CE3-CB 3.95Å; W495-P505 HydrophobicContact CH2-CB 4.37Å; W495-P505 HydrophobicContact CZ3-CB 4.07Å; W495-P505 HydrophobicContact CZ3-CG 4.39Å
496	S	94.1	Very high	90.5	Very high	19 Å²	19	42.6 Å²	42.6	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.4	167.5	177.5	0	0	0	0	110.5	R462 H498 A499	R462-S496 PolarHBondContact NH1-O 3.14Å; S496-H498 PolarHBondContact O-N 3.29Å; S496-H498 PolarHBondContact OG-N 3.23Å; S496-H498 VanDerWaalsContact OG-N 3.11Å; S496-A499 PolarHBondContact O-N 2.76Å
497	Q	89.1	Confident	90.4	Very high	80 Å²	80	44.3 Å²	44.3	37%	0.374	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.3	169.7	-173.7	172.8	-6	0	0	112.2	N312 W476 S480 Q481	N312-Q497 PolarHBondContact ND2-OE1 3.15Å; W476-Q497 HydrophobicContact CZ3-CB 4.18Å; S480-Q497 PolarHBondContact O-OE1 3.37Å; Q481-Q497 PolarHBondContact O-N 3.21Å
498	H	87.1	Confident	90.4	Very high	148 Å²	148	47.1 Å²	47.1	69%	0.685	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-2	-177.4	-56.4	-60.7	0	0	0	113.8	S496	S496-H498 PolarHBondContact O-N 3.29Å; S496-H498 PolarHBondContact OG-N 3.23Å; S496-H498 VanDerWaalsContact OG-N 3.11Å
499	A	82.3	Confident	90.4	Very high	23 Å²	23	46.5 Å²	46.5	19%	0.19	28%	0.282	C	S	.	.	S	Bend	trans	-63.1	143.6	171.2	0	0	0	0	0	110.4	S496	S496-A499 PolarHBondContact O-N 2.76Å
500	P	77.8	Confident	90.3	Very high	86 Å²	86	51.2 Å²	51.2	56%	0.558	30%	0.303	S	S	*	.			trans	-56.4	152.8	175.9	24.9	-34.3	0	0	0	110.8	R462 T502 G503	R462-P500 PolarHBondContact NH2-O 2.89Å; P500-T502 PolarHBondContact O-N 3.05Å; P500-G503 WeakPolarHBondContact O-CA 3.36Å; P500-G503 PolarHBondContact O-N 3.01Å
501	S	70	Confident	90.3	Very high	93 Å²	93	52.6 Å²	52.6	65%	0.65	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-35.2	-177.4	49.3	0	0	0	0	113	G503	S501-G503 VanDerWaalsContact C-N 3.32Å
502	T	68.2	Low	90.3	Very high	135 Å²	135	51.8 Å²	51.8	83%	0.828	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-6	174.8	47.4	0	0	0	0	114.8	P500	P500-T502 PolarHBondContact O-N 3.05Å
503	G	72.7	Confident	90.2	Very high	27 Å²	27	56.5 Å²	56.5	28%	0.278	33%	0.334	S	S	.	.			trans	-77.8	141	177.8	0	0	0	0	0	112.7	R462 P500 S501	R462-G503 PolarHBondContact NH2-O 3Å; P500-G503 WeakPolarHBondContact O-CA 3.36Å; P500-G503 PolarHBondContact O-N 3.01Å; S501-G503 VanDerWaalsContact C-N 3.32Å
504	G	89	Confident	90.2	Very high	42 Å²	42	56.9 Å²	56.9	43%	0.433	34%	0.337	S	S	.	.			trans	-73.7	-162.6	170.1	0	0	0	0	0	113.5
505	P	94.7	Very high	90.2	Very high	26 Å²	26	57.1 Å²	57.1	17%	0.169	34%	0.339	C	S	.	.			trans	-65.8	149.1	170.7	29.9	-34.6	0	0	0	110.8	D466 L493 W495	D466-P505 HydrophobicContact CB-CG 4.4Å; D466-P505 VanDerWaalsContact OD2-CD 3.26Å; D466-P505 WeakPolarHBondContact OD2-CD 3.43Å; L493-P505 HydrophobicContact CB-CB 4.14Å; L493-P505 HydrophobicContact CD2-CB 4.47Å; L493-P505 HydrophobicContact CD2-CG 4.28Å; W495-P505 HydrophobicContact CD2-CB 4.15Å; W495-P505 HydrophobicContact CE3-CB 3.95Å; W495-P505 HydrophobicContact CH2-CB 4.37Å; W495-P505 HydrophobicContact CZ3-CB 4.07Å; W495-P505 HydrophobicContact CZ3-CG 4.39Å
506	V	94.9	Very high	90.3	Very high	79 Å²	79	56.8 Å²	56.8	48%	0.479	34%	0.337	S	S	.	.	S	Bend	trans	-76.8	-36.8	175.6	-177.6	0	0	0	0	110.5	V494	V494-V506 PolarHBondContact O-N 3.41Å
507	L	96.6	Very high	90.6	Very high	37 Å²	37	56.1 Å²	56.1	19%	0.194	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.2	176.1	-58.5	167.1	0	0	0	109.8	L493 V494 Y509 T545	L493-L507 WeakPolarHBondContact CA-O 3.45Å; V494-L507 HydrophobicContact CB-CB 4.1Å; V494-L507 HydrophobicContact CG2-CB 4.31Å; V494-L507 PolarHBondContact N-O 2.65Å; V494-L507 PolarHBondContact O-N 3.49Å; L507-Y509 HydrophobicContact CB-CE2 4.03Å; L507-Y509 HydrophobicContact CD1-CE2 4.44Å; L507-T545 WeakPolarHBondContact CD1-O 3.42Å
508	T	97.5	Very high	91	Very high	59 Å²	59	52.4 Å²	52.4	36%	0.362	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.2	176.9	-66.3	0	0	0	0	107.7	L493 E510	L493-T508 HydrophobicContact CD2-CG2 3.71Å; L493-T508 WeakPolarHBondContact CD2-OG1 3.23Å; T508-E510 HydrophobicContact CG2-CG 3.79Å; T508-E510 WeakPolarHBondContact CG2-OE1 3.32Å
509	Y	97.9	Very high	91.6	Very high	16 Å²	16	45.9 Å²	45.9	6%	0.063	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.4	175.4	-55.2	-78.9	0	0	0	109.7	L492 V494 L507 W543 G548	L492-Y509 HydrophobicContact CB-CD2 4.5Å; L492-Y509 HydrophobicContact CD2-CD2 3.88Å; L492-Y509 HydrophobicContact CG-CD2 4.15Å; L492-Y509 PolarHBondContact N-O 3.14Å; L492-Y509 PolarHBondContact O-N 2.69Å; V494-Y509 HydrophobicContact CG2-CE2 4.1Å; L507-Y509 HydrophobicContact CB-CE2 4.03Å; L507-Y509 HydrophobicContact CD1-CE2 4.44Å; Y509-W543 HydrophobicContact CD1-CD2 4.05Å; Y509-W543 AromaticContact CD1-CE3 3.31Å; Y509-W543 HydrophobicContact CD1-CE3 3.31Å; Y509-W543 HydrophobicContact CD1-CH2 4.1Å; Y509-W543 AromaticContact CD1-CZ3 3.35Å; Y509-W543 HydrophobicContact CD1-CZ3 3.35Å; Y509-W543 HydrophobicContact CD2-CD2 4.3Å; Y509-W543 HydrophobicContact CD2-CE3 4.37Å; Y509-W543 HydrophobicContact CE1-CD2 4.07Å; Y509-W543 AromaticContact CE1-CE3 3.38Å; Y509-W543 HydrophobicContact CE1-CE3 3.38Å; Y509-W543 AromaticContact CE1-CZ3 3.9Å; Y509-W543 HydrophobicContact CE1-CZ3 3.9Å; Y509-W543 HydrophobicContact CE2-CB 4.32Å; Y509-W543 HydrophobicContact CE2-CD2 4.33Å; Y509-W543 HydrophobicContact CE2-CE3 4.43Å; Y509-W543 HydrophobicContact CE2-CG 4.3Å; Y509-W543 HydrophobicContact CG-CD2 4.13Å; Y509-W543 AromaticContact CG-CE3 3.81Å; Y509-W543 HydrophobicContact CG-CE3 3.81Å; Y509-W543 HydrophobicContact CG-CH2 4.14Å; Y509-W543 HydrophobicContact CG-CZ2 4.44Å; Y509-W543 AromaticContact CG-CZ3 3.83Å; Y509-W543 HydrophobicContact CG-CZ3 3.83Å; Y509-W543 AromaticContact CZ-CE3 3.95Å; Y509-G548 WeakPolarHBondContact CE1-O 3.15Å
510	E	97.5	Very high	92.3	Very high	120 Å²	120	45.1 Å²	45.1	56%	0.561	28%	0.279	S	S	*	.			trans	-120.9	17.7	-174.8	-45.3	-162	152.6	0	0	112.1	R491 T508	R491-E510 HydrophobicContact CG-CG 4.15Å; R491-E510 IonicContact CZ-OE1 3.57Å; R491-E510 IonicContact NE-OE1 3.02Å; R491-E510 PolarHBondContact NE-OE1 3.14Å; R491-E510 IonicContact NH2-OE1 2.67Å; R491-E510 PolarHBondContact NH2-OE1 2.93Å; T508-E510 HydrophobicContact CG2-CG 3.79Å; T508-E510 WeakPolarHBondContact CG2-OE1 3.32Å
511	E	97.3	Very high	93.3	Very high	83 Å²	83	42 Å²	42	39%	0.388	26%	0.256	S	S	.	.			trans	-78.4	-16	-177.6	-50.6	-176.1	172.2	0	0	114.2	R541 W543 A550	E511-R541 VanDerWaalsContact O-CZ 3.3Å; E511-R541 PolarHBondContact O-NE 2.97Å; E511-R541 PolarHBondContact O-NH2 3.03Å; E511-R541 IonicContact OE2-CZ 3.96Å; E511-R541 IonicContact OE2-NE 3.49Å; E511-R541 IonicContact OE2-NH1 3.93Å; E511-R541 PolarHBondContact OE2-NH1 3.33Å; E511-W543 HydrophobicContact CB-CH2 4.02Å; E511-W543 HydrophobicContact CG-CH2 3.85Å; E511-W543 HydrophobicContact CG-CZ3 4.16Å; E511-W543 WeakPolarHBondContact OE2-CH2 3.5Å; E511-A550 WeakPolarHBondContact OE1-CB 3.5Å
512	H	98.2	Very high	94.6	Very high	7 Å²	7	37.8 Å²	37.8	3%	0.032	23%	0.226	C	C	.	.			trans	-76.3	136.6	174.6	-78.1	-68.5	0	0	0	109.8	N490 V516 S531 G533 D537 C539	N490-H512 WeakPolarHBondContact CB-O 3.5Å; H512-V516 HydrophobicContact CB-CG2 3.65Å; H512-S531 PolarHBondContact NE2-OG 2.85Å; H512-G533 PolarHBondContact CE1-N 3.13Å; H512-D537 VanDerWaalsContact CA-OD1 3.29Å; H512-D537 WeakPolarHBondContact CA-OD1 3.48Å; H512-D537 IonicContact CE1-OD2 2.68Å; H512-D537 IonicContact CG-OD2 3.58Å; H512-D537 IonicContact ND1-OD1 3.83Å; H512-D537 IonicContact ND1-OD2 3.52Å; H512-D537 PolarHBondContact ND1-OD2 2.83Å; H512-C539 PolarHBondContact CE1-O 2.89Å
513	V	97.7	Very high	95.9	Very high	98 Å²	98	34.2 Å²	34.2	59%	0.594	21%	0.205	S	C	*	.	S	Bend	trans	-97.4	7.3	-179	-159	0	0	0	0	112.1	N490 D537	N490-V513 VanDerWaalsContact ND2-C 3.31Å; N490-V513 PolarHBondContact ND2-O 2.87Å; V513-D537 HydrophobicContact CB-CB 4.31Å; V513-D537 PolarHBondContact N-OD1 3.46Å
514	A	97.8	Very high	97	Very high	8 Å²	8	36.8 Å²	36.8	7%	0.066	21%	0.21	C	C	.	.	S	Bend	trans	-152.8	171	179.6	0	0	0	0	0	111	N490 A536 D537	N490-A514 VanDerWaalsContact CG-C 3.48Å; N490-A514 VanDerWaalsContact CG-CA 3.48Å; N490-A514 WeakPolarHBondContact OD1-CA 3.32Å; N490-A514 PolarHBondContact OD1-O 2.88Å; A514-A536 HydrophobicContact CB-CB 4.16Å; A514-D537 HydrophobicContact CB-CB 3.72Å
515	A	98.2	Very high	97.3	Very high	6 Å²	6	38.9 Å²	38.9	5%	0.05	21%	0.209	C	C	.	.			trans	-48.7	135.6	-177.7	0	0	0	0	0	113.9	F220 Y221 G487 N488 N490 G533 G534	F220-A515 HydrophobicContact CE1-CB 4.03Å; Y221-A515 HydrophobicContact CE1-CB 4.36Å; G487-A515 WeakPolarHBondContact O-CA 3.2Å; N488-A515 HydrophobicContact CB-CB 4.48Å; N488-A515 WeakPolarHBondContact OD1-CB 3.45Å; N490-A515 PolarHBondContact OD1-N 2.81Å; N490-A515 VanDerWaalsContact OD1-N 3.14Å; A515-G533 CarbonylContact O-C 3.58Å; A515-G534 PolarHBondContact O-N 2.86Å
516	V	98.7	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.			trans	-105	80.1	-176.8	-171.6	0	0	0	0	110.5	G486 G487 L492 H512 I519	G486-V516 CarbonylContact C-O 3.49Å; G486-V516 VanDerWaalsContact C-O 3.28Å; G486-V516 VanDerWaalsContact CA-O 3.26Å; G486-V516 WeakPolarHBondContact CA-O 3.39Å; G487-V516 PolarHBondContact O-N 3.28Å; G487-V516 VanDerWaalsContact O-N 3.08Å; L492-V516 HydrophobicContact CB-CG1 4.37Å; L492-V516 HydrophobicContact CD1-CG1 4.26Å; H512-V516 HydrophobicContact CB-CG2 3.65Å; V516-I519 HydrophobicContact CG1-CG1 4.28Å
517	K	98.7	Very high	97.3	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.026	20%	0.199	C	C	.	.			trans	-81.3	-48.7	174.9	178.8	-171.7	179	65.2	0	112.1	F220 L222 N223 G473 I519 C561	F220-K517 HydrophobicContact CD1-CD 4.3Å; F220-K517 HydrophobicContact CD2-CD 4.11Å; F220-K517 HydrophobicContact CE1-CB 3.64Å; F220-K517 HydrophobicContact CE1-CD 4.08Å; F220-K517 HydrophobicContact CE1-CG 4.47Å; F220-K517 HydrophobicContact CE2-CB 4.35Å; F220-K517 HydrophobicContact CE2-CD 3.89Å; F220-K517 HydrophobicContact CG-CD 4.31Å; F220-K517 HydrophobicContact CZ-CB 3.54Å; F220-K517 HydrophobicContact CZ-CD 3.88Å; F220-K517 HydrophobicContact CZ-CG 4.38Å; F220-K517 WeakPolarHBondContact O-CD 3.43Å; F220-K517 WeakPolarHBondContact O-CE 3.38Å; F220-K517 PolarHBondContact O-NZ 3.28Å; L222-K517 PolarHBondContact O-NZ 2.9Å; N223-K517 PolarHBondContact OD1-NZ 3.3Å; G473-K517 VanDerWaalsContact CA-O 3.26Å; G473-K517 WeakPolarHBondContact CA-O 3.3Å; K517-I519 PolarHBondContact O-N 3.46Å; K517-C561 WeakPolarHBondContact CD-O 3.14Å; K517-C561 WeakPolarHBondContact CG-O 3.44Å
518	A	98.7	Very high	97.4	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	112.8	-172.6	0	0	0	0	0	109.8	S531 G532 V560 I563	A518-S531 CarbonylContact O-C 3.57Å; A518-S531 WeakPolarHBondContact O-CA 3.47Å; A518-G532 PolarHBondContact O-N 3.17Å; A518-V560 HydrophobicContact CB-CG1 3.88Å; A518-I563 HydrophobicContact CB-CD1 3.93Å; A518-I563 HydrophobicContact CB-CG1 3.95Å
519	I	98.6	Very high	97.4	Very high	12 Å²	12	33.7 Å²	33.7	6%	0.062	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	123.9	-179.4	-58.1	-177.9	0	0	0	109.3	K475 A484 G486 L492 V516 K517 L529	K475-I519 HydrophobicContact CB-CB 4.41Å; K475-I519 HydrophobicContact CB-CG2 3.9Å; A484-I519 HydrophobicContact CB-CG2 3.64Å; G486-I519 VanDerWaalsContact N-CD1 3.29Å; L492-I519 HydrophobicContact CD1-CD1 3.77Å; L492-I519 HydrophobicContact CD1-CG1 4.16Å; V516-I519 HydrophobicContact CG1-CG1 4.28Å; K517-I519 PolarHBondContact O-N 3.46Å; I519-L529 HydrophobicContact CG2-CD1 3.84Å
520	A	98.6	Very high	97.5	Very high	6 Å²	6	33 Å²	33	5%	0.05	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	117.9	179.9	0	0	0	0	0	112.8	A530 I563 W565	A520-A530 PolarHBondContact N-O 3.4Å; A520-A530 PolarHBondContact O-N 2.94Å; A520-I563 HydrophobicContact CB-CB 4.02Å; A520-I563 HydrophobicContact CB-CG2 3.77Å; A520-I563 WeakPolarHBondContact CB-O 3.27Å; A520-W565 PolarHBondContact O-NE1 2.91Å
