A0A3Q0KNN4_SCHMA Loading...

Notch

AlphaFold DB , UniProt , Accession A0A3Q0KNN4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,238 aa.

						>A0A3Q0KNN4_SCHMA|A0A3Q0KNN4
MMDLIYMNVHRKLFDSYSIIFSLLFIIHIHLSLINCNKFHYTNWNEYVNPYNQDHNKNIHFIRNYYYNQRHNRNVLPSYNVHRNNEQTQFPPPPHNNQHSSYRNSPPYRNPHLQQSNTYRFQRRRVPYSRNIESVNPYHSYSSRKYSHEWWKKHSPSGNYPNRYIDYGRKNQTLADREVNDYVSIYSSDSPIEYGNAKPENYFESVLTLSHPNDRVWNEKEQYWGYVPNSYSTQQGTEISTYLWSQSARQFDECIPPFCIPAQCDYYTDGRPICTQNLPCLGSTPCYQNDPSCRQANYGVNCNVMNSTVCKQMWNLQCSFGCVKNGSKPSDVLCVCNPWTLQNNESSCVSVDLDIFKCPLGCNGRGHCDPKTGKCFCYPGFKGHSCELEDNCPSGLTGPNCEYDVDECLSSRSGCEQRCVNIYGSFRCECENGYVVVPDDPKRCKPSECLTKCHSGNGKCDTTGKCHCLPGYVGEWCNLDIDECRLGIHNCEQVCINTPGSYQCECHSGYKLNLTDRKSCHEVTCNPRCTINQGFCSDDGICTCRPGFTGPDCGEDIDECKKGTHNCSQKCINTYGSFKCECFEGYETQSGNGVNCKSKCSERCMSNKGKCDATGKCICRRGFTGLNCSEDINECELKPKPCVQGCVNTYGSYYCTCDKGYHQDYRGHCLPNKCSPECVHGQGECTSNGKCMCNPGFRGLSCETDVDECAEGKHNCQQECINTPGSFKCSCHSGYKLSTVDPSKCEPISCPSQCNLIDGECDCECKLGHFGLNCNQTVDSCAIKPCDQICVDLGDGKYTCKCNEGFEPSPNNPRRCQRICKDGIDCIYGSCRTVFSNDTDQSLCTCLEGFYGTNCQNDVNECLNENGQKHFCEHHCINTLGSYQCFCDPDYELQSDGRTCKKQFKGEMKCPEYCLNGATCKSTGECVCQPGYEGIYCEKIKDICAILKLCDQQCFPKEDGTYHCGCDPEYELQADGHSCELKSSCNLKCQNNGKCFNGKCICTSNFEGDYCEKDKNECDQSVFEHSCIHGCINTYGSYECICPDGYRRLADKRTCVKEDNVSCNPPCENGGICRPGNLCECTRGYEGIQCELDINECVRHRPCDPDYGICENTPGSFTCQCVPGYQLMYDGQHCIDNERAKSHPNLIFRGRGTKGVSIATRLTNTTNFNQTKYYPRKLNKRSLQPIIKYSLKSTNLIDLHRNNHFHYKNQQPALSSRYHYKKLSLKGDPDVIITPRNV
					

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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	36	Very low	34	Very low	227 Å²	227	153.1 Å²	153.1	100%	1.118	73%	0.731	S	S	*	*				0	96.9	0	-179.3	-171.2	-67.8	0	0	104
2	M	40.8	Very low	33.8	Very low	158 Å²	158	152.9 Å²	152.9	78%	0.778	73%	0.725	S	S	*	*			trans	63.6	124.8	-134.1	-44	-55.5	172.8	0	0	109.7
3	D	33.8	Very low	33.5	Very low	135 Å²	135	149.4 Å²	149.4	72%	0.722	71%	0.712	S	S	*	*			cis	73.3	141	27.3	-50.8	-70.8	0	0	0	112.2
4	L	31.9	Very low	33.8	Very low	140 Å²	140	149.5 Å²	149.5	73%	0.733	71%	0.709	S	S	*	*			cis	175.1	-175	-20.8	-137	164.9	0	0	0	102.9
5	I	37.7	Very low	33.9	Very low	101 Å²	101	146.2 Å²	146.2	52%	0.518	70%	0.697	S	S	.	*			trans	63.2	91.6	166.2	-56.5	149.8	0	0	0	112.9
6	Y	31.1	Very low	34.4	Very low	212 Å²	212	142.4 Å²	142.4	83%	0.831	69%	0.691	S	S	*	*			cis	62.6	155	48.4	-144.2	-93.9	0	0	0	113.7	N8	Y6-N8 PolarHBondContact O-N 2.94Å