521	W	98.3	Very high	97.5	Very high	20 Å²	20	27.2 Å²	27.2	8%	0.076	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.3	168.6	-64.8	98.4	0	0	0	111.3	K475 P478 Y482 A484 V494 L529 T545 W565	K475-W521 PolarHBondContact O-NE1 2.99Å; P478-W521 HydrophobicContact CG-CB 4.21Å; Y482-W521 HydrophobicContact CG-CH2 4.38Å; A484-W521 HydrophobicContact CB-CZ2 3.79Å; V494-W521 HydrophobicContact CG1-CH2 4.03Å; V494-W521 HydrophobicContact CG1-CZ2 4.29Å; W521-L529 HydrophobicContact CD2-CD1 3.77Å; W521-L529 HydrophobicContact CE3-CB 4.03Å; W521-L529 HydrophobicContact CE3-CD1 4.12Å; W521-L529 HydrophobicContact CG-CD1 4.05Å; W521-L529 HydrophobicContact CH2-CD2 4.43Å; W521-L529 HydrophobicContact CZ2-CD1 4.42Å; W521-L529 HydrophobicContact CZ2-CD2 4.46Å; W521-L529 HydrophobicContact CZ3-CB 4.07Å; W521-T545 HydrophobicContact CH2-CG2 3.72Å; W521-T545 HydrophobicContact CZ3-CG2 3.65Å; W521-T545 WeakPolarHBondContact CZ3-OG1 3.47Å; W521-W565 VanDerWaalsContact C-CD1 3.44Å
522	S	97.6	Very high	97.6	Very high	5 Å²	5	23.3 Å²	23.3	4%	0.035	12%	0.124	C	C	.	.			trans	-71	131.8	172.9	-174.4	0	0	0	0	110.8	H524 Q525 L528	S522-H524 VanDerWaalsContact C-N 3.28Å; S522-H524 PolarHBondContact OG-N 3.14Å; S522-Q525 PolarHBondContact OG-N 3.15Å; S522-L528 PolarHBondContact N-O 3.45Å
523	P	96	Very high	97.6	Very high	60 Å²	60	23 Å²	23	39%	0.39	12%	0.123	S	C	.	.	S	Bend	trans	-76.9	-15.8	172.8	31.4	-34.1	0	0	0	112.8	W565	P523-W565 VanDerWaalsContact CD-CB 3.46Å; P523-W565 HydrophobicContact CG-CB 4.17Å
524	H	95.1	Very high	97.6	Very high	82 Å²	82	18.4 Å²	18.4	38%	0.38	10%	0.096	S	C	.	.	S	Bend	trans	-97.5	-29.6	-174.6	-55.8	-66.5	0	0	0	113.6	S522 S566 I567 S569 N570	S522-H524 VanDerWaalsContact C-N 3.28Å; S522-H524 PolarHBondContact OG-N 3.14Å; H524-S566 PolarHBondContact NE2-O 2.88Å; H524-I567 PolarHBondContact CE1-O 3.11Å; H524-S569 PolarHBondContact CD2-O 2.87Å; H524-S569 PolarHBondContact NE2-O 3.34Å; H524-N570 PolarHBondContact CD2-OD1 3.09Å; H524-N570 VanDerWaalsContact CD2-OD1 3.26Å
525	Q	95.4	Very high	97.5	Very high	85 Å²	85	20 Å²	20	40%	0.397	11%	0.105	S	C	.	.	S	Bend	trans	-125.8	107.1	-177.8	-178.3	177.2	-8.8	0	0	109.4	S522 G527 L528	S522-Q525 PolarHBondContact OG-N 3.15Å; Q525-G527 PolarHBondContact O-N 3.27Å; Q525-L528 HydrophobicContact CB-CB 3.9Å; Q525-L528 HydrophobicContact CB-CD2 4.18Å; Q525-L528 HydrophobicContact CG-CB 3.87Å; Q525-L528 WeakPolarHBondContact O-CB 3.41Å; Q525-L528 PolarHBondContact O-N 3.49Å; Q525-L528 VanDerWaalsContact O-N 3.12Å
526	H	94.8	Very high	97.4	Very high	89 Å²	89	22.6 Å²	22.6	41%	0.412	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	137.8	172	175.3	69.3	0	0	0	110.3	D479 L528	D479-H526 IonicContact OD1-CE1 3.49Å; D479-H526 IonicContact OD1-ND1 3.66Å; D479-H526 IonicContact OD2-CE1 3.51Å; D479-H526 PolarHBondContact OD2-CE1 3.11Å; D479-H526 IonicContact OD2-ND1 2.73Å; D479-H526 PolarHBondContact OD2-ND1 2.97Å; H526-L528 VanDerWaalsContact C-N 3.28Å; H526-L528 PolarHBondContact O-N 2.78Å
527	G	95.1	Very high	97.3	Very high	3 Å²	3	23.1 Å²	23.1	3%	0.031	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-4.6	-175	0	0	0	0	0	116.1	Q525 N544 T545	Q525-G527 PolarHBondContact O-N 3.27Å; G527-N544 CarbonylContact O-C 3.55Å; G527-N544 WeakPolarHBondContact O-CA 3.36Å; G527-T545 WeakPolarHBondContact CA-OG1 3.47Å; G527-T545 PolarHBondContact O-N 2.87Å; G527-T545 PolarHBondContact O-OG1 2.91Å
528	L	97.7	Very high	97.2	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.7	173.2	177	62.7	0	0	0	110.6	S522 Q525 H526 F542 W543 L551 W565 Y588	S522-L528 PolarHBondContact N-O 3.45Å; Q525-L528 HydrophobicContact CB-CB 3.9Å; Q525-L528 HydrophobicContact CB-CD2 4.18Å; Q525-L528 HydrophobicContact CG-CB 3.87Å; Q525-L528 WeakPolarHBondContact O-CB 3.41Å; Q525-L528 PolarHBondContact O-N 3.49Å; Q525-L528 VanDerWaalsContact O-N 3.12Å; H526-L528 VanDerWaalsContact C-N 3.28Å; H526-L528 PolarHBondContact O-N 2.78Å; L528-F542 HydrophobicContact CD1-CB 4.39Å; L528-F542 HydrophobicContact CD1-CD1 4.45Å; L528-W543 WeakPolarHBondContact CA-O 3.41Å; L528-L551 HydrophobicContact CD1-CD1 3.76Å; L528-W565 HydrophobicContact CD2-CH2 3.87Å; L528-W565 HydrophobicContact CD2-CZ2 4.03Å; L528-W565 HydrophobicContact CG-CZ2 4.26Å; L528-Y588 WeakPolarHBondContact CD1-OH 3.5Å; L528-Y588 HydrophobicContact CD2-CD1 4.22Å; L528-Y588 HydrophobicContact CD2-CE1 3.46Å; L528-Y588 VanDerWaalsContact CD2-CE1 3.46Å; L528-Y588 HydrophobicContact CD2-CE2 4.39Å
529	L	98.4	Very high	97.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.5	177	179.9	60.6	0	0	0	110	A484 L492 V494 I519 W521 F542 W543 T545	A484-L529 HydrophobicContact CB-CD1 4.12Å; A484-L529 HydrophobicContact CB-CD2 3.96Å; L492-L529 HydrophobicContact CD1-CD2 4.39Å; L492-L529 HydrophobicContact CD2-CD2 4.01Å; L492-L529 HydrophobicContact CG-CD2 4.5Å; V494-L529 HydrophobicContact CG2-CD2 4.04Å; I519-L529 HydrophobicContact CG2-CD1 3.84Å; W521-L529 HydrophobicContact CD2-CD1 3.77Å; W521-L529 HydrophobicContact CE3-CB 4.03Å; W521-L529 HydrophobicContact CE3-CD1 4.12Å; W521-L529 HydrophobicContact CG-CD1 4.05Å; W521-L529 HydrophobicContact CH2-CD2 4.43Å; W521-L529 HydrophobicContact CZ2-CD1 4.42Å; W521-L529 HydrophobicContact CZ2-CD2 4.46Å; W521-L529 HydrophobicContact CZ3-CB 4.07Å; L529-F542 CarbonylContact O-C 3.59Å; L529-F542 WeakPolarHBondContact O-CA 3.49Å; L529-W543 HydrophobicContact CB-CB 4.36Å; L529-W543 PolarHBondContact N-O 2.9Å; L529-W543 PolarHBondContact O-N 2.85Å; L529-T545 HydrophobicContact CB-CG2 3.8Å; L529-T545 HydrophobicContact CD2-CG2 4.01Å
530	A	98.6	Very high	97.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.9	167.9	0	0	0	0	0	110.1	A520 R541 F542 I563 W565	A520-A530 PolarHBondContact N-O 3.4Å; A520-A530 PolarHBondContact O-N 2.94Å; A530-R541 WeakPolarHBondContact CA-O 3.34Å; A530-F542 HydrophobicContact CB-CD1 3.88Å; A530-F542 HydrophobicContact CB-CE1 3.77Å; A530-I563 HydrophobicContact CB-CD1 4.39Å; A530-I563 HydrophobicContact CB-CG2 4.28Å; A530-W565 HydrophobicContact CB-CZ2 3.99Å
531	S	98.8	Very high	97.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.6	172.9	61.7	0	0	0	0	111.9	H512 A518 I540 R541 W543 I563	H512-S531 PolarHBondContact NE2-OG 2.85Å; A518-S531 CarbonylContact O-C 3.57Å; A518-S531 WeakPolarHBondContact O-CA 3.47Å; S531-I540 CarbonylContact O-C 3.55Å; S531-I540 VanDerWaalsContact O-CA 3.29Å; S531-I540 WeakPolarHBondContact O-CA 3.47Å; S531-R541 PolarHBondContact N-O 3.16Å; S531-R541 PolarHBondContact O-N 2.6Å; S531-W543 PolarHBondContact OG-NE1 3.08Å; S531-I563 VanDerWaalsContact C-CD1 3.5Å
532	G	98.5	Very high	97.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.9	178.8	0	0	0	0	0	112.1	A518 C539	A518-G532 PolarHBondContact O-N 3.17Å; G532-C539 WeakPolarHBondContact CA-O 3.25Å
533	G	98	Very high	97.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.			trans	-92.3	157.6	-179.4	0	0	0	0	0	114.7	H512 A515 D537 C539 V560	H512-G533 PolarHBondContact CE1-N 3.13Å; A515-G533 CarbonylContact O-C 3.58Å; G533-D537 WeakPolarHBondContact CA-OD2 3.43Å; G533-C539 PolarHBondContact N-O 3.11Å; G533-V560 PolarHBondContact O-N 3.41Å
534	G	97.1	Very high	97.3	Very high	2 Å²	2	27 Å²	27	2%	0.021	14%	0.138	C	C	.	.			trans	-66.8	-163.6	177.6	0	0	0	0	0	115.7	A515 A536 D537 R538	A515-G534 PolarHBondContact O-N 2.86Å; G534-A536 VanDerWaalsContact C-N 3.34Å; G534-A536 PolarHBondContact O-N 3.47Å; G534-D537 PolarHBondContact O-N 3.1Å; G534-D537 VanDerWaalsContact O-N 3.09Å; G534-R538 PolarHBondContact O-N 3.33Å
535	T	95.9	Very high	97.3	Very high	42 Å²	42	23.5 Å²	23.5	26%	0.258	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.5	-168.2	-40.5	0	0	0	0	114.9	D34 R538 Q559	D34-T535 PolarHBondContact OD1-OG1 3.4Å; D34-T535 WeakPolarHBondContact OD2-CB 3.43Å; T535-R538 WeakPolarHBondContact O-CG 3.21Å; T535-Q559 PolarHBondContact OG1-NE2 3.17Å
536	A	96.5	Very high	97.3	Very high	61 Å²	61	24.1 Å²	24.1	50%	0.504	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.2	-179.7	0	0	0	0	0	114.1	A514 G534	A514-A536 HydrophobicContact CB-CB 4.16Å; G534-A536 VanDerWaalsContact C-N 3.34Å; G534-A536 PolarHBondContact O-N 3.47Å
537	D	97.2	Very high	97.3	Very high	10 Å²	10	23.6 Å²	23.6	5%	0.053	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-49.3	-177.5	178.6	88.1	0	0	0	112.9	H512 V513 A514 G533 G534 C539 R541	H512-D537 VanDerWaalsContact CA-OD1 3.29Å; H512-D537 WeakPolarHBondContact CA-OD1 3.48Å; H512-D537 IonicContact CE1-OD2 2.68Å; H512-D537 IonicContact CG-OD2 3.58Å; H512-D537 IonicContact ND1-OD1 3.83Å; H512-D537 IonicContact ND1-OD2 3.52Å; H512-D537 PolarHBondContact ND1-OD2 2.83Å; V513-D537 HydrophobicContact CB-CB 4.31Å; V513-D537 PolarHBondContact N-OD1 3.46Å; A514-D537 HydrophobicContact CB-CB 3.72Å; G533-D537 WeakPolarHBondContact CA-OD2 3.43Å; G534-D537 PolarHBondContact O-N 3.1Å; G534-D537 VanDerWaalsContact O-N 3.09Å; D537-C539 PolarHBondContact O-N 3.06Å; D537-C539 PolarHBondContact O-SG 2.96Å; D537-C539 WeakPolarHBondContact OD2-CB 3.34Å; D537-C539 PolarHBondContact OD2-N 2.97Å; D537-R541 IonicContact OD1-NH2 3.1Å
538	R	97.1	Very high	97.3	Very high	99 Å²	99	24.8 Å²	24.8	37%	0.374	14%	0.143	S	C	.	.			trans	57.8	4.6	176.1	-49.6	-177.4	-59.5	-107.8	-0.5	116.2	G534 T535 D555 T556 S558	G534-R538 PolarHBondContact O-N 3.33Å; T535-R538 WeakPolarHBondContact O-CG 3.21Å; R538-D555 WeakPolarHBondContact CB-OD1 3.38Å; R538-D555 IonicContact NE-OD1 2.98Å; R538-D555 IonicContact NH2-OD2 3.92Å; R538-T556 WeakPolarHBondContact O-CB 3.4Å; R538-T556 PolarHBondContact O-N 2.83Å; R538-T556 PolarHBondContact O-OG1 2.74Å; R538-S558 WeakPolarHBondContact CA-O 3.45Å; R538-S558 WeakPolarHBondContact CB-O 3.35Å
539	C	97.6	Very high	97.2	Very high	20 Å²	20	30.1 Å²	30.1	14%	0.135	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	145.4	-175	-67.4	0	0	0	0	111.3	H512 G532 G533 D537 V554	H512-C539 PolarHBondContact CE1-O 2.89Å; G532-C539 WeakPolarHBondContact CA-O 3.25Å; G533-C539 PolarHBondContact N-O 3.11Å; D537-C539 PolarHBondContact O-N 3.06Å; D537-C539 PolarHBondContact O-SG 2.96Å; D537-C539 WeakPolarHBondContact OD2-CB 3.34Å; D537-C539 PolarHBondContact OD2-N 2.97Å; C539-V554 CarbonylContact C-O 3.52Å; C539-V554 VanDerWaalsContact CA-O 3.3Å; C539-V554 WeakPolarHBondContact CA-O 3.23Å
540	I	98.4	Very high	97.1	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.8	159.2	-61.8	173.3	0	0	0	107.5	S531 F542 S553 V554 T556 V560 I563 W586	S531-I540 CarbonylContact O-C 3.55Å; S531-I540 VanDerWaalsContact O-CA 3.29Å; S531-I540 WeakPolarHBondContact O-CA 3.47Å; I540-F542 HydrophobicContact CG2-CD2 4.43Å; I540-F542 HydrophobicContact CG2-CE2 3.66Å; I540-F542 HydrophobicContact CG2-CZ 3.71Å; I540-S553 CarbonylContact O-C 3.58Å; I540-S553 VanDerWaalsContact O-CA 3.25Å; I540-S553 WeakPolarHBondContact O-CA 3.43Å; I540-V554 HydrophobicContact CB-CG1 3.95Å; I540-V554 PolarHBondContact N-O 3.1Å; I540-V554 PolarHBondContact O-N 3.38Å; I540-T556 HydrophobicContact CB-CG2 4.47Å; I540-T556 HydrophobicContact CD1-CG2 3.71Å; I540-T556 HydrophobicContact CG1-CG2 3.71Å; I540-V560 HydrophobicContact CD1-CG1 4.41Å; I540-V560 HydrophobicContact CG1-CG1 4.13Å; I540-V560 HydrophobicContact CG1-CG2 4Å; I540-I563 HydrophobicContact CD1-CD1 4.42Å; I540-I563 HydrophobicContact CD1-CG1 4.38Å; I540-I563 HydrophobicContact CG1-CD1 4.17Å; I540-I563 HydrophobicContact CG2-CD1 3.87Å; I540-W586 HydrophobicContact CD1-CZ2 4.41Å
541	R	98.5	Very high	97	Very high	41 Å²	41	35.7 Å²	35.7	16%	0.155	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	146.1	177.7	-62.6	-177.4	-174.7	-93	-3.3	110.2	E511 A530 S531 D537 W543	E511-R541 VanDerWaalsContact O-CZ 3.3Å; E511-R541 PolarHBondContact O-NE 2.97Å; E511-R541 PolarHBondContact O-NH2 3.03Å; E511-R541 IonicContact OE2-CZ 3.96Å; E511-R541 IonicContact OE2-NE 3.49Å; E511-R541 IonicContact OE2-NH1 3.93Å; E511-R541 PolarHBondContact OE2-NH1 3.33Å; A530-R541 WeakPolarHBondContact CA-O 3.34Å; S531-R541 PolarHBondContact N-O 3.16Å; S531-R541 PolarHBondContact O-N 2.6Å; D537-R541 IonicContact OD1-NH2 3.1Å; R541-W543 HydrophobicContact CB-CH2 4.13Å; R541-W543 HydrophobicContact CB-CZ2 3.42Å; R541-W543 VanDerWaalsContact CB-CZ2 3.42Å; R541-W543 VanDerWaalsContact CD-CZ2 3.49Å; R541-W543 HydrophobicContact CG-CH2 4.48Å; R541-W543 HydrophobicContact CG-CZ2 4.08Å
542	F	98.4	Very high	96.7	Very high	1 Å²	1	42 Å²	42	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134	179.6	-63.6	-91.1	0	0	0	109.8	L528 L529 A530 I540 L551 R552 W565 L572 Y588 L591	L528-F542 HydrophobicContact CD1-CB 4.39Å; L528-F542 HydrophobicContact CD1-CD1 4.45Å; L529-F542 CarbonylContact O-C 3.59Å; L529-F542 WeakPolarHBondContact O-CA 3.49Å; A530-F542 HydrophobicContact CB-CD1 3.88Å; A530-F542 HydrophobicContact CB-CE1 3.77Å; I540-F542 HydrophobicContact CG2-CD2 4.43Å; I540-F542 HydrophobicContact CG2-CE2 3.66Å; I540-F542 HydrophobicContact CG2-CZ 3.71Å; F542-L551 HydrophobicContact CB-CB 4.31Å; F542-L551 WeakPolarHBondContact O-CB 3.31Å; F542-L551 PolarHBondContact O-N 2.88Å; F542-R552 HydrophobicContact CD2-CB 4.26Å; F542-R552 PolarHBondContact N-O 2.87Å; F542-W565 HydrophobicContact CD1-CH2 4.22Å; F542-W565 HydrophobicContact CD1-CZ2 4.04Å; F542-W565 AromaticContact CE1-CH2 3.77Å; F542-W565 HydrophobicContact CE1-CH2 3.77Å; F542-W565 AromaticContact CE1-CZ2 3.73Å; F542-W565 HydrophobicContact CE1-CZ2 3.73Å; F542-L572 HydrophobicContact CE1-CD2 3.72Å; F542-L572 HydrophobicContact CZ-CD2 3.71Å; F542-Y588 HydrophobicContact CB-CE2 4.44Å; F542-Y588 AromaticContact CD1-CD2 3.9Å; F542-Y588 HydrophobicContact CD1-CD2 3.9Å; F542-Y588 AromaticContact CD1-CE2 3.54Å; F542-Y588 HydrophobicContact CD1-CE2 3.54Å; F542-Y588 HydrophobicContact CD2-CE2 4.5Å; F542-Y588 AromaticContact CE1-CD2 3.7Å; F542-Y588 HydrophobicContact CE1-CD2 3.7Å; F542-Y588 AromaticContact CE1-CE2 3.86Å; F542-Y588 HydrophobicContact CE1-CE2 3.86Å; F542-Y588 HydrophobicContact CG-CD2 4.48Å; F542-Y588 AromaticContact CG-CE2 3.9Å; F542-Y588 HydrophobicContact CG-CE2 3.9Å; F542-Y588 HydrophobicContact CZ-CD2 4.13Å; F542-Y588 HydrophobicContact CZ-CE2 4.48Å; F542-L591 HydrophobicContact CD2-CD1 4.21Å; F542-L591 HydrophobicContact CD2-CD2 4.2Å; F542-L591 HydrophobicContact CE2-CD1 3.9Å; F542-L591 HydrophobicContact CE2-CD2 3.4Å; F542-L591 HydrophobicContact CE2-CG 4.33Å; F542-L591 HydrophobicContact CZ-CD2 3.59Å
543	W	98.2	Very high	96.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.8	-172.1	-39.6	91.3	0	0	0	110.9	L492 Y509 E511 L528 L529 S531 R541 Q549 A550	L492-W543 HydrophobicContact CD2-CD2 4.45Å; L492-W543 HydrophobicContact CD2-CG 4.41Å; L492-W543 HydrophobicContact CD2-CZ2 4.25Å; L492-W543 VanDerWaalsContact CD2-NE1 3.31Å; Y509-W543 HydrophobicContact CD1-CD2 4.05Å; Y509-W543 AromaticContact CD1-CE3 3.31Å; Y509-W543 HydrophobicContact CD1-CE3 3.31Å; Y509-W543 HydrophobicContact CD1-CH2 4.1Å; Y509-W543 AromaticContact CD1-CZ3 3.35Å; Y509-W543 HydrophobicContact CD1-CZ3 3.35Å; Y509-W543 HydrophobicContact CD2-CD2 4.3Å; Y509-W543 HydrophobicContact CD2-CE3 4.37Å; Y509-W543 HydrophobicContact CE1-CD2 4.07Å; Y509-W543 AromaticContact CE1-CE3 3.38Å; Y509-W543 HydrophobicContact CE1-CE3 3.38Å; Y509-W543 AromaticContact CE1-CZ3 3.9Å; Y509-W543 HydrophobicContact CE1-CZ3 3.9Å; Y509-W543 HydrophobicContact CE2-CB 4.32Å; Y509-W543 HydrophobicContact CE2-CD2 4.33Å; Y509-W543 HydrophobicContact CE2-CE3 4.43Å; Y509-W543 HydrophobicContact CE2-CG 4.3Å; Y509-W543 HydrophobicContact CG-CD2 4.13Å; Y509-W543 AromaticContact CG-CE3 3.81Å; Y509-W543 HydrophobicContact CG-CE3 3.81Å; Y509-W543 HydrophobicContact CG-CH2 4.14Å; Y509-W543 HydrophobicContact CG-CZ2 4.44Å; Y509-W543 AromaticContact CG-CZ3 3.83Å; Y509-W543 HydrophobicContact CG-CZ3 3.83Å; Y509-W543 AromaticContact CZ-CE3 3.95Å; E511-W543 HydrophobicContact CB-CH2 4.02Å; E511-W543 HydrophobicContact CG-CH2 3.85Å; E511-W543 HydrophobicContact CG-CZ3 4.16Å; E511-W543 WeakPolarHBondContact OE2-CH2 3.5Å; L528-W543 WeakPolarHBondContact CA-O 3.41Å; L529-W543 HydrophobicContact CB-CB 4.36Å; L529-W543 PolarHBondContact N-O 2.9Å; L529-W543 PolarHBondContact O-N 2.85Å; S531-W543 PolarHBondContact OG-NE1 3.08Å; R541-W543 HydrophobicContact CB-CH2 4.13Å; R541-W543 HydrophobicContact CB-CZ2 3.42Å; R541-W543 VanDerWaalsContact CB-CZ2 3.42Å; R541-W543 VanDerWaalsContact CD-CZ2 3.49Å; R541-W543 HydrophobicContact CG-CH2 4.48Å; R541-W543 HydrophobicContact CG-CZ2 4.08Å; W543-Q549 WeakPolarHBondContact CA-O 3.49Å; W543-A550 HydrophobicContact CE3-CB 3.77Å; W543-A550 HydrophobicContact CZ3-CB 3.64Å
544	N	97.3	Very high	96.5	Very high	30 Å²	30	46.8 Å²	46.8	16%	0.16	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	101.9	165.5	-178.4	-14.5	0	0	0	108.8	G527 L546 T547 G548 Q549 L551	G527-N544 CarbonylContact O-C 3.55Å; G527-N544 WeakPolarHBondContact O-CA 3.36Å; N544-L546 PolarHBondContact O-N 3.11Å; N544-L546 WeakPolarHBondContact OD1-CB 3.35Å; N544-L546 PolarHBondContact OD1-N 2.9Å; N544-T547 WeakPolarHBondContact CB-OG1 3.49Å; N544-T547 PolarHBondContact ND2-OG1 2.84Å; N544-T547 PolarHBondContact O-N 3.4Å; N544-T547 PolarHBondContact OD1-N 3.27Å; N544-G548 WeakPolarHBondContact O-CA 3.28Å; N544-G548 PolarHBondContact O-N 3.47Å; N544-Q549 PolarHBondContact N-O 2.91Å; N544-Q549 PolarHBondContact O-N 2.83Å; N544-L551 HydrophobicContact CB-CD1 4.11Å; N544-L551 HydrophobicContact CB-CD2 3.99Å; N544-L551 HydrophobicContact CB-CG 4.12Å
545	T	96.4	Very high	96.5	Very high	8 Å²	8	50.8 Å²	50.8	5%	0.049	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-2	-177	72	0	0	0	0	113.7	V494 L507 W521 G527 L529	V494-T545 HydrophobicContact CG2-CG2 4.16Å; L507-T545 WeakPolarHBondContact CD1-O 3.42Å; W521-T545 HydrophobicContact CH2-CG2 3.72Å; W521-T545 HydrophobicContact CZ3-CG2 3.65Å; W521-T545 WeakPolarHBondContact CZ3-OG1 3.47Å; G527-T545 WeakPolarHBondContact CA-OG1 3.47Å; G527-T545 PolarHBondContact O-N 2.87Å; G527-T545 PolarHBondContact O-OG1 2.91Å; L529-T545 HydrophobicContact CB-CG2 3.8Å; L529-T545 HydrophobicContact CD2-CG2 4.01Å
546	L	94.4	Very high	96.5	Very high	99 Å²	99	49.1 Å²	49.1	52%	0.518	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-27.9	170.8	-57.3	174.8	0	0	0	111.9	N544	N544-L546 PolarHBondContact O-N 3.11Å; N544-L546 WeakPolarHBondContact OD1-CB 3.35Å; N544-L546 PolarHBondContact OD1-N 2.9Å
547	T	95.6	Very high	96.4	Very high	78 Å²	78	47.7 Å²	47.7	48%	0.479	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-9.7	-179.7	62.6	0	0	0	0	113.5	N544 Q549	N544-T547 WeakPolarHBondContact CB-OG1 3.49Å; N544-T547 PolarHBondContact ND2-OG1 2.84Å; N544-T547 PolarHBondContact O-N 3.4Å; N544-T547 PolarHBondContact OD1-N 3.27Å; T547-Q549 PolarHBondContact O-N 3.44Å; T547-Q549 WeakPolarHBondContact OG1-CB 3.37Å; T547-Q549 WeakPolarHBondContact OG1-CG 3.28Å; T547-Q549 PolarHBondContact OG1-N 3.18Å; T547-Q549 PolarHBondContact OG1-OE1 2.8Å
548	G	94.7	Very high	96.3	Very high	27 Å²	27	47.2 Å²	47.2	28%	0.278	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	6.9	-172	0	0	0	0	0	114.2	Y509 N544	Y509-G548 WeakPolarHBondContact CE1-O 3.15Å; N544-G548 WeakPolarHBondContact O-CA 3.28Å; N544-G548 PolarHBondContact O-N 3.47Å
549	Q	96.4	Very high	96.3	Very high	113 Å²	113	42.7 Å²	42.7	53%	0.528	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	134.9	-172.2	-68.7	175.3	-20.2	0	0	113.4	W543 N544 T547	W543-Q549 WeakPolarHBondContact CA-O 3.49Å; N544-Q549 PolarHBondContact N-O 2.91Å; N544-Q549 PolarHBondContact O-N 2.83Å; T547-Q549 PolarHBondContact O-N 3.44Å; T547-Q549 WeakPolarHBondContact OG1-CB 3.37Å; T547-Q549 WeakPolarHBondContact OG1-CG 3.28Å; T547-Q549 PolarHBondContact OG1-N 3.18Å; T547-Q549 PolarHBondContact OG1-OE1 2.8Å
550	A	95.3	Very high	96.4	Very high	52 Å²	52	41.8 Å²	41.8	43%	0.43	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.3	158.7	0	0	0	0	0	109.4	E511 W543	E511-A550 WeakPolarHBondContact OE1-CB 3.5Å; W543-A550 HydrophobicContact CE3-CB 3.77Å; W543-A550 HydrophobicContact CZ3-CB 3.64Å
551	L	95.8	Very high	96.4	Very high	66 Å²	66	41.7 Å²	41.7	35%	0.346	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-54.9	-174.4	-63.6	177.4	0	0	0	112.5	L528 F542 N544	L528-L551 HydrophobicContact CD1-CD1 3.76Å; F542-L551 HydrophobicContact CB-CB 4.31Å; F542-L551 WeakPolarHBondContact O-CB 3.31Å; F542-L551 PolarHBondContact O-N 2.88Å; N544-L551 HydrophobicContact CB-CD1 4.11Å; N544-L551 HydrophobicContact CB-CD2 3.99Å; N544-L551 HydrophobicContact CB-CG 4.12Å
552	R	93.1	Very high	96.4	Very high	132 Å²	132	40.7 Å²	40.7	50%	0.498	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	153.3	-174.6	-63.4	-171.4	176.7	-144.7	-15.4	109.9	F542 P589 L591	F542-R552 HydrophobicContact CD2-CB 4.26Å; F542-R552 PolarHBondContact N-O 2.87Å; R552-P589 PolarHBondContact NH1-O 2.96Å; R552-L591 HydrophobicContact CB-CD1 3.86Å
553	S	95.8	Very high	96.4	Very high	71 Å²	71	41.2 Å²	41.2	50%	0.497	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.9	168.9	57.4	0	0	0	0	110.5	I540	I540-S553 CarbonylContact O-C 3.58Å; I540-S553 VanDerWaalsContact O-CA 3.25Å; I540-S553 WeakPolarHBondContact O-CA 3.43Å
554	V	97.1	Very high	96.4	Very high	29 Å²	29	41.6 Å²	41.6	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	125.9	171.3	58.4	0	0	0	0	109.6	C539 I540 W586 L591	C539-V554 CarbonylContact C-O 3.52Å; C539-V554 VanDerWaalsContact CA-O 3.3Å; C539-V554 WeakPolarHBondContact CA-O 3.23Å; I540-V554 HydrophobicContact CB-CG1 3.95Å; I540-V554 PolarHBondContact N-O 3.1Å; I540-V554 PolarHBondContact O-N 3.38Å; V554-W586 HydrophobicContact CG1-CH2 4.36Å; V554-W586 HydrophobicContact CG1-CZ3 4.33Å; V554-W586 HydrophobicContact CG2-CH2 3.92Å; V554-W586 HydrophobicContact CG2-CZ3 3.72Å; V554-L591 HydrophobicContact CB-CD1 4.09Å; V554-L591 HydrophobicContact CG1-CD1 4.16Å
555	D	96.6	Very high	96.4	Very high	87 Å²	87	40.6 Å²	40.6	47%	0.465	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128.3	168.1	-172.7	-3.4	0	0	0	108.4	R538 G557	R538-D555 WeakPolarHBondContact CB-OD1 3.38Å; R538-D555 IonicContact NE-OD1 2.98Å; R538-D555 IonicContact NH2-OD2 3.92Å; D555-G557 PolarHBondContact OD1-N 2.91Å
556	T	95.6	Very high	96.4	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.043	23%	0.232	C	C	.	.			trans	-98.3	-5.2	179.7	71.9	0	0	0	0	112.9	R538 I540 S558 V560 H576 W586	R538-T556 WeakPolarHBondContact O-CB 3.4Å; R538-T556 PolarHBondContact O-N 2.83Å; R538-T556 PolarHBondContact O-OG1 2.74Å; I540-T556 HydrophobicContact CB-CG2 4.47Å; I540-T556 HydrophobicContact CD1-CG2 3.71Å; I540-T556 HydrophobicContact CG1-CG2 3.71Å; T556-S558 PolarHBondContact O-N 2.83Å; T556-S558 PolarHBondContact OG1-O 3.11Å; T556-V560 HydrophobicContact CG2-CG2 4.26Å; T556-H576 VanDerWaalsContact CB-CE1 3.49Å; T556-H576 WeakPolarHBondContact CB-CE1 3.38Å; T556-H576 PolarHBondContact OG1-CE1 2.84Å; T556-H576 VanDerWaalsContact OG1-CE1 3.31Å; T556-H576 PolarHBondContact OG1-ND1 3.41Å; T556-W586 HydrophobicContact CG2-CH2 3.92Å; T556-W586 HydrophobicContact CG2-CZ2 3.62Å
557	G	94.6	Very high	96.4	Very high	31 Å²	31	39.7 Å²	39.7	32%	0.32	23%	0.228	S	C	.	.	S	Bend	trans	66.1	16.9	-178.5	0	0	0	0	0	113.9	D555 Q580	D555-G557 PolarHBondContact OD1-N 2.91Å; G557-Q580 PolarHBondContact O-NE2 3.45Å
558	S	95.8	Very high	96.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-158	152.6	-175.8	-143.4	0	0	0	0	110.8	R538 T556 V560 G577 Y578 S579 Q580	R538-S558 WeakPolarHBondContact CA-O 3.45Å; R538-S558 WeakPolarHBondContact CB-O 3.35Å; T556-S558 PolarHBondContact O-N 2.83Å; T556-S558 PolarHBondContact OG1-O 3.11Å; S558-V560 PolarHBondContact O-N 3.36Å; S558-G577 PolarHBondContact OG-O 3.09Å; S558-Y578 CarbonylContact C-O 3.58Å; S558-Y578 WeakPolarHBondContact CA-O 3.19Å; S558-Y578 PolarHBondContact OG-O 3.49Å; S558-S579 PolarHBondContact OG-N 2.93Å; S558-Q580 PolarHBondContact OG-N 3.34Å