7	M	35.6	Very low	34.7	Very low	156 Å²	156	146.4 Å²	146.4	77%	0.768	70%	0.699	S	S	*	*			trans	-54.9	126.8	-169.4	-63.3	-174.6	173.4	0	0	114.1
8	N	26.4	Very low	34.5	Very low	102 Å²	102	144.2 Å²	144.2	55%	0.545	70%	0.702	S	S	.	*			trans	-152.2	99.5	135.1	-111.7	-8.4	0	0	0	113.7	Y6 F14	Y6-N8 PolarHBondContact O-N 2.94Å; N8-F14 PolarHBondContact ND2-O 3.34Å
9	V	35.3	Very low	34.5	Very low	86 Å²	86	143.2 Å²	143.2	52%	0.521	70%	0.699	S	S	.	*				45.8	113.5	121.3	-176.6	0	0	0	0	116.4	K12 L13	V9-K12 CarbonylContact O-C 3.19Å; V9-K12 PolarHBondContact O-N 3.06Å; V9-L13 PolarHBondContact O-N 3.21Å
10	H	36.4	Very low	34.6	Very low	144 Å²	144	143.7 Å²	143.7	67%	0.667	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn		-102.1	124.4	127.7	-131.3	-110.4	0	0	0	108.1	L13	H10-L13 WeakPolarHBondContact NE2-CD1 3.44Å; H10-L13 WeakPolarHBondContact NE2-CG 3.4Å
11	R	29.2	Very low	34.6	Very low	223 Å²	223	145.4 Å²	145.4	84%	0.842	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	cis	-105.6	67	34.7	-66.7	-176.5	161.4	-162.8	-7.1	118.4
12	K	30.8	Very low	34.5	Very low	151 Å²	151	138.8 Å²	138.8	66%	0.657	68%	0.683	S	S	*	*			trans	165.8	113.6	131.8	-86.1	149.9	-167.6	-178.8	0	108.5	V9	V9-K12 CarbonylContact O-C 3.19Å; V9-K12 PolarHBondContact O-N 3.06Å
13	L	31	Very low	34.6	Very low	107 Å²	107	138.5 Å²	138.5	56%	0.56	68%	0.684	S	S	*	*				63.3	121.5	88.2	-88.2	162.7	0	0	0	112.6	V9 H10	V9-L13 PolarHBondContact O-N 3.21Å; H10-L13 WeakPolarHBondContact NE2-CD1 3.44Å; H10-L13 WeakPolarHBondContact NE2-CG 3.4Å
14	F	37	Very low	34.9	Very low	151 Å²	151	138 Å²	138	66%	0.662	68%	0.681	S	S	*	*			trans	69.6	127.8	173	-71.3	-108.6	0	0	0	113.5	N8	N8-F14 PolarHBondContact ND2-O 3.34Å
15	D	35.9	Very low	35.1	Very low	100 Å²	100	139.6 Å²	139.6	54%	0.535	68%	0.682	S	S	.	*				82.8	151.2	61.8	-87.4	-51.2	0	0	0	115.3
16	S	40.8	Very low	35.2	Very low	86 Å²	86	141.3 Å²	141.3	60%	0.601	69%	0.691	S	S	*	*			trans	78.9	117.7	155.8	55.9	0	0	0	0	122.8
17	Y	40.3	Very low	35.7	Very low	209 Å²	209	137.3 Å²	137.3	82%	0.82	68%	0.682	S	S	*	*			trans	69.8	127.9	145.7	-66.8	-138.2	0	0	0	116.6
18	S	31.5	Very low	35.9	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	68%	0.68	S	S	*	*			cis	79.6	149.4	45.8	-164.6	0	0	0	0	114.2