559	Q	97.6	Very high	96.1	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.019	21%	0.214	C	C	.	.			trans	-51.2	127.9	169.2	178	177.4	41.1	0	0	110.3	F220 T535 H576 G577 Y578	F220-Q559 HydrophobicContact CD2-CG 4.37Å; F220-Q559 VanDerWaalsContact CD2-NE2 3.27Å; F220-Q559 HydrophobicContact CE2-CG 3.8Å; F220-Q559 VanDerWaalsContact CE2-NE2 3.33Å; F220-Q559 HydrophobicContact CZ-CG 4.47Å; T535-Q559 PolarHBondContact OG1-NE2 3.17Å; Q559-H576 CarbonylContact O-C 3.56Å; Q559-H576 WeakPolarHBondContact O-CA 3.35Å; Q559-G577 PolarHBondContact O-N 3.06Å; Q559-Y578 PolarHBondContact N-O 2.96Å
560	V	98.4	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.5	176.8	-169.4	0	0	0	0	109.4	A518 G533 I540 T556 S558 I563	A518-V560 HydrophobicContact CB-CG1 3.88Å; G533-V560 PolarHBondContact O-N 3.41Å; I540-V560 HydrophobicContact CD1-CG1 4.41Å; I540-V560 HydrophobicContact CG1-CG1 4.13Å; I540-V560 HydrophobicContact CG1-CG2 4Å; T556-V560 HydrophobicContact CG2-CG2 4.26Å; S558-V560 PolarHBondContact O-N 3.36Å; V560-I563 HydrophobicContact CG1-CD1 4.4Å; V560-I563 HydrophobicContact CG1-CG1 4.16Å
561	C	98.2	Very high	96	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-47.8	-177.3	-63	0	0	0	0	111.9	F220 K517 T575 G577 V604	F220-C561 HydrophobicContact CE2-CB 4.36Å; K517-C561 WeakPolarHBondContact CD-O 3.14Å; K517-C561 WeakPolarHBondContact CG-O 3.44Å; C561-T575 PolarHBondContact N-O 3.04Å; C561-G577 PolarHBondContact SG-N 3.34Å; C561-G577 VanDerWaalsContact SG-N 3.41Å; C561-V604 VanDerWaalsContact CB-O 3.23Å; C561-V604 WeakPolarHBondContact CB-O 3.3Å
562	N	98.6	Very high	96	Very high	20 Å²	20	32.3 Å²	32.3	11%	0.107	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.2	178.5	-59.4	-80.9	0	0	0	111.4	S574 T575 L605 L607	N562-S574 VanDerWaalsContact O-CA 3.23Å; N562-S574 WeakPolarHBondContact O-CA 3.5Å; N562-T575 PolarHBondContact N-OG1 2.82Å; N562-T575 PolarHBondContact ND2-OG1 3.42Å; N562-T575 VanDerWaalsContact ND2-OG1 3.15Å; N562-T575 PolarHBondContact O-N 3.17Å; N562-L605 VanDerWaalsContact ND2-C 3.32Å; N562-L605 PolarHBondContact ND2-O 3.41Å; N562-L607 HydrophobicContact CB-CB 3.61Å; N562-L607 HydrophobicContact CB-CD2 3.58Å; N562-L607 HydrophobicContact CB-CG 4.24Å
563	I	98.4	Very high	96.3	Very high	11 Å²	11	26 Å²	26	6%	0.056	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.9	167.7	-64.9	158.2	0	0	0	108.2	A518 A520 A530 S531 I540 V560 L572 V573	A518-I563 HydrophobicContact CB-CD1 3.93Å; A518-I563 HydrophobicContact CB-CG1 3.95Å; A520-I563 HydrophobicContact CB-CB 4.02Å; A520-I563 HydrophobicContact CB-CG2 3.77Å; A520-I563 WeakPolarHBondContact CB-O 3.27Å; A530-I563 HydrophobicContact CB-CD1 4.39Å; A530-I563 HydrophobicContact CB-CG2 4.28Å; S531-I563 VanDerWaalsContact C-CD1 3.5Å; I540-I563 HydrophobicContact CD1-CD1 4.42Å; I540-I563 HydrophobicContact CD1-CG1 4.38Å; I540-I563 HydrophobicContact CG1-CD1 4.17Å; I540-I563 HydrophobicContact CG2-CD1 3.87Å; V560-I563 HydrophobicContact CG1-CD1 4.4Å; V560-I563 HydrophobicContact CG1-CG1 4.16Å; I563-L572 HydrophobicContact CG2-CD1 4.05Å; I563-V573 CarbonylContact C-O 3.57Å; I563-V573 VanDerWaalsContact CA-O 3.3Å; I563-V573 WeakPolarHBondContact CA-O 3.39Å
564	A	98.1	Very high	96.4	Very high	8 Å²	8	22.7 Å²	22.7	7%	0.066	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.5	175.9	0	0	0	0	0	110.2	L572 V573 L607 I609	A564-L572 CarbonylContact O-C 3.58Å; A564-L572 WeakPolarHBondContact O-CA 3.21Å; A564-L572 WeakPolarHBondContact O-CB 3.25Å; A564-V573 HydrophobicContact CB-CB 4.48Å; A564-V573 PolarHBondContact N-O 2.86Å; A564-V573 PolarHBondContact O-N 2.92Å; A564-L607 HydrophobicContact CB-CD2 3.52Å; A564-L607 HydrophobicContact CB-CG 4.36Å; A564-I609 HydrophobicContact CB-CD1 3.67Å; A564-I609 HydrophobicContact CB-CG1 3.9Å
565	W	97.7	Very high	96.5	Very high	10 Å²	10	21.3 Å²	21.3	4%	0.038	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	142.5	170.6	-70.8	98.5	0	0	0	110.9	A520 W521 P523 L528 A530 F542 L572 Y588 I609	A520-W565 PolarHBondContact O-NE1 2.91Å; W521-W565 VanDerWaalsContact C-CD1 3.44Å; P523-W565 VanDerWaalsContact CD-CB 3.46Å; P523-W565 HydrophobicContact CG-CB 4.17Å; L528-W565 HydrophobicContact CD2-CH2 3.87Å; L528-W565 HydrophobicContact CD2-CZ2 4.03Å; L528-W565 HydrophobicContact CG-CZ2 4.26Å; A530-W565 HydrophobicContact CB-CZ2 3.99Å; F542-W565 HydrophobicContact CD1-CH2 4.22Å; F542-W565 HydrophobicContact CD1-CZ2 4.04Å; F542-W565 AromaticContact CE1-CH2 3.77Å; F542-W565 HydrophobicContact CE1-CH2 3.77Å; F542-W565 AromaticContact CE1-CZ2 3.73Å; F542-W565 HydrophobicContact CE1-CZ2 3.73Å; W565-L572 HydrophobicContact CD2-CB 4.12Å; W565-L572 HydrophobicContact CE3-CB 3.91Å; W565-L572 HydrophobicContact CE3-CD2 4.17Å; W565-L572 HydrophobicContact CH2-CD2 3.74Å; W565-L572 HydrophobicContact CZ2-CD2 4.22Å; W565-L572 HydrophobicContact CZ3-CB 4.31Å; W565-L572 HydrophobicContact CZ3-CD2 3.71Å; W565-Y588 AromaticContact CH2-CD1 3.97Å; W565-Y588 HydrophobicContact CH2-CD1 3.97Å; W565-Y588 AromaticContact CH2-CD2 3.81Å; W565-Y588 HydrophobicContact CH2-CD2 3.81Å; W565-Y588 HydrophobicContact CH2-CE1 4.42Å; W565-Y588 HydrophobicContact CH2-CE2 4.29Å; W565-Y588 AromaticContact CH2-CG 3.65Å; W565-Y588 HydrophobicContact CH2-CG 3.65Å; W565-Y588 HydrophobicContact CZ3-CD1 4.14Å; W565-Y588 HydrophobicContact CZ3-CD2 4.43Å; W565-Y588 AromaticContact CZ3-CG 3.86Å; W565-Y588 HydrophobicContact CZ3-CG 3.86Å; W565-I609 WeakPolarHBondContact O-CD1 3.35Å
566	S	96.4	Very high	96.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.099	C	C	.	.			trans	-68.7	139.2	166.4	-168.4	0	0	0	0	110.4	H524 H568 S569 E571 F631	H524-S566 PolarHBondContact NE2-O 2.88Å; S566-H568 VanDerWaalsContact C-N 3.3Å; S566-H568 PolarHBondContact OG-N 2.92Å; S566-S569 WeakPolarHBondContact CB-O 3.39Å; S566-S569 WeakPolarHBondContact CB-OG 3.47Å; S566-S569 VanDerWaalsContact O-O 3.14Å; S566-S569 PolarHBondContact OG-OG 3.37Å; S566-E571 WeakPolarHBondContact CB-O 3.46Å; S566-E571 PolarHBondContact N-O 2.94Å; S566-F631 VanDerWaalsContact CB-CE1 3.46Å; S566-F631 WeakPolarHBondContact OG-CD1 3.46Å; S566-F631 VanDerWaalsContact OG-CG 3.27Å; S566-F631 WeakPolarHBondContact OG-CG 3.49Å
567	I	94.4	Very high	96.5	Very high	87 Å²	87	16.8 Å²	16.8	45%	0.446	10%	0.097	S	C	.	.	S	Bend	trans	-81.8	-9.7	169.2	70.1	178.2	0	0	0	112.7	H524	H524-I567 PolarHBondContact CE1-O 3.11Å
568	H	92.7	Very high	96.1	Very high	53 Å²	53	19.5 Å²	19.5	25%	0.245	10%	0.098	C	C	.	.	S	Bend	trans	-103.7	-18	-176.8	-60	-61.2	0	0	0	113.8	S566 D612 G613	S566-H568 VanDerWaalsContact C-N 3.3Å; S566-H568 PolarHBondContact OG-N 2.92Å; H568-D612 PolarHBondContact CE1-O 3.26Å; H568-D612 VanDerWaalsContact CE1-O 3.27Å; H568-D612 PolarHBondContact NE2-O 3.13Å; H568-G613 PolarHBondContact CD2-O 2.58Å; H568-G613 VanDerWaalsContact CD2-O 3.31Å
569	S	91.9	Very high	95.8	Very high	30 Å²	30	24.3 Å²	24.3	21%	0.21	13%	0.131	C	C	.	.	S	Bend	trans	-152.2	163.5	-174.1	63.2	0	0	0	0	111.8	H524 S566 E571	H524-S569 PolarHBondContact CD2-O 2.87Å; H524-S569 PolarHBondContact NE2-O 3.34Å; S566-S569 WeakPolarHBondContact CB-O 3.39Å; S566-S569 WeakPolarHBondContact CB-OG 3.47Å; S566-S569 VanDerWaalsContact O-O 3.14Å; S566-S569 PolarHBondContact OG-OG 3.37Å; S569-E571 PolarHBondContact O-N 2.86Å; S569-E571 WeakPolarHBondContact OG-CB 3.39Å; S569-E571 WeakPolarHBondContact OG-CG 3.33Å; S569-E571 PolarHBondContact OG-OE2 3.34Å
570	N	92.9	Very high	95.3	Very high	84 Å²	84	27.2 Å²	27.2	45%	0.449	15%	0.145	S	C	.	.	S	Bend	trans	-77.3	44.7	169.9	-65	-14.7	0	0	0	111.5	H524 Y588	H524-N570 PolarHBondContact CD2-OD1 3.09Å; H524-N570 VanDerWaalsContact CD2-OD1 3.26Å; N570-Y588 WeakPolarHBondContact O-CA 3.25Å; N570-Y588 VanDerWaalsContact O-CB 3.3Å; N570-Y588 WeakPolarHBondContact O-CB 3.33Å; N570-Y588 PolarHBondContact O-N 2.64Å
571	E	95.6	Very high	95.2	Very high	14 Å²	14	28.4 Å²	28.4	7%	0.065	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	150.9	176.8	-62.4	171	148	0	0	108.8	R201 S566 S569 W586 L594 F631	R201-E571 IonicContact CZ-OE1 2.73Å; R201-E571 IonicContact CZ-OE2 3.34Å; R201-E571 VanDerWaalsContact CZ-OE2 3.23Å; R201-E571 IonicContact NH1-OE1 3.41Å; R201-E571 IonicContact NH1-OE2 2.79Å; R201-E571 PolarHBondContact NH1-OE2 3.26Å; R201-E571 VanDerWaalsContact NH2-CD 3.26Å; R201-E571 IonicContact NH2-OE1 3.52Å; R201-E571 PolarHBondContact NH2-OE1 2.82Å; R201-E571 VanDerWaalsContact NH2-OE1 3.14Å; R201-E571 IonicContact NH2-OE2 3.44Å; R201-E571 PolarHBondContact NH2-OE2 3.21Å; S566-E571 WeakPolarHBondContact CB-O 3.46Å; S566-E571 PolarHBondContact N-O 2.94Å; S569-E571 PolarHBondContact O-N 2.86Å; S569-E571 WeakPolarHBondContact OG-CB 3.39Å; S569-E571 WeakPolarHBondContact OG-CG 3.33Å; S569-E571 PolarHBondContact OG-OE2 3.34Å; E571-W586 VanDerWaalsContact CA-O 3.28Å; E571-W586 WeakPolarHBondContact CA-O 3.33Å; E571-W586 WeakPolarHBondContact CB-O 3.46Å; E571-L594 HydrophobicContact CG-CD1 4.13Å; E571-L594 WeakPolarHBondContact OE1-CD1 3.38Å; E571-F631 HydrophobicContact CB-CE1 4.19Å
572	L	97.1	Very high	95.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.8	177.3	65.9	108.4	0	0	0	110.5	F542 I563 A564 W565 W586	F542-L572 HydrophobicContact CE1-CD2 3.72Å; F542-L572 HydrophobicContact CZ-CD2 3.71Å; I563-L572 HydrophobicContact CG2-CD1 4.05Å; A564-L572 CarbonylContact O-C 3.58Å; A564-L572 WeakPolarHBondContact O-CA 3.21Å; A564-L572 WeakPolarHBondContact O-CB 3.25Å; W565-L572 HydrophobicContact CD2-CB 4.12Å; W565-L572 HydrophobicContact CE3-CB 3.91Å; W565-L572 HydrophobicContact CE3-CD2 4.17Å; W565-L572 HydrophobicContact CH2-CD2 3.74Å; W565-L572 HydrophobicContact CZ2-CD2 4.22Å; W565-L572 HydrophobicContact CZ3-CB 4.31Å; W565-L572 HydrophobicContact CZ3-CD2 3.71Å; L572-W586 HydrophobicContact CD1-CB 4.28Å; L572-W586 HydrophobicContact CD1-CG 4.17Å; L572-W586 HydrophobicContact CG-CB 4.09Å; L572-W586 PolarHBondContact N-O 2.6Å; L572-W586 PolarHBondContact O-N 2.9Å
573	V	98	Very high	95	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.2	171.3	169.7	0	0	0	0	108.6	I563 A564 I583 L584 V585 I616 I630 F631	I563-V573 CarbonylContact C-O 3.57Å; I563-V573 VanDerWaalsContact CA-O 3.3Å; I563-V573 WeakPolarHBondContact CA-O 3.39Å; A564-V573 HydrophobicContact CB-CB 4.48Å; A564-V573 PolarHBondContact N-O 2.86Å; A564-V573 PolarHBondContact O-N 2.92Å; V573-I583 HydrophobicContact CG1-CG2 3.36Å; V573-L584 CarbonylContact C-O 3.58Å; V573-L584 VanDerWaalsContact CA-O 3.29Å; V573-L584 WeakPolarHBondContact CA-O 3.38Å; V573-V585 HydrophobicContact CG2-CG1 4.4Å; V573-V585 HydrophobicContact CG2-CG2 4.25Å; V573-I616 HydrophobicContact CG1-CD1 4.02Å; V573-I630 HydrophobicContact CG2-CD1 4.02Å; V573-I630 HydrophobicContact CG2-CG2 4.08Å; V573-F631 HydrophobicContact CG2-CE1 4.24Å; V573-F631 HydrophobicContact CG2-CE2 4.31Å; V573-F631 HydrophobicContact CG2-CZ 3.63Å
574	S	98.4	Very high	95	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.6	163.2	57.5	0	0	0	0	111.1	N562 H576 I583 L584 W586	N562-S574 VanDerWaalsContact O-CA 3.23Å; N562-S574 WeakPolarHBondContact O-CA 3.5Å; S574-H576 PolarHBondContact OG-CE1 3.04Å; S574-H576 PolarHBondContact OG-NE2 2.81Å; S574-I583 WeakPolarHBondContact O-CA 3.46Å; S574-L584 PolarHBondContact N-O 2.85Å; S574-L584 PolarHBondContact O-N 3.42Å; S574-W586 PolarHBondContact OG-NE1 2.91Å
575	T	98.5	Very high	94.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.6	171.6	72.8	0	0	0	0	110.3	C561 N562 I583 V604 L607 T618	C561-T575 PolarHBondContact N-O 3.04Å; N562-T575 PolarHBondContact N-OG1 2.82Å; N562-T575 PolarHBondContact ND2-OG1 3.42Å; N562-T575 VanDerWaalsContact ND2-OG1 3.15Å; N562-T575 PolarHBondContact O-N 3.17Å; T575-I583 HydrophobicContact CG2-CG1 4.31Å; T575-I583 HydrophobicContact CG2-CG2 4.38Å; T575-V604 WeakPolarHBondContact CB-O 3.28Å; T575-V604 HydrophobicContact CG2-CG1 3.84Å; T575-V604 PolarHBondContact OG1-O 2.65Å; T575-L607 HydrophobicContact CG2-CB 4.02Å; T575-L607 HydrophobicContact CG2-CD1 3.89Å; T575-L607 HydrophobicContact CG2-CD2 4.03Å; T575-L607 HydrophobicContact CG2-CG 4.19Å; T575-T618 HydrophobicContact CG2-CG2 3.95Å
576	H	98.4	Very high	94.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.6	-170	-61.6	-84.5	0	0	0	113.4	T556 Q559 S574 N581 Q582 V604	T556-H576 VanDerWaalsContact CB-CE1 3.49Å; T556-H576 WeakPolarHBondContact CB-CE1 3.38Å; T556-H576 PolarHBondContact OG1-CE1 2.84Å; T556-H576 VanDerWaalsContact OG1-CE1 3.31Å; T556-H576 PolarHBondContact OG1-ND1 3.41Å; Q559-H576 CarbonylContact O-C 3.56Å; Q559-H576 WeakPolarHBondContact O-CA 3.35Å; S574-H576 PolarHBondContact OG-CE1 3.04Å; S574-H576 PolarHBondContact OG-NE2 2.81Å; H576-N581 WeakPolarHBondContact O-CA 3.37Å; H576-Q582 HydrophobicContact CB-CG 3.99Å; H576-Q582 WeakPolarHBondContact CB-O 3.42Å; H576-Q582 PolarHBondContact CD2-O 2.96Å; H576-Q582 PolarHBondContact N-O 3.03Å; H576-V604 PolarHBondContact O-N 2.97Å
577	G	95.1	Very high	94.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.163	C	C	.	.			trans	-91.5	-137.7	168.7	0	0	0	0	0	111.6	S558 Q559 C561 Q580 N581	S558-G577 PolarHBondContact OG-O 3.09Å; Q559-G577 PolarHBondContact O-N 3.06Å; C561-G577 PolarHBondContact SG-N 3.34Å; C561-G577 VanDerWaalsContact SG-N 3.41Å; G577-Q580 PolarHBondContact O-N 3.2Å; G577-N581 PolarHBondContact O-N 2.9Å; G577-N581 PolarHBondContact O-OD1 3.07Å
578	Y	86.4	Confident	94.9	Very high	88 Å²	88	29.7 Å²	29.7	35%	0.345	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	142.5	-179.2	-63.3	-56	0	0	0	112.2	S558 Q559 R603	S558-Y578 CarbonylContact C-O 3.58Å; S558-Y578 WeakPolarHBondContact CA-O 3.19Å; S558-Y578 PolarHBondContact OG-O 3.49Å; Q559-Y578 PolarHBondContact N-O 2.96Å; Y578-R603 HydrophobicContact CD1-CG 4.25Å; Y578-R603 HydrophobicContact CD2-CG 4.25Å; Y578-R603 HydrophobicContact CE1-CG 4.14Å; Y578-R603 HydrophobicContact CE2-CG 4.15Å; Y578-R603 HydrophobicContact CG-CG 4.3Å
579	S	88.2	Confident	95	Very high	101 Å²	101	30.4 Å²	30.4	71%	0.706	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	cis	-96	1.2	-1.8	58.1	0	0	0	0	114.5	S558	S558-S579 PolarHBondContact OG-N 2.93Å
580	Q	88.5	Confident	95.1	Very high	64 Å²	64	31.7 Å²	31.7	30%	0.299	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-17.3	-162.5	-56.3	-170	49	0	0	115.5	G557 S558 G577 Q582 K596	G557-Q580 PolarHBondContact O-NE2 3.45Å; S558-Q580 PolarHBondContact OG-N 3.34Å; G577-Q580 PolarHBondContact O-N 3.2Å; Q580-Q582 HydrophobicContact CB-CB 4.39Å; Q580-Q582 HydrophobicContact CB-CG 3.85Å; Q580-Q582 PolarHBondContact O-N 3.1Å; Q580-Q582 VanDerWaalsContact OE1-CD 3.27Å; Q580-K596 VanDerWaalsContact OE1-NZ 3.13Å
581	N	95.1	Very high	95.2	Very high	26 Å²	26	28.9 Å²	28.9	14%	0.139	15%	0.151	C	C	.	.			trans	47.1	38.9	175.6	-62.9	-7.7	0	0	0	114	H576 G577 S601 Y602	H576-N581 WeakPolarHBondContact O-CA 3.37Å; G577-N581 PolarHBondContact O-N 2.9Å; G577-N581 PolarHBondContact O-OD1 3.07Å; N581-S601 PolarHBondContact ND2-O 3.49Å; N581-Y602 WeakPolarHBondContact CB-O 3.49Å; N581-Y602 VanDerWaalsContact CG-C 3.45Å
582	Q	95.9	Very high	95.1	Very high	3 Å²	3	31.5 Å²	31.5	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	167.4	-166.3	68.8	-172.6	-0.5	0	0	112.5	H576 Q580 L584 L597 V598	H576-Q582 HydrophobicContact CB-CG 3.99Å; H576-Q582 WeakPolarHBondContact CB-O 3.42Å; H576-Q582 PolarHBondContact CD2-O 2.96Å; H576-Q582 PolarHBondContact N-O 3.03Å; Q580-Q582 HydrophobicContact CB-CB 4.39Å; Q580-Q582 HydrophobicContact CB-CG 3.85Å; Q580-Q582 PolarHBondContact O-N 3.1Å; Q580-Q582 VanDerWaalsContact OE1-CD 3.27Å; Q582-L584 HydrophobicContact CG-CD2 4.23Å; Q582-L584 HydrophobicContact CG-CG 4.14Å; Q582-L597 WeakPolarHBondContact CA-O 3.28Å; Q582-V598 HydrophobicContact CB-CG2 4.49Å
583	I	97.9	Very high	94.9	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.015	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.8	168.9	-49.8	156.7	0	0	0	107.1	V573 S574 T575 L597 V604 I616 T618 W628	V573-I583 HydrophobicContact CG1-CG2 3.36Å; S574-I583 WeakPolarHBondContact O-CA 3.46Å; T575-I583 HydrophobicContact CG2-CG1 4.31Å; T575-I583 HydrophobicContact CG2-CG2 4.38Å; I583-L597 HydrophobicContact CB-CB 4.13Å; I583-L597 HydrophobicContact CB-CD1 4.31Å; I583-L597 HydrophobicContact CD1-CB 4.47Å; I583-L597 HydrophobicContact CD1-CD1 4.49Å; I583-L597 HydrophobicContact CG2-CD1 4.34Å; I583-L597 PolarHBondContact N-O 3.46Å; I583-L597 PolarHBondContact O-N 2.95Å; I583-V604 HydrophobicContact CG1-CG1 4.31Å; I583-I616 HydrophobicContact CG2-CD1 4.14Å; I583-T618 HydrophobicContact CD1-CG2 3.59Å; I583-T618 HydrophobicContact CG1-CG2 4.1Å; I583-W628 HydrophobicContact CD1-CD2 4.16Å; I583-W628 VanDerWaalsContact CD1-CE2 3.49Å; I583-W628 HydrophobicContact CD1-CG 4.44Å; I583-W628 HydrophobicContact CD1-CZ2 3.75Å
584	L	97.5	Very high	94.7	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.4	178.2	-64.5	-175.9	0	0	0	110.3	V573 S574 Q582 W586 K596	V573-L584 CarbonylContact C-O 3.58Å; V573-L584 VanDerWaalsContact CA-O 3.29Å; V573-L584 WeakPolarHBondContact CA-O 3.38Å; S574-L584 PolarHBondContact N-O 2.85Å; S574-L584 PolarHBondContact O-N 3.42Å; Q582-L584 HydrophobicContact CG-CD2 4.23Å; Q582-L584 HydrophobicContact CG-CG 4.14Å; L584-W586 HydrophobicContact CB-CZ2 4.09Å; L584-W586 HydrophobicContact CD1-CH2 4.06Å; L584-W586 HydrophobicContact CD1-CZ2 3.41Å; L584-W586 VanDerWaalsContact CD1-CZ2 3.41Å; L584-W586 HydrophobicContact CG-CZ2 4.41Å; L584-K596 HydrophobicContact CD2-CB 3.68Å; L584-K596 HydrophobicContact CD2-CD 4.38Å; L584-K596 HydrophobicContact CD2-CG 3.94Å
585	V	96.9	Very high	94.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.5	172.3	-166.7	0	0	0	0	108.3	V573 L594 V595 I630	V573-V585 HydrophobicContact CG2-CG1 4.4Å; V573-V585 HydrophobicContact CG2-CG2 4.25Å; V585-L594 HydrophobicContact CB-CB 4.4Å; V585-L594 HydrophobicContact CG1-CD1 4.3Å; V585-L594 PolarHBondContact O-N 2.81Å; V585-V595 HydrophobicContact CB-CB 4.44Å; V585-V595 HydrophobicContact CG2-CB 4.19Å; V585-V595 PolarHBondContact N-O 3.18Å; V585-I630 HydrophobicContact CG1-CG2 3.98Å; V585-I630 HydrophobicContact CG2-CD1 4.31Å; V585-I630 HydrophobicContact CG2-CG2 3.77Å
586	W	96.8	Very high	94.3	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.9	-176.9	-46.2	79.4	0	0	0	111.5	I540 V554 T556 E571 L572 S574 L584 Q593	I540-W586 HydrophobicContact CD1-CZ2 4.41Å; V554-W586 HydrophobicContact CG1-CH2 4.36Å; V554-W586 HydrophobicContact CG1-CZ3 4.33Å; V554-W586 HydrophobicContact CG2-CH2 3.92Å; V554-W586 HydrophobicContact CG2-CZ3 3.72Å; T556-W586 HydrophobicContact CG2-CH2 3.92Å; T556-W586 HydrophobicContact CG2-CZ2 3.62Å; E571-W586 VanDerWaalsContact CA-O 3.28Å; E571-W586 WeakPolarHBondContact CA-O 3.33Å; E571-W586 WeakPolarHBondContact CB-O 3.46Å; L572-W586 HydrophobicContact CD1-CB 4.28Å; L572-W586 HydrophobicContact CD1-CG 4.17Å; L572-W586 HydrophobicContact CG-CB 4.09Å; L572-W586 PolarHBondContact N-O 2.6Å; L572-W586 PolarHBondContact O-N 2.9Å; S574-W586 PolarHBondContact OG-NE1 2.91Å; L584-W586 HydrophobicContact CB-CZ2 4.09Å; L584-W586 HydrophobicContact CD1-CH2 4.06Å; L584-W586 HydrophobicContact CD1-CZ2 3.41Å; L584-W586 VanDerWaalsContact CD1-CZ2 3.41Å; L584-W586 HydrophobicContact CG-CZ2 4.41Å; W586-Q593 HydrophobicContact CD2-CG 4.12Å; W586-Q593 HydrophobicContact CE3-CB 4.48Å; W586-Q593 HydrophobicContact CE3-CG 3.48Å; W586-Q593 VanDerWaalsContact CE3-CG 3.48Å; W586-Q593 HydrophobicContact CH2-CG 3.82Å; W586-Q593 HydrophobicContact CZ2-CG 4.38Å; W586-Q593 HydrophobicContact CZ3-CG 3.31Å
587	R	95	Very high	94.2	Very high	124 Å²	124	45.1 Å²	45.1	47%	0.468	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.2	166.5	179.7	170.6	-68.3	178.7	-0	110.4	S590 L591 T592 L594	R587-S590 WeakPolarHBondContact CG-OG 3.03Å; R587-S590 PolarHBondContact O-N 3.07Å; R587-S590 PolarHBondContact O-OG 2.85Å; R587-L591 VanDerWaalsContact O-CA 3.3Å; R587-L591 WeakPolarHBondContact O-CA 3.47Å; R587-L591 PolarHBondContact O-N 2.92Å; R587-T592 PolarHBondContact N-O 2.96Å; R587-L594 HydrophobicContact CB-CD1 4.17Å; R587-L594 HydrophobicContact CB-CD2 4.17Å; R587-L594 HydrophobicContact CB-CG 4.21Å
588	Y	95.9	Very high	94.2	Very high	27 Å²	27	49.3 Å²	49.3	11%	0.106	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	143.6	168.6	-174.5	-93.9	0	0	0	109.8	L528 F542 W565 N570 L591	L528-Y588 WeakPolarHBondContact CD1-OH 3.5Å; L528-Y588 HydrophobicContact CD2-CD1 4.22Å; L528-Y588 HydrophobicContact CD2-CE1 3.46Å; L528-Y588 VanDerWaalsContact CD2-CE1 3.46Å; L528-Y588 HydrophobicContact CD2-CE2 4.39Å; F542-Y588 HydrophobicContact CB-CE2 4.44Å; F542-Y588 AromaticContact CD1-CD2 3.9Å; F542-Y588 HydrophobicContact CD1-CD2 3.9Å; F542-Y588 AromaticContact CD1-CE2 3.54Å; F542-Y588 HydrophobicContact CD1-CE2 3.54Å; F542-Y588 HydrophobicContact CD2-CE2 4.5Å; F542-Y588 AromaticContact CE1-CD2 3.7Å; F542-Y588 HydrophobicContact CE1-CD2 3.7Å; F542-Y588 AromaticContact CE1-CE2 3.86Å; F542-Y588 HydrophobicContact CE1-CE2 3.86Å; F542-Y588 HydrophobicContact CG-CD2 4.48Å; F542-Y588 AromaticContact CG-CE2 3.9Å; F542-Y588 HydrophobicContact CG-CE2 3.9Å; F542-Y588 HydrophobicContact CZ-CD2 4.13Å; F542-Y588 HydrophobicContact CZ-CE2 4.48Å; W565-Y588 AromaticContact CH2-CD1 3.97Å; W565-Y588 HydrophobicContact CH2-CD1 3.97Å; W565-Y588 AromaticContact CH2-CD2 3.81Å; W565-Y588 HydrophobicContact CH2-CD2 3.81Å; W565-Y588 HydrophobicContact CH2-CE1 4.42Å; W565-Y588 HydrophobicContact CH2-CE2 4.29Å; W565-Y588 AromaticContact CH2-CG 3.65Å; W565-Y588 HydrophobicContact CH2-CG 3.65Å; W565-Y588 HydrophobicContact CZ3-CD1 4.14Å; W565-Y588 HydrophobicContact CZ3-CD2 4.43Å; W565-Y588 AromaticContact CZ3-CG 3.86Å; W565-Y588 HydrophobicContact CZ3-CG 3.86Å; N570-Y588 WeakPolarHBondContact O-CA 3.25Å; N570-Y588 VanDerWaalsContact O-CB 3.3Å; N570-Y588 WeakPolarHBondContact O-CB 3.33Å; N570-Y588 PolarHBondContact O-N 2.64Å; Y588-L591 HydrophobicContact CD2-CD2 3.94Å
589	P	95.1	Very high	94.5	Very high	68 Å²	68	46.4 Å²	46.4	44%	0.442	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.7	0.3	2.2	35.7	-36.6	0	0	0	115.2	R552 L591	R552-P589 PolarHBondContact NH1-O 2.96Å; P589-L591 PolarHBondContact O-N 2.88Å
590	S	94.6	Very high	94.9	Very high	58 Å²	58	42.1 Å²	42.1	41%	0.406	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.7	-174.3	58.6	0	0	0	0	114.9	R587 T592	R587-S590 WeakPolarHBondContact CG-OG 3.03Å; R587-S590 PolarHBondContact O-N 3.07Å; R587-S590 PolarHBondContact O-OG 2.85Å; S590-T592 PolarHBondContact O-N 2.93Å; S590-T592 VanDerWaalsContact O-N 3.14Å; S590-T592 PolarHBondContact OG-OG1 3.09Å
591	L	94	Very high	95.2	Very high	25 Å²	25	43.2 Å²	43.2	13%	0.131	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	25.4	-174.3	-53.2	-175	0	0	0	113.8	F542 R552 V554 R587 Y588 P589	F542-L591 HydrophobicContact CD2-CD1 4.21Å; F542-L591 HydrophobicContact CD2-CD2 4.2Å; F542-L591 HydrophobicContact CE2-CD1 3.9Å; F542-L591 HydrophobicContact CE2-CD2 3.4Å; F542-L591 HydrophobicContact CE2-CG 4.33Å; F542-L591 HydrophobicContact CZ-CD2 3.59Å; R552-L591 HydrophobicContact CB-CD1 3.86Å; V554-L591 HydrophobicContact CB-CD1 4.09Å; V554-L591 HydrophobicContact CG1-CD1 4.16Å; R587-L591 VanDerWaalsContact O-CA 3.3Å; R587-L591 WeakPolarHBondContact O-CA 3.47Å; R587-L591 PolarHBondContact O-N 2.92Å; Y588-L591 HydrophobicContact CD2-CD2 3.94Å; P589-L591 PolarHBondContact O-N 2.88Å