19	I	34.6	Very low	36.5	Very low	126 Å²	126	139 Å²	139	65%	0.646	69%	0.688	S	S	*	*			trans	86.5	133.1	171	-51.4	168.9	0	0	0	116.9
20	I	36.9	Very low	36.7	Very low	152 Å²	152	141.5 Å²	141.5	78%	0.779	69%	0.693	S	S	*	*			trans	69.2	146.4	159.9	-82.4	166.9	0	0	0	117.9
21	F	32.8	Very low	36.8	Very low	181 Å²	181	141.6 Å²	141.6	79%	0.794	70%	0.698	S	S	*	*			cis	-169.3	163.3	-30.9	-142.8	-130.8	0	0	0	107.8
22	S	35.6	Very low	37.1	Very low	88 Å²	88	135 Å²	135	62%	0.615	69%	0.686	S	S	*	*			trans	14.4	138	155.5	-57	0	0	0	0	121.7
23	L	42.8	Very low	37.2	Very low	151 Å²	151	135.5 Å²	135.5	79%	0.791	70%	0.695	S	S	*	*				-168.2	106.9	111.2	-97.6	163	0	0	0	111.5
24	L	40.1	Very low	37.5	Very low	126 Å²	126	137.7 Å²	137.7	66%	0.66	71%	0.706	S	S	*	*			trans	39.8	123	140.5	-53.8	175	0	0	0	118.6
25	F	36	Very low	37.3	Very low	172 Å²	172	137.5 Å²	137.5	75%	0.754	71%	0.712	S	S	*	*			cis	-142.9	-178.2	20.2	-58.1	-96.6	0	0	0	109.7
26	I	40	Very low	37	Very low	138 Å²	138	137.8 Å²	137.8	71%	0.708	72%	0.721	S	S	*	*			cis	-150.2	141.5	9.9	-149.1	145.2	0	0	0	111.9
27	I	40.6	Very low	36.6	Very low	128 Å²	128	140.4 Å²	140.4	66%	0.656	73%	0.728	S	S	*	*			trans	11.8	129.7	136.8	-61	164.4	0	0	0	116.4
28	H	39	Very low	36.2	Very low	156 Å²	156	138.8 Å²	138.8	72%	0.722	73%	0.725	S	S	*	*			cis	-176.1	167.4	-4.6	-100.8	-15.9	0	0	0	107.3
29	I	40.8	Very low	36.3	Very low	138 Å²	138	141.8 Å²	141.8	71%	0.708	73%	0.725	S	S	*	*			cis	-148.7	171.3	3.5	-133.9	164.3	0	0	0	113.7
30	H	39.4	Very low	36.1	Very low	137 Å²	137	143.3 Å²	143.3	63%	0.634	73%	0.729	S	S	*	*			trans	-38.3	144.9	166.1	-78.7	-119.3	0	0	0	118.3
31	L	36.9	Very low	35.9	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	73%	0.726	S	S	*	*				70.7	146.4	68.8	-70.7	156	0	0	0	112.8
32	S	37.4	Very low	35.9	Very low	84 Å²	84	141 Å²	141	59%	0.587	72%	0.718	S	S	*	*			cis	-168	167.8	35.1	-25.2	0	0	0	0	113.5
33	L	32.4	Very low	35.8	Very low	163 Å²	163	143.1 Å²	143.1	85%	0.853	72%	0.722	S	S	*	*			trans	70.3	151.7	144.2	-70.2	168.1	0	0	0	118.4
34	I	37.8	Very low	35.1	Very low	153 Å²	153	145.7 Å²	145.7	79%	0.785	72%	0.721	S	S	*	*			cis	-134.8	159.9	3.6	-60.6	-178.4	0	0	0	111.4
35	N	32.1	Very low	34.6	Very low	146 Å²	146	144.2 Å²	144.2	78%	0.781	71%	0.714	S	S	*	*			trans	-57.2	171.1	169.7	-71.1	-50.3	0	0	0	118.6