592	T	93.9	Very high	95.3	Very high	68 Å²	68	45.7 Å²	45.7	42%	0.417	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.6	175.2	51.7	0	0	0	0	109.8	R587 S590 L594	R587-T592 PolarHBondContact N-O 2.96Å; S590-T592 PolarHBondContact O-N 2.93Å; S590-T592 VanDerWaalsContact O-N 3.14Å; S590-T592 PolarHBondContact OG-OG1 3.09Å; T592-L594 PolarHBondContact O-N 2.88Å
593	Q	93.8	Very high	95.4	Very high	107 Å²	107	46.4 Å²	46.4	50%	0.5	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	126.6	169.6	-65.5	178.9	-1.9	0	0	109.6	W586	W586-Q593 HydrophobicContact CD2-CG 4.12Å; W586-Q593 HydrophobicContact CE3-CB 4.48Å; W586-Q593 HydrophobicContact CE3-CG 3.48Å; W586-Q593 VanDerWaalsContact CE3-CG 3.48Å; W586-Q593 HydrophobicContact CH2-CG 3.82Å; W586-Q593 HydrophobicContact CZ2-CG 4.38Å; W586-Q593 HydrophobicContact CZ3-CG 3.31Å
594	L	92.8	Very high	95.4	Very high	54 Å²	54	46.2 Å²	46.2	28%	0.283	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-45.6	176.7	-62.8	176.7	0	0	0	110.8	E571 V585 R587 T592	E571-L594 HydrophobicContact CG-CD1 4.13Å; E571-L594 WeakPolarHBondContact OE1-CD1 3.38Å; V585-L594 HydrophobicContact CB-CB 4.4Å; V585-L594 HydrophobicContact CG1-CD1 4.3Å; V585-L594 PolarHBondContact O-N 2.81Å; R587-L594 HydrophobicContact CB-CD1 4.17Å; R587-L594 HydrophobicContact CB-CD2 4.17Å; R587-L594 HydrophobicContact CB-CG 4.21Å; T592-L594 PolarHBondContact O-N 2.88Å
595	V	94.1	Very high	95.4	Very high	27 Å²	27	46.2 Å²	46.2	16%	0.164	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	140.9	-177.2	179.1	0	0	0	0	110.3	I203 V585 L597	I203-V595 HydrophobicContact CB-CG2 4.11Å; I203-V595 HydrophobicContact CD1-CB 4.44Å; I203-V595 HydrophobicContact CD1-CG2 3.73Å; I203-V595 HydrophobicContact CG1-CG2 4.44Å; V585-V595 HydrophobicContact CB-CB 4.44Å; V585-V595 HydrophobicContact CG2-CB 4.19Å; V585-V595 PolarHBondContact N-O 3.18Å; V595-L597 HydrophobicContact CG1-CD2 3.52Å; V595-L597 HydrophobicContact CG1-CG 4.04Å
596	K	95.3	Very high	95.5	Very high	99 Å²	99	46.3 Å²	46.3	43%	0.43	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.1	164.2	169	170.3	169.6	145.7	0	108.5	Q580 L584 V598	Q580-K596 VanDerWaalsContact OE1-NZ 3.13Å; L584-K596 HydrophobicContact CD2-CB 3.68Å; L584-K596 HydrophobicContact CD2-CD 4.38Å; L584-K596 HydrophobicContact CD2-CG 3.94Å; K596-V598 HydrophobicContact CG-CG2 4.04Å
597	L	96.1	Very high	95.6	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.7	173.5	-49.1	169.8	0	0	0	108.2	I203 S204 Q582 I583 V595 W628 I630	I203-L597 HydrophobicContact CG2-CD2 4.5Å; S204-L597 VanDerWaalsContact O-CD2 3.24Å; S204-L597 WeakPolarHBondContact O-CD2 3.47Å; Q582-L597 WeakPolarHBondContact CA-O 3.28Å; I583-L597 HydrophobicContact CB-CB 4.13Å; I583-L597 HydrophobicContact CB-CD1 4.31Å; I583-L597 HydrophobicContact CD1-CB 4.47Å; I583-L597 HydrophobicContact CD1-CD1 4.49Å; I583-L597 HydrophobicContact CG2-CD1 4.34Å; I583-L597 PolarHBondContact N-O 3.46Å; I583-L597 PolarHBondContact O-N 2.95Å; V595-L597 HydrophobicContact CG1-CD2 3.52Å; V595-L597 HydrophobicContact CG1-CG 4.04Å; L597-W628 HydrophobicContact CB-CE3 4.33Å; L597-W628 HydrophobicContact CB-CH2 4.35Å; L597-W628 HydrophobicContact CB-CZ3 4.03Å; L597-W628 HydrophobicContact CD1-CD2 4.15Å; L597-W628 HydrophobicContact CD1-CE3 3.88Å; L597-W628 HydrophobicContact CD1-CG 4.46Å; L597-W628 HydrophobicContact CD1-CZ3 4.42Å; L597-W628 HydrophobicContact CD2-CE3 4.43Å; L597-W628 HydrophobicContact CD2-CZ3 4.48Å; L597-W628 HydrophobicContact CG-CE3 4.46Å; L597-I630 HydrophobicContact CD1-CD1 3.63Å; L597-I630 HydrophobicContact CD1-CG1 4.18Å
598	V	95	Very high	95.8	Very high	87 Å²	87	41.5 Å²	41.5	53%	0.527	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.2	179.3	-178.2	0	0	0	0	107.5	Q582 K596	Q582-V598 HydrophobicContact CB-CG2 4.49Å; K596-V598 HydrophobicContact CG-CG2 4.04Å
599	G	91.6	Very high	95.8	Very high	28 Å²	28	42.6 Å²	42.6	29%	0.289	24%	0.24	S	C	.	.			trans	177.3	-37.7	176.2	0	0	0	0	0	113.9	R626	G599-R626 VanDerWaalsContact C-CZ 3.43Å; G599-R626 PolarHBondContact O-NH1 2.73Å; G599-R626 PolarHBondContact O-NH2 2.91Å
600	H	97	Very high	95.9	Very high	10 Å²	10	39.6 Å²	39.6	5%	0.046	22%	0.221	C	C	.	.			trans	-70.1	138.2	176.2	-74.8	-73.6	0	0	0	111.5	V604 T618 A620 D622 T624 R626	H600-V604 HydrophobicContact CB-CG2 3.93Å; H600-T618 PolarHBondContact NE2-O 2.76Å; H600-T618 PolarHBondContact NE2-OG1 3.26Å; H600-A620 HydrophobicContact CB-CB 4.02Å; H600-A620 WeakPolarHBondContact ND1-CB 3.38Å; H600-D622 VanDerWaalsContact CA-OD2 3.24Å; H600-D622 WeakPolarHBondContact CA-OD2 3.44Å; H600-D622 IonicContact CE1-OD1 3.51Å; H600-D622 IonicContact CG-OD2 3.87Å; H600-D622 IonicContact ND1-OD1 2.77Å; H600-D622 PolarHBondContact ND1-OD1 3.46Å; H600-D622 IonicContact ND1-OD2 3.8Å; H600-D622 PolarHBondContact ND1-OD2 3.28Å; H600-D622 VanDerWaalsContact ND1-OD2 3.1Å; H600-T624 PolarHBondContact CE1-O 2.85Å; H600-T624 PolarHBondContact CE1-OG1 3.44Å; H600-T624 PolarHBondContact ND1-OG1 2.83Å; H600-R626 PolarHBondContact ND1-NE 3.15Å
601	S	95.7	Very high	96	Very high	88 Å²	88	39.5 Å²	39.5	62%	0.615	22%	0.219	S	C	*	.	S	Bend	trans	-81.5	-23.6	177.4	-59.7	0	0	0	0	112.6	N581 D622	N581-S601 PolarHBondContact ND2-O 3.49Å; S601-D622 PolarHBondContact N-OD2 3.19Å; S601-D622 VanDerWaalsContact N-OD2 3.15Å
602	Y	96.8	Very high	96	Very high	77 Å²	77	41.7 Å²	41.7	30%	0.302	23%	0.231	S	C	.	.	S	Bend	trans	-117.1	176.8	-179.5	-74.7	-104.8	0	0	0	111.2	N581 V604 D622	N581-Y602 WeakPolarHBondContact CB-O 3.49Å; N581-Y602 VanDerWaalsContact CG-C 3.45Å; Y602-V604 PolarHBondContact O-N 2.85Å; Y602-D622 HydrophobicContact CD2-CB 3.8Å
603	R	97.6	Very high	96.1	Very high	18 Å²	18	38.5 Å²	38.5	7%	0.068	21%	0.211	C	C	.	.			trans	-56.6	134.7	-179.5	-60.9	-178	-68.9	-168.8	-1.3	111.3	D218 Y578 L605 A620	D218-R603 PolarHBondContact O-NH2 3.04Å; D218-R603 IonicContact OD1-CZ 2.79Å; D218-R603 VanDerWaalsContact OD1-CZ 3.32Å; D218-R603 IonicContact OD1-NE 2.76Å; D218-R603 PolarHBondContact OD1-NE 2.92Å; D218-R603 IonicContact OD1-NH2 3.55Å; D218-R603 PolarHBondContact OD1-NH2 3.02Å; D218-R603 IonicContact OD2-NE 3.23Å; D218-R603 IonicContact OD2-NH2 3.9Å; Y578-R603 HydrophobicContact CD1-CG 4.25Å; Y578-R603 HydrophobicContact CD2-CG 4.25Å; Y578-R603 HydrophobicContact CE1-CG 4.14Å; Y578-R603 HydrophobicContact CE2-CG 4.15Å; Y578-R603 HydrophobicContact CG-CG 4.3Å; R603-L605 VanDerWaalsContact C-N 3.29Å; R603-L605 HydrophobicContact CB-CD2 3.72Å; R603-L605 HydrophobicContact CB-CG 4.05Å; R603-L605 PolarHBondContact O-N 2.83Å; R603-A620 WeakPolarHBondContact O-CA 3.27Å; R603-A620 WeakPolarHBondContact O-CB 3.15Å
604	V	98.2	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.			trans	-84.6	75.4	-179.7	-167.7	0	0	0	0	110.2	C561 T575 H576 I583 H600 Y602 T618 G619	C561-V604 VanDerWaalsContact CB-O 3.23Å; C561-V604 WeakPolarHBondContact CB-O 3.3Å; T575-V604 WeakPolarHBondContact CB-O 3.28Å; T575-V604 HydrophobicContact CG2-CG1 3.84Å; T575-V604 PolarHBondContact OG1-O 2.65Å; H576-V604 PolarHBondContact O-N 2.97Å; I583-V604 HydrophobicContact CG1-CG1 4.31Å; H600-V604 HydrophobicContact CB-CG2 3.93Å; Y602-V604 PolarHBondContact O-N 2.85Å; V604-T618 HydrophobicContact CG1-CG2 4.01Å; V604-G619 CarbonylContact C-O 3.55Å
605	L	98.3	Very high	96.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.192	C	C	.	.			trans	-74	-26.9	-171	-65.2	-169.4	0	0	0	114.7	D218 F220 N562 R603 G619	D218-L605 VanDerWaalsContact OD1-CD1 3.3Å; D218-L605 WeakPolarHBondContact OD1-CD1 3.35Å; F220-L605 HydrophobicContact CB-CD2 4.38Å; F220-L605 HydrophobicContact CD2-CD2 4.12Å; N562-L605 VanDerWaalsContact ND2-C 3.32Å; N562-L605 PolarHBondContact ND2-O 3.41Å; R603-L605 VanDerWaalsContact C-N 3.29Å; R603-L605 HydrophobicContact CB-CD2 3.72Å; R603-L605 HydrophobicContact CB-CG 4.05Å; R603-L605 PolarHBondContact O-N 2.83Å; L605-G619 PolarHBondContact N-O 2.86Å; L605-G619 VanDerWaalsContact N-O 3.13Å
606	Y	98.5	Very high	96.5	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.7	-171.3	-51.7	-62.8	0	0	0	111.8	L216 Q217 D219 L222 L224 V225 T618 G619	L216-Y606 HydrophobicContact CD1-CD2 3.92Å; L216-Y606 HydrophobicContact CD1-CE2 3.69Å; L216-Y606 HydrophobicContact CD2-CD2 3.95Å; L216-Y606 HydrophobicContact CD2-CE2 4.19Å; L216-Y606 HydrophobicContact CG-CD2 4.06Å; L216-Y606 HydrophobicContact CG-CE2 3.79Å; Q217-Y606 WeakPolarHBondContact O-CE2 3.3Å; Q217-Y606 PolarHBondContact O-OH 3.07Å; D219-Y606 PolarHBondContact O-OH 2.95Å; L222-Y606 HydrophobicContact CB-CE1 4.46Å; L222-Y606 WeakPolarHBondContact O-CE1 3.46Å; L224-Y606 HydrophobicContact CB-CD1 4.21Å; L224-Y606 HydrophobicContact CB-CE1 3.87Å; L224-Y606 HydrophobicContact CD1-CE1 4.37Å; L224-Y606 HydrophobicContact CD1-CE2 4.5Å; L224-Y606 HydrophobicContact CG-CE1 3.92Å; V225-Y606 HydrophobicContact CG2-CD2 4.43Å; V225-Y606 HydrophobicContact CG2-CG 3.96Å; Y606-T618 VanDerWaalsContact O-CA 3.29Å; Y606-T618 WeakPolarHBondContact O-CA 3.43Å; Y606-G619 PolarHBondContact N-O 3.02Å; Y606-G619 PolarHBondContact O-N 2.78Å
607	L	98.4	Very high	96.6	Very high	22 Å²	22	28.5 Å²	28.5	12%	0.115	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	129.5	-177.8	176.3	68	0	0	0	110.4	N562 A564 T575 I616 V617 T618	N562-L607 HydrophobicContact CB-CB 3.61Å; N562-L607 HydrophobicContact CB-CD2 3.58Å; N562-L607 HydrophobicContact CB-CG 4.24Å; A564-L607 HydrophobicContact CB-CD2 3.52Å; A564-L607 HydrophobicContact CB-CG 4.36Å; T575-L607 HydrophobicContact CG2-CB 4.02Å; T575-L607 HydrophobicContact CG2-CD1 3.89Å; T575-L607 HydrophobicContact CG2-CD2 4.03Å; T575-L607 HydrophobicContact CG2-CG 4.19Å; L607-I616 HydrophobicContact CD1-CB 4.04Å; L607-I616 HydrophobicContact CD1-CD1 3.75Å; L607-I616 HydrophobicContact CD1-CG1 4.45Å; L607-I616 HydrophobicContact CD1-CG2 4.4Å; L607-V617 WeakPolarHBondContact CA-O 3.1Å; L607-T618 HydrophobicContact CD1-CG2 3.87Å
608	A	98.3	Very high	96.7	Very high	5 Å²	5	28.4 Å²	28.4	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.1	164.5	0	0	0	0	0	111.1	V225 W227 I616 V617	V225-A608 HydrophobicContact CG1-CB 4.32Å; W227-A608 HydrophobicContact CB-CB 3.86Å; A608-I616 CarbonylContact O-C 3.53Å; A608-I616 VanDerWaalsContact O-CA 3.3Å; A608-I616 WeakPolarHBondContact O-CA 3.47Å; A608-V617 HydrophobicContact CB-CG1 3.83Å; A608-V617 PolarHBondContact N-O 2.93Å; A608-V617 PolarHBondContact O-N 3.27Å
609	I	97.5	Very high	96.9	Very high	49 Å²	49	24.3 Å²	24.3	25%	0.251	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.8	179.1	-42.7	175.2	0	0	0	108.1	W227 A564 W565 N615 I616	W227-I609 WeakPolarHBondContact CB-O 3.32Å; A564-I609 HydrophobicContact CB-CD1 3.67Å; A564-I609 HydrophobicContact CB-CG1 3.9Å; W565-I609 WeakPolarHBondContact O-CD1 3.35Å; I609-N615 WeakPolarHBondContact CG2-O 3.5Å; I609-I616 HydrophobicContact CG1-CG2 4.45Å; I609-I616 HydrophobicContact CG2-CG2 4.39Å
610	S	97.1	Very high	97.2	Very high	5 Å²	5	23 Å²	23	4%	0.035	12%	0.124	C	C	.	.			trans	-62.2	154.4	171.7	53.8	0	0	0	0	111.9	D612 G613 N615	S610-D612 VanDerWaalsContact CB-OD1 3.32Å; S610-D612 WeakPolarHBondContact CB-OD1 3.3Å; S610-D612 PolarHBondContact O-N 3.21Å; S610-D612 PolarHBondContact OG-OD1 3Å; S610-G613 WeakPolarHBondContact O-CA 3.15Å; S610-G613 PolarHBondContact O-N 2.8Å; S610-N615 PolarHBondContact N-O 2.77Å; S610-N615 WeakPolarHBondContact OG-CA 3.36Å; S610-N615 WeakPolarHBondContact OG-CB 3.26Å; S610-N615 PolarHBondContact OG-N 3.4Å; S610-N615 PolarHBondContact OG-O 3.43Å
611	P	96.1	Very high	97.1	Very high	56 Å²	56	23.3 Å²	23.3	36%	0.364	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.7	-179.2	27.4	-37.5	0	0	0	114	N231 G613	N231-P611 HydrophobicContact CB-CG 3.84Å; N231-P611 WeakPolarHBondContact OD1-CD 3.42Å; P611-G613 VanDerWaalsContact C-N 3.26Å