36	C	29.8	Very low	34.4	Very low	107 Å²	107	142.6 Å²	142.6	72%	0.723	71%	0.709	S	S	*	*			trans	96.1	109.5	139.5	-88	0	0	0	0	122.1
37	N	32.6	Very low	33.9	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	71%	0.713	S	S	*	*				58.1	105.3	124.8	-74.2	-36.2	0	0	0	122
38	K	31.6	Very low	33.4	Very low	175 Å²	175	144.8 Å²	144.8	76%	0.761	71%	0.714	S	S	*	*				74.8	143.2	113.4	-142.2	176.9	-174.2	176.4	0	119.7
39	F	32.5	Very low	33.3	Very low	170 Å²	170	144.8 Å²	144.8	75%	0.746	72%	0.719	S	S	*	*			trans	78.6	106.5	171	-77.5	-80.5	0	0	0	120.2
40	H	31.3	Very low	33.1	Very low	158 Å²	158	142 Å²	142	73%	0.731	71%	0.71	S	S	*	*				56.7	127.7	126.5	-101.9	-115.7	0	0	0	123.1
41	Y	32.6	Very low	32.7	Very low	184 Å²	184	145.1 Å²	145.1	72%	0.722	72%	0.718	S	S	*	*			trans	81.6	115.5	138.6	-104.2	-120.8	0	0	0	121.8
42	T	32.9	Very low	32.3	Very low	101 Å²	101	144.2 Å²	144.2	62%	0.62	71%	0.714	S	S	*	*			trans	67.9	120.6	138.2	49.3	0	0	0	0	121.8
43	N	32.7	Very low	32.1	Very low	132 Å²	132	148.8 Å²	148.8	71%	0.706	73%	0.726	S	S	*	*				106.2	119.2	124.7	-77.8	3.9	0	0	0	121
44	W	28.5	Very low	32	Very low	204 Å²	204	146.3 Å²	146.3	77%	0.773	71%	0.713	S	S	*	*			trans	82.4	103.5	133.2	-78.8	54.6	0	0	0	120
45	N	30.4	Very low	32	Very low	96 Å²	96	148.2 Å²	148.2	51%	0.513	72%	0.718	S	S	.	*				84.9	120.7	116.7	-79.3	33.5	0	0	0	121.9
46	E	30.7	Very low	31.8	Very low	137 Å²	137	146.8 Å²	146.8	64%	0.64	71%	0.711	S	S	*	*				93.2	117.4	122.9	-72.3	176.6	129	0	0	121.5
47	Y	29.9	Very low	32.1	Very low	200 Å²	200	151.6 Å²	151.6	78%	0.784	72%	0.72	S	S	*	*				108.8	126.8	123.7	-92	-140.8	0	0	0	121.1
48	V	30.9	Very low	32	Very low	112 Å²	112	150.9 Å²	150.9	68%	0.679	72%	0.716	S	S	*	*			trans	77.7	84.3	141.2	179.3	0	0	0	0	118.6	P50	V48-P50 HydrophobicContact CG1-CG 4.38Å
49	N	36.5	Very low	32.1	Very low	156 Å²	156	150.3 Å²	150.3	83%	0.834	72%	0.719	S	S	*	*			trans	-55.5	137.7	134.5	172	30.6	0	0	0	110.1
50	P	36.3	Very low	31.9	Very low	81 Å²	81	148.9 Å²	148.9	53%	0.526	72%	0.715	S	S	.	*				-159.1	177	116.5	42.7	-24	0	0	0	118	V48	V48-P50 HydrophobicContact CG1-CG 4.38Å
51	Y	31.6	Very low	31.9	Very low	201 Å²	201	150.6 Å²	150.6	79%	0.788	72%	0.72	S	S	*	*			trans	68.2	124.7	167	-76.5	-90.3	0	0	0	118.7
52	N	28.2	Very low	31.7	Very low	127 Å²	127	146 Å²	146	68%	0.679	71%	0.707	S	S	*	*			cis	87	105	23.4	-170.4	34.3	0	0	0	116.1