612	D	94.6	Very high	97.2	Very high	72 Å²	72	20.3 Å²	20.3	39%	0.385	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-12.5	170.2	60.9	24.3	0	0	0	113.2	H568 S610 E614	H568-D612 PolarHBondContact CE1-O 3.26Å; H568-D612 VanDerWaalsContact CE1-O 3.27Å; H568-D612 PolarHBondContact NE2-O 3.13Å; S610-D612 VanDerWaalsContact CB-OD1 3.32Å; S610-D612 WeakPolarHBondContact CB-OD1 3.3Å; S610-D612 PolarHBondContact O-N 3.21Å; S610-D612 PolarHBondContact OG-OD1 3Å; D612-E614 VanDerWaalsContact C-N 3.26Å; D612-E614 HydrophobicContact CB-CG 4.49Å; D612-E614 PolarHBondContact O-N 3.42Å; D612-E614 PolarHBondContact OD1-N 2.73Å
613	G	95.1	Very high	97.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	69.7	11.1	-178.6	0	0	0	0	0	116	H568 S610 P611 F631	H568-G613 PolarHBondContact CD2-O 2.58Å; H568-G613 VanDerWaalsContact CD2-O 3.31Å; S610-G613 WeakPolarHBondContact O-CA 3.15Å; S610-G613 PolarHBondContact O-N 2.8Å; P611-G613 VanDerWaalsContact C-N 3.26Å; G613-F631 WeakPolarHBondContact O-CB 3.43Å; G613-F631 VanDerWaalsContact O-CD2 3.3Å; G613-F631 WeakPolarHBondContact O-CD2 3.44Å
614	E	94.5	Very high	97.3	Very high	58 Å²	58	21.4 Å²	21.4	27%	0.271	12%	0.118	S	C	.	.	S	Bend	trans	-92.1	-34.8	-178.5	-60.1	-153.9	138.3	0	0	112.7	D612 I630 F631 K633	D612-E614 VanDerWaalsContact C-N 3.26Å; D612-E614 HydrophobicContact CB-CG 4.49Å; D612-E614 PolarHBondContact O-N 3.42Å; D612-E614 PolarHBondContact OD1-N 2.73Å; E614-I630 PolarHBondContact O-N 3.37Å; E614-F631 CarbonylContact C-O 3.52Å; E614-F631 VanDerWaalsContact CA-O 3.26Å; E614-F631 WeakPolarHBondContact CA-O 3.44Å; E614-F631 WeakPolarHBondContact CB-O 3.35Å; E614-F631 PolarHBondContact O-N 3.12Å; E614-F631 VanDerWaalsContact O-O 3.13Å; E614-K633 VanDerWaalsContact OE1-CB 3.23Å; E614-K633 WeakPolarHBondContact OE1-CB 3.21Å; E614-K633 PolarHBondContact OE1-N 3.46Å
615	N	95.9	Very high	97.3	Very high	19 Å²	19	21.7 Å²	21.7	10%	0.102	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	154.3	-174.2	-52.8	-76.6	0	0	0	111.5	Y208 I609 S610 W628 N629	Y208-N615 HydrophobicContact CE1-CB 4.2Å; Y208-N615 WeakPolarHBondContact CE1-OD1 3.45Å; I609-N615 WeakPolarHBondContact CG2-O 3.5Å; S610-N615 PolarHBondContact N-O 2.77Å; S610-N615 WeakPolarHBondContact OG-CA 3.36Å; S610-N615 WeakPolarHBondContact OG-CB 3.26Å; S610-N615 PolarHBondContact OG-N 3.4Å; S610-N615 PolarHBondContact OG-O 3.43Å; N615-W628 CarbonylContact C-O 3.6Å; N615-W628 VanDerWaalsContact CA-O 3.28Å; N615-W628 WeakPolarHBondContact CA-O 3.36Å; N615-N629 WeakPolarHBondContact OD1-CB 3.46Å
616	I	97.9	Very high	97.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	156.5	164.5	66.6	162.8	0	0	0	109.9	V573 I583 L607 A608 I609 T618 F627 W628 I630 F631	V573-I616 HydrophobicContact CG1-CD1 4.02Å; I583-I616 HydrophobicContact CG2-CD1 4.14Å; L607-I616 HydrophobicContact CD1-CB 4.04Å; L607-I616 HydrophobicContact CD1-CD1 3.75Å; L607-I616 HydrophobicContact CD1-CG1 4.45Å; L607-I616 HydrophobicContact CD1-CG2 4.4Å; A608-I616 CarbonylContact O-C 3.53Å; A608-I616 VanDerWaalsContact O-CA 3.3Å; A608-I616 WeakPolarHBondContact O-CA 3.47Å; I609-I616 HydrophobicContact CG1-CG2 4.45Å; I609-I616 HydrophobicContact CG2-CG2 4.39Å; I616-T618 HydrophobicContact CD1-CG2 3.87Å; I616-F627 CarbonylContact O-C 3.58Å; I616-F627 WeakPolarHBondContact O-CA 3.4Å; I616-W628 HydrophobicContact CD1-CB 4.48Å; I616-W628 HydrophobicContact CG1-CB 3.86Å; I616-W628 HydrophobicContact CG1-CG 4.25Å; I616-W628 PolarHBondContact N-O 3.45Å; I616-W628 PolarHBondContact O-N 2.95Å; I616-I630 HydrophobicContact CD1-CD1 3.39Å; I616-I630 HydrophobicContact CG1-CD1 3.63Å; I616-I630 HydrophobicContact CG1-CG1 4.3Å; I616-F631 HydrophobicContact CG2-CE2 4.36Å
617	V	98.4	Very high	97.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.9	164.5	63.7	0	0	0	0	109.2	V225 W227 L233 L607 A608 L625 R626 F627	V225-V617 HydrophobicContact CG1-CG1 4.15Å; W227-V617 HydrophobicContact CE3-CB 4.21Å; W227-V617 HydrophobicContact CE3-CG1 3.72Å; W227-V617 HydrophobicContact CZ3-CB 4Å; W227-V617 HydrophobicContact CZ3-CG1 4.05Å; L233-V617 HydrophobicContact CD1-CG1 3.7Å; L233-V617 HydrophobicContact CD2-CG1 4.29Å; L233-V617 HydrophobicContact CD2-CG2 4.21Å; L607-V617 WeakPolarHBondContact CA-O 3.1Å; A608-V617 HydrophobicContact CB-CG1 3.83Å; A608-V617 PolarHBondContact N-O 2.93Å; A608-V617 PolarHBondContact O-N 3.27Å; V617-L625 HydrophobicContact CG2-CB 4.05Å; V617-L625 HydrophobicContact CG2-CD2 4.18Å; V617-R626 CarbonylContact C-O 3.56Å; V617-R626 VanDerWaalsContact CA-O 3.32Å; V617-R626 WeakPolarHBondContact CA-O 3.42Å; V617-F627 HydrophobicContact CB-CD1 3.85Å; V617-F627 HydrophobicContact CB-CE1 3.76Å; V617-F627 HydrophobicContact CB-CG 4.42Å; V617-F627 HydrophobicContact CB-CZ 4.25Å; V617-F627 HydrophobicContact CG2-CD1 3.98Å; V617-F627 HydrophobicContact CG2-CD2 4.17Å; V617-F627 HydrophobicContact CG2-CE1 3.69Å; V617-F627 HydrophobicContact CG2-CE2 3.88Å; V617-F627 HydrophobicContact CG2-CG 4.22Å; V617-F627 HydrophobicContact CG2-CZ 3.65Å
618	T	98.6	Very high	97.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.4	175.8	58.6	0	0	0	0	111.5	T575 I583 H600 V604 Y606 L607 I616 L625 R626 W628	T575-T618 HydrophobicContact CG2-CG2 3.95Å; I583-T618 HydrophobicContact CD1-CG2 3.59Å; I583-T618 HydrophobicContact CG1-CG2 4.1Å; H600-T618 PolarHBondContact NE2-O 2.76Å; H600-T618 PolarHBondContact NE2-OG1 3.26Å; V604-T618 HydrophobicContact CG1-CG2 4.01Å; Y606-T618 VanDerWaalsContact O-CA 3.29Å; Y606-T618 WeakPolarHBondContact O-CA 3.43Å; L607-T618 HydrophobicContact CD1-CG2 3.87Å; I616-T618 HydrophobicContact CD1-CG2 3.87Å; T618-L625 CarbonylContact O-C 3.57Å; T618-L625 WeakPolarHBondContact O-CA 3.32Å; T618-R626 PolarHBondContact N-O 3.07Å; T618-R626 PolarHBondContact O-N 3.21Å; T618-W628 PolarHBondContact OG1-NE1 2.93Å
619	G	98.4	Very high	97	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.2	176.7	0	0	0	0	0	112.1	V604 L605 Y606	V604-G619 CarbonylContact C-O 3.55Å; L605-G619 PolarHBondContact N-O 2.86Å; L605-G619 VanDerWaalsContact N-O 3.13Å; Y606-G619 PolarHBondContact N-O 3.02Å; Y606-G619 PolarHBondContact O-N 2.78Å
620	A	98.3	Very high	96.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	167.3	-179.4	0	0	0	0	0	110.9	H600 R603 D622 E623	H600-A620 HydrophobicContact CB-CB 4.02Å; H600-A620 WeakPolarHBondContact ND1-CB 3.38Å; R603-A620 WeakPolarHBondContact O-CA 3.27Å; R603-A620 WeakPolarHBondContact O-CB 3.15Å; A620-D622 PolarHBondContact O-N 2.75Å; A620-E623 PolarHBondContact O-N 2.82Å
621	G	95.5	Very high	96.4	Very high	17 Å²	17	23 Å²	23	18%	0.175	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	13.7	169.9	0	0	0	0	0	115.2
622	D	96.5	Very high	95.7	Very high	26 Å²	26	23.2 Å²	23.2	14%	0.139	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	12	166.7	76.1	-14.1	0	0	0	112.4	H600 S601 Y602 A620 T624 R626	H600-D622 VanDerWaalsContact CA-OD2 3.24Å; H600-D622 WeakPolarHBondContact CA-OD2 3.44Å; H600-D622 IonicContact CE1-OD1 3.51Å; H600-D622 IonicContact CG-OD2 3.87Å; H600-D622 IonicContact ND1-OD1 2.77Å; H600-D622 PolarHBondContact ND1-OD1 3.46Å; H600-D622 IonicContact ND1-OD2 3.8Å; H600-D622 PolarHBondContact ND1-OD2 3.28Å; H600-D622 VanDerWaalsContact ND1-OD2 3.1Å; S601-D622 PolarHBondContact N-OD2 3.19Å; S601-D622 VanDerWaalsContact N-OD2 3.15Å; Y602-D622 HydrophobicContact CD2-CB 3.8Å; A620-D622 PolarHBondContact O-N 2.75Å; D622-T624 VanDerWaalsContact CG-OG1 3.23Å; D622-T624 PolarHBondContact O-N 3.43Å; D622-T624 PolarHBondContact OD1-N 2.75Å; D622-T624 PolarHBondContact OD1-OG1 3.42Å; D622-T624 PolarHBondContact OD2-OG1 2.97Å; D622-R626 IonicContact OD2-CZ 3.14Å; D622-R626 IonicContact OD2-NE 3.32Å; D622-R626 IonicContact OD2-NH2 2.74Å; D622-R626 PolarHBondContact OD2-NH2 3.41Å
623	E	97.8	Very high	94.8	Very high	97 Å²	97	26.9 Å²	26.9	45%	0.453	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	28.7	-178.2	-57.8	-169.6	124.6	0	0	113.5	A213 P214 E215 A620	A213-E623 PolarHBondContact N-O 2.83Å; A213-E623 WeakPolarHBondContact O-CA 3.46Å; A213-E623 WeakPolarHBondContact O-CB 3.3Å; P214-E623 WeakPolarHBondContact CA-OE1 3.47Å; E215-E623 PolarHBondContact N-OE1 3.41Å; A620-E623 PolarHBondContact O-N 2.82Å
624	T	98.3	Very high	93.5	Very high	21 Å²	21	30.2 Å²	30.2	13%	0.129	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144	175.3	71.5	0	0	0	0	113.5	V210 H600 D622 R626	V210-T624 HydrophobicContact CG1-CG2 4.13Å; H600-T624 PolarHBondContact CE1-O 2.85Å; H600-T624 PolarHBondContact CE1-OG1 3.44Å; H600-T624 PolarHBondContact ND1-OG1 2.83Å; D622-T624 VanDerWaalsContact CG-OG1 3.23Å; D622-T624 PolarHBondContact O-N 3.43Å; D622-T624 PolarHBondContact OD1-N 2.75Å; D622-T624 PolarHBondContact OD1-OG1 3.42Å; D622-T624 PolarHBondContact OD2-OG1 2.97Å; T624-R626 PolarHBondContact OG1-NE 2.64Å
625	L	98.4	Very high	92	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.3	161.9	-70.1	168.1	0	0	0	109.3	V210 L211 A213 L216 V225 L233 V235 V617 T618 F627	V210-L625 CarbonylContact C-O 3.48Å; V210-L625 VanDerWaalsContact CA-O 3.3Å; V210-L625 WeakPolarHBondContact CA-O 3.37Å; L211-L625 HydrophobicContact CB-CB 4.32Å; L211-L625 PolarHBondContact N-O 2.99Å; L211-L625 PolarHBondContact O-N 3.38Å; A213-L625 HydrophobicContact CB-CD1 4.12Å; A213-L625 HydrophobicContact CB-CG 3.9Å; L216-L625 HydrophobicContact CD2-CD2 4.48Å; V225-L625 HydrophobicContact CG1-CD2 4.43Å; V225-L625 HydrophobicContact CG2-CD2 3.98Å; L233-L625 HydrophobicContact CD2-CD1 4.24Å; V235-L625 HydrophobicContact CB-CD1 4.44Å; V235-L625 HydrophobicContact CG1-CD1 3.98Å; V235-L625 HydrophobicContact CG2-CD1 3.61Å; V617-L625 HydrophobicContact CG2-CB 4.05Å; V617-L625 HydrophobicContact CG2-CD2 4.18Å; T618-L625 CarbonylContact O-C 3.57Å; T618-L625 WeakPolarHBondContact O-CA 3.32Å; L625-F627 HydrophobicContact CB-CE2 4.37Å
626	R	98.4	Very high	90.2	Very high	41 Å²	41	42.5 Å²	42.5	16%	0.155	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.8	-175	-61.3	-176.1	-171.9	-144.4	15	110.8	P207 V210 G599 H600 V617 T618 D622 T624 W628	P207-R626 HydrophobicContact CB-CB 4.02Å; P207-R626 HydrophobicContact CG-CB 4.4Å; V210-R626 HydrophobicContact CG1-CG 4.21Å; V210-R626 HydrophobicContact CG2-CG 4.21Å; G599-R626 VanDerWaalsContact C-CZ 3.43Å; G599-R626 PolarHBondContact O-NH1 2.73Å; G599-R626 PolarHBondContact O-NH2 2.91Å; H600-R626 PolarHBondContact ND1-NE 3.15Å; V617-R626 CarbonylContact C-O 3.56Å; V617-R626 VanDerWaalsContact CA-O 3.32Å; V617-R626 WeakPolarHBondContact CA-O 3.42Å; T618-R626 PolarHBondContact N-O 3.07Å; T618-R626 PolarHBondContact O-N 3.21Å; D622-R626 IonicContact OD2-CZ 3.14Å; D622-R626 IonicContact OD2-NE 3.32Å; D622-R626 IonicContact OD2-NH2 2.74Å; D622-R626 PolarHBondContact OD2-NH2 3.41Å; T624-R626 PolarHBondContact OG1-NE 2.64Å; R626-W628 HydrophobicContact CB-CZ2 3.96Å; R626-W628 PolarHBondContact O-NE1 3.43Å
627	F	97.9	Very high	88.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.8	-177	-64.3	-100.8	0	0	0	110.8	P207 Y208 K209 L211 W227 L233 W244 I616 V617 L625	P207-F627 CarbonylContact C-O 3.57Å; P207-F627 WeakPolarHBondContact CA-O 3.28Å; P207-F627 VanDerWaalsContact CB-O 3.23Å; P207-F627 WeakPolarHBondContact CB-O 3.43Å; Y208-F627 HydrophobicContact CD1-CB 4.14Å; Y208-F627 VanDerWaalsContact CD1-O 3.25Å; Y208-F627 WeakPolarHBondContact CD1-O 3.33Å; Y208-F627 HydrophobicContact CD2-CB 4.46Å; Y208-F627 HydrophobicContact CE1-CB 3.61Å; Y208-F627 HydrophobicContact CE2-CB 3.96Å; Y208-F627 PolarHBondContact N-O 3.18Å; K209-F627 HydrophobicContact CB-CB 4.08Å; K209-F627 HydrophobicContact CB-CD2 3.99Å; K209-F627 HydrophobicContact CB-CG 4.24Å; K209-F627 HydrophobicContact CG-CD2 4.2Å; K209-F627 PolarHBondContact O-N 3.31Å; L211-F627 HydrophobicContact CB-CE2 4.41Å; L211-F627 HydrophobicContact CD1-CE2 3.65Å; L211-F627 HydrophobicContact CD1-CZ 3.83Å; L211-F627 HydrophobicContact CG-CE2 3.8Å; L211-F627 HydrophobicContact CG-CZ 4.48Å; W227-F627 AromaticContact CH2-CD1 3.75Å; W227-F627 HydrophobicContact CH2-CD1 3.75Å; W227-F627 AromaticContact CH2-CE1 3.75Å; W227-F627 HydrophobicContact CH2-CE1 3.75Å; W227-F627 HydrophobicContact CZ2-CE1 4.45Å; W227-F627 AromaticContact CZ3-CD1 3.89Å; W227-F627 HydrophobicContact CZ3-CD1 3.89Å; W227-F627 AromaticContact CZ3-CE1 3.88Å; W227-F627 HydrophobicContact CZ3-CE1 3.88Å; L233-F627 HydrophobicContact CD2-CE1 4.28Å; L233-F627 HydrophobicContact CD2-CZ 3.85Å; W244-F627 HydrophobicContact CE3-CE1 4.11Å; W244-F627 AromaticContact CE3-CZ 3.82Å; W244-F627 HydrophobicContact CE3-CZ 3.82Å; W244-F627 HydrophobicContact CH2-CE1 4.06Å; W244-F627 HydrophobicContact CH2-CZ 4.1Å; W244-F627 HydrophobicContact CZ3-CD1 4.39Å; W244-F627 AromaticContact CZ3-CE1 3.4Å; W244-F627 HydrophobicContact CZ3-CE1 3.4Å; W244-F627 VanDerWaalsContact CZ3-CE1 3.4Å; W244-F627 AromaticContact CZ3-CZ 3.48Å; W244-F627 HydrophobicContact CZ3-CZ 3.48Å; W244-F627 VanDerWaalsContact CZ3-CZ 3.48Å; I616-F627 CarbonylContact O-C 3.58Å; I616-F627 WeakPolarHBondContact O-CA 3.4Å; V617-F627 HydrophobicContact CB-CD1 3.85Å; V617-F627 HydrophobicContact CB-CE1 3.76Å; V617-F627 HydrophobicContact CB-CG 4.42Å; V617-F627 HydrophobicContact CB-CZ 4.25Å; V617-F627 HydrophobicContact CG2-CD1 3.98Å; V617-F627 HydrophobicContact CG2-CD2 4.17Å; V617-F627 HydrophobicContact CG2-CE1 3.69Å; V617-F627 HydrophobicContact CG2-CE2 3.88Å; V617-F627 HydrophobicContact CG2-CG 4.22Å; V617-F627 HydrophobicContact CG2-CZ 3.65Å; L625-F627 HydrophobicContact CB-CE2 4.37Å
628	W	97.4	Very high	86.5	Confident	3 Å²	3	57.7 Å²	57.7	1%	0.011	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.8	-172.5	-47.1	83.9	0	0	0	110.2	P207 I583 L597 N615 I616 T618 R626 I630	P207-W628 HydrophobicContact CB-CD2 4.04Å; P207-W628 HydrophobicContact CB-CE3 4.07Å; P207-W628 HydrophobicContact CB-CH2 4.33Å; P207-W628 HydrophobicContact CB-CZ2 4.27Å; P207-W628 HydrophobicContact CB-CZ3 4.22Å; P207-W628 HydrophobicContact CG-CH2 4.21Å; P207-W628 HydrophobicContact CG-CZ2 4.42Å; P207-W628 HydrophobicContact CG-CZ3 4.34Å; I583-W628 HydrophobicContact CD1-CD2 4.16Å; I583-W628 VanDerWaalsContact CD1-CE2 3.49Å; I583-W628 HydrophobicContact CD1-CG 4.44Å; I583-W628 HydrophobicContact CD1-CZ2 3.75Å; L597-W628 HydrophobicContact CB-CE3 4.33Å; L597-W628 HydrophobicContact CB-CH2 4.35Å; L597-W628 HydrophobicContact CB-CZ3 4.03Å; L597-W628 HydrophobicContact CD1-CD2 4.15Å; L597-W628 HydrophobicContact CD1-CE3 3.88Å; L597-W628 HydrophobicContact CD1-CG 4.46Å; L597-W628 HydrophobicContact CD1-CZ3 4.42Å; L597-W628 HydrophobicContact CD2-CE3 4.43Å; L597-W628 HydrophobicContact CD2-CZ3 4.48Å; L597-W628 HydrophobicContact CG-CE3 4.46Å; N615-W628 CarbonylContact C-O 3.6Å; N615-W628 VanDerWaalsContact CA-O 3.28Å; N615-W628 WeakPolarHBondContact CA-O 3.36Å; I616-W628 HydrophobicContact CD1-CB 4.48Å; I616-W628 HydrophobicContact CG1-CB 3.86Å; I616-W628 HydrophobicContact CG1-CG 4.25Å; I616-W628 PolarHBondContact N-O 3.45Å; I616-W628 PolarHBondContact O-N 2.95Å; T618-W628 PolarHBondContact OG1-NE1 2.93Å; R626-W628 HydrophobicContact CB-CZ2 3.96Å; R626-W628 PolarHBondContact O-NE1 3.43Å; W628-I630 HydrophobicContact CB-CD1 4.04Å; W628-I630 HydrophobicContact CB-CG1 3.88Å
629	N	94.5	Very high	84.9	Confident	66 Å²	66	63.3 Å²	63.3	35%	0.353	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	111.4	168.4	-175.8	-49.1	0	0	0	107.8	Y208 N615	Y208-N629 HydrophobicContact CD1-CB 4.23Å; Y208-N629 HydrophobicContact CE1-CB 4.46Å; N615-N629 WeakPolarHBondContact OD1-CB 3.46Å
630	I	92.4	Very high	83.4	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	38%	0.375	C	S	.	.			trans	-121.5	-45.8	-172.2	-63	-172.1	0	0	0	111.2	I203 V573 V585 L597 E614 I616 W628	I203-I630 HydrophobicContact CD1-CG2 4.45Å; I203-I630 HydrophobicContact CG2-CG1 4.42Å; V573-I630 HydrophobicContact CG2-CD1 4.02Å; V573-I630 HydrophobicContact CG2-CG2 4.08Å; V585-I630 HydrophobicContact CG1-CG2 3.98Å; V585-I630 HydrophobicContact CG2-CD1 4.31Å; V585-I630 HydrophobicContact CG2-CG2 3.77Å; L597-I630 HydrophobicContact CD1-CD1 3.63Å; L597-I630 HydrophobicContact CD1-CG1 4.18Å; E614-I630 PolarHBondContact O-N 3.37Å; I616-I630 HydrophobicContact CD1-CD1 3.39Å; I616-I630 HydrophobicContact CG1-CD1 3.63Å; I616-I630 HydrophobicContact CG1-CG1 4.3Å; W628-I630 HydrophobicContact CB-CD1 4.04Å; W628-I630 HydrophobicContact CB-CG1 3.88Å
631	F	89.5	Confident	82.1	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	41%	0.405	C	S	.	.			trans	-100.8	140.3	-177.6	-52.7	-58	0	0	0	109.2	S566 E571 V573 G613 E614 I616	S566-F631 VanDerWaalsContact CB-CE1 3.46Å; S566-F631 WeakPolarHBondContact OG-CD1 3.46Å; S566-F631 VanDerWaalsContact OG-CG 3.27Å; S566-F631 WeakPolarHBondContact OG-CG 3.49Å; E571-F631 HydrophobicContact CB-CE1 4.19Å; V573-F631 HydrophobicContact CG2-CE1 4.24Å; V573-F631 HydrophobicContact CG2-CE2 4.31Å; V573-F631 HydrophobicContact CG2-CZ 3.63Å; G613-F631 WeakPolarHBondContact O-CB 3.43Å; G613-F631 VanDerWaalsContact O-CD2 3.3Å; G613-F631 WeakPolarHBondContact O-CD2 3.44Å; E614-F631 CarbonylContact C-O 3.52Å; E614-F631 VanDerWaalsContact CA-O 3.26Å; E614-F631 WeakPolarHBondContact CA-O 3.44Å; E614-F631 WeakPolarHBondContact CB-O 3.35Å; E614-F631 PolarHBondContact O-N 3.12Å; E614-F631 VanDerWaalsContact O-O 3.13Å; I616-F631 HydrophobicContact CG2-CE2 4.36Å
632	T	81.6	Confident	81	Confident	61 Å²	61	78.7 Å²	78.7	37%	0.374	42%	0.419	S	S	.	.			trans	-121.5	129.2	175.1	58.2	0	0	0	0	107.5	R201 A634	R201-T632 WeakPolarHBondContact CD-OG1 3.25Å; R201-T632 HydrophobicContact CG-CG2 4.38Å; T632-A634 PolarHBondContact O-N 2.71Å
633	K	75.1	Confident	80.1	Confident	150 Å²	150	83.2 Å²	83.2	65%	0.652	45%	0.453	S	S	*	.			trans	-57.9	110.8	172.6	-173	173	-173.7	172.9	0	110.2	E614 K635	E614-K633 VanDerWaalsContact OE1-CB 3.23Å; E614-K633 WeakPolarHBondContact OE1-CB 3.21Å; E614-K633 PolarHBondContact OE1-N 3.46Å; K633-K635 PolarHBondContact O-N 3.31Å
634	A	68	Low	79.4	Confident	69 Å²	69	86.6 Å²	86.6	57%	0.57	47%	0.473	S	S	*	.			trans	-63.2	133.6	174.4	0	0	0	0	0	109	T632 T636	T632-A634 PolarHBondContact O-N 2.71Å; A634-T636 PolarHBondContact O-N 3.28Å
635	K	64.1	Low	78.6	Confident	208 Å²	208	88.5 Å²	88.5	90%	0.904	48%	0.483	S	S	*	.			trans	-60.9	113.9	167.2	-68	-176.6	-179.4	179.8	0	106.8	K633	K633-K635 PolarHBondContact O-N 3.31Å
636	T	58	Low	77.9	Confident	127 Å²	127	94.8 Å²	94.8	78%	0.779	52%	0.516	S	S	*	.			trans	-57.2	130.3	-180	40.3	0	0	0	0	108.9	A634	A634-T636 PolarHBondContact O-N 3.28Å
637	P	58.8	Low	77.1	Confident	104 Å²	104	100.4 Å²	100.4	68%	0.675	54%	0.542	S	S	*	.			trans	-59.3	150.1	168.1	27.3	-33.2	0	0	0	108.2	V639	P637-V639 HydrophobicContact CG-CG2 4.34Å; P637-V639 PolarHBondContact O-N 2.96Å
638	K	59	Low	76.2	Confident	215 Å²	215	103.5 Å²	103.5	94%	0.935	56%	0.558	S	S	*	*			trans	-66.8	85.1	170.8	-70.5	-176.9	177.2	-178.2	0	108.7
639	V	64.9	Low	74.9	Confident	118 Å²	118	106.6 Å²	106.6	72%	0.715	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-64.7	133.8	171.4	-174.2	0	0	0	0	107.2	P637	P637-V639 HydrophobicContact CG-CG2 4.34Å; P637-V639 PolarHBondContact O-N 2.96Å
640	Q	66.4	Low	74.2	Confident	174 Å²	174	109.1 Å²	109.1	81%	0.813	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-60.4	131.3	172.4	-73.1	-178.7	-14.7	0	0	108.7	S642	Q640-S642 PolarHBondContact O-N 3.05Å
641	P	70.6	Confident	72.9	Confident	99 Å²	99	123 Å²	123	64%	0.643	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-57.8	124.5	179.3	22.2	-31.7	0	0	0	109.7	S643 N648	P641-S643 PolarHBondContact O-N 2.86Å; P641-N648 WeakPolarHBondContact CA-ND2 3.4Å; P641-N648 HydrophobicContact CB-CB 3.94Å; P641-N648 VanDerWaalsContact CB-CG 3.48Å; P641-N648 VanDerWaalsContact CB-ND2 3.28Å; P641-N648 WeakPolarHBondContact CB-ND2 3.47Å
642	S	73.9	Confident	72.1	Confident	67 Å²	67	129.2 Å²	129.2	47%	0.469	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-65.1	131.7	176.6	50.1	0	0	0	0	110.4	Q640 L644 N645 N648	Q640-S642 PolarHBondContact O-N 3.05Å; S642-L644 PolarHBondContact O-N 3.06Å; S642-N645 PolarHBondContact O-N 2.91Å; S642-N645 VanDerWaalsContact O-N 3.15Å; S642-N645 VanDerWaalsContact OG-CB 3.29Å; S642-N645 WeakPolarHBondContact OG-CB 3.43Å; S642-N648 PolarHBondContact N-ND2 3.1Å; S642-N648 VanDerWaalsContact N-ND2 3.2Å; S642-N648 PolarHBondContact O-ND2 2.98Å
643	S	78.1	Confident	71.6	Confident	122 Å²	122	132.8 Å²	132.8	85%	0.853	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-23.4	177.7	50.8	0	0	0	0	113.6	P641	P641-S643 PolarHBondContact O-N 2.86Å
644	L	83.1	Confident	71.4	Confident	168 Å²	168	131.8 Å²	131.8	88%	0.88	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-11.5	177.2	-60.9	179	0	0	0	113.8	S642 L646	S642-L644 PolarHBondContact O-N 3.06Å; L644-L646 PolarHBondContact O-N 2.76Å
645	N	81.5	Confident	71.6	Confident	61 Å²	61	135.5 Å²	135.5	33%	0.326	72%	0.716	S	S	.	*			trans	-85.2	106.4	176.1	176.3	-5	0	0	0	108.9	S642 F647 N648	S642-N645 PolarHBondContact O-N 2.91Å; S642-N645 VanDerWaalsContact O-N 3.15Å; S642-N645 VanDerWaalsContact OG-CB 3.29Å; S642-N645 WeakPolarHBondContact OG-CB 3.43Å; N645-F647 PolarHBondContact O-N 3.15Å; N645-F647 WeakPolarHBondContact OD1-CB 3.36Å; N645-F647 VanDerWaalsContact OD1-CD2 3.26Å; N645-F647 WeakPolarHBondContact OD1-CD2 3.34Å; N645-F647 PolarHBondContact OD1-N 3.05Å; N645-F647 VanDerWaalsContact OD1-N 3.1Å; N645-N648 WeakPolarHBondContact CB-ND2 3.37Å; N645-N648 WeakPolarHBondContact O-CB 3.36Å; N645-N648 PolarHBondContact O-N 2.87Å
646	L	82.7	Confident	72	Confident	137 Å²	137	131 Å²	131	72%	0.717	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-49.6	-35.6	-178	-172.7	65.6	0	0	0	113.2	L644 N648 G649 I650	L644-L646 PolarHBondContact O-N 2.76Å; L646-N648 VanDerWaalsContact C-N 3.27Å; L646-N648 PolarHBondContact O-N 2.88Å; L646-G649 PolarHBondContact O-N 2.85Å; L646-I650 HydrophobicContact CG-CD1 4.32Å
647	F	82.1	Confident	73	Confident	159 Å²	159	131.3 Å²	131.3	70%	0.697	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-67	-25.5	179.4	-56.7	-63.3	0	0	0	113.7	N645 G649 I650	N645-F647 PolarHBondContact O-N 3.15Å; N645-F647 WeakPolarHBondContact OD1-CB 3.36Å; N645-F647 VanDerWaalsContact OD1-CD2 3.26Å; N645-F647 WeakPolarHBondContact OD1-CD2 3.34Å; N645-F647 PolarHBondContact OD1-N 3.05Å; N645-F647 VanDerWaalsContact OD1-N 3.1Å; F647-G649 VanDerWaalsContact C-N 3.29Å; F647-G649 PolarHBondContact O-N 3.4Å; F647-I650 HydrophobicContact CD1-CD1 4.46Å
648	N	79.4	Confident	74	Confident	65 Å²	65	133.2 Å²	133.2	35%	0.348	70%	0.701	S	S	.	*	G	3₁₀ helix	trans	-74.5	-19.3	177.1	-66.6	-23.2	0	0	0	112.8	P641 S642 N645 L646	P641-N648 WeakPolarHBondContact CA-ND2 3.4Å; P641-N648 HydrophobicContact CB-CB 3.94Å; P641-N648 VanDerWaalsContact CB-CG 3.48Å; P641-N648 VanDerWaalsContact CB-ND2 3.28Å; P641-N648 WeakPolarHBondContact CB-ND2 3.47Å; S642-N648 PolarHBondContact N-ND2 3.1Å; S642-N648 VanDerWaalsContact N-ND2 3.2Å; S642-N648 PolarHBondContact O-ND2 2.98Å; N645-N648 WeakPolarHBondContact CB-ND2 3.37Å; N645-N648 WeakPolarHBondContact O-CB 3.36Å; N645-N648 PolarHBondContact O-N 2.87Å; L646-N648 VanDerWaalsContact C-N 3.27Å; L646-N648 PolarHBondContact O-N 2.88Å
649	G	70.3	Confident	75.1	Confident	67 Å²	67	126.9 Å²	126.9	69%	0.691	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-97.3	4.8	178.3	0	0	0	0	0	114.7	L646 F647	L646-G649 PolarHBondContact O-N 2.85Å; F647-G649 VanDerWaalsContact C-N 3.29Å; F647-G649 PolarHBondContact O-N 3.4Å
650	I	78.8	Confident	76	Confident	120 Å²	120	127.7 Å²	127.7	62%	0.615	68%	0.68	S	S	*	*			trans	-95.4	3.7	179.3	-68	164.7	0	0	0	111.3	L646 F647	L646-I650 HydrophobicContact CG-CD1 4.32Å; F647-I650 HydrophobicContact CD1-CD1 4.46Å
651	R	65.1	Low	76.9	Confident	293 Å²	293	123.5 Å²	123.5	100%	1.106	67%	0.668	S	S	*	*			trans	-134.6	0	172.7	-73.8	-173.2	175.3	-168.6	-1.4	110.7

Retrieved 651 of 651 residues in 223.9 ms (Link to these results)

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