53	Q	33.3	Very low	31.5	Very low	181 Å²	181	151.4 Å²	151.4	85%	0.846	72%	0.716	S	S	*	*			trans	-170.6	119.5	144.2	-102	163.8	12.3	0	0	107.2
54	D	30.1	Very low	31.2	Very low	110 Å²	110	151.5 Å²	151.5	59%	0.588	72%	0.717	S	S	*	*				88.6	113.8	61.9	-164.1	-1.3	0	0	0	112.6	N56	D54-N56 PolarHBondContact OD1-ND2 3.43Å
55	H	37.6	Very low	31.3	Very low	193 Å²	193	152.1 Å²	152.1	89%	0.894	72%	0.721	S	S	*	*			trans	-158.1	88.5	150.4	-115.2	-54.3	0	0	0	112.5
56	N	28.4	Very low	31.2	Very low	116 Å²	116	156.5 Å²	156.5	62%	0.62	73%	0.731	S	S	*	*			trans	-58.1	148.8	168	-88.2	-86	0	0	0	114	D54	D54-N56 PolarHBondContact OD1-ND2 3.43Å
57	K	36.4	Very low	31.1	Very low	209 Å²	209	159.1 Å²	159.1	91%	0.909	74%	0.737	S	S	*	*			trans	-160.6	128.2	135.5	-112.3	159.4	-170.9	174	0	115
58	N	29.1	Very low	30.9	Very low	126 Å²	126	155.1 Å²	155.1	67%	0.674	73%	0.729	S	S	*	*			trans	-74.2	161	-174.7	-57.3	-62.7	0	0	0	115
59	I	34.1	Very low	30.7	Very low	163 Å²	163	155.7 Å²	155.7	84%	0.836	72%	0.724	S	S	*	*				176.7	115.3	128.8	-85.3	147.1	0	0	0	105.9
60	H	27.9	Very low	30.1	Very low	140 Å²	140	158.4 Å²	158.4	65%	0.648	72%	0.723	S	S	*	*			cis	93.5	74.1	15.5	-156	-61.4	0	0	0	117.2
61	F	31.6	Very low	29.8	Very low	193 Å²	193	161.9 Å²	161.9	85%	0.846	73%	0.731	S	S	*	*			trans	-161.6	157.5	155.4	-98.9	-85.2	0	0	0	110.1
62	I	27.8	Very low	29.5	Very low	88 Å²	88	157.8 Å²	157.8	45%	0.451	72%	0.723	S	S	.	*				-178.1	141	-54.9	-103.2	166.2	0	0	0	108.9
63	R	28.8	Very low	29.5	Very low	214 Å²	214	161 Å²	161	81%	0.808	73%	0.726	S	S	*	*			trans	65.1	140.5	168.6	-72.8	161.8	-176.1	136.5	1.7	116.9
64	N	27.5	Very low	29.1	Very low	134 Å²	134	159 Å²	159	72%	0.717	72%	0.721	S	S	*	*			cis	70.9	104.7	48.1	-81.4	-1	0	0	0	115.6
65	Y	31	Very low	29.2	Very low	218 Å²	218	160.3 Å²	160.3	86%	0.855	73%	0.733	S	S	*	*			trans	-157.4	124.4	136.6	-98.4	-81.2	0	0	0	107.1
66	Y	26.8	Very low	29	Very low	187 Å²	187	158.1 Å²	158.1	73%	0.733	73%	0.727	S	S	*	*				68.8	97.2	58.1	-94.9	-79.3	0	0	0	115.6
67	Y	29.6	Very low	29.3	Very low	193 Å²	193	157.9 Å²	157.9	76%	0.757	73%	0.732	S	S	*	*				162.7	133.7	123.9	-103.8	-104.4	0	0	0	108.7
68	N	25	Very low	28.9	Very low	115 Å²	115	151.8 Å²	151.8	62%	0.615	72%	0.715	S	S	*	*			cis	100.5	134.4	19	-165	18	0	0	0	114.1
69	Q	26.2	Very low	29.1	Very low	125 Å²	125	155.9 Å²	155.9	58%	0.584	72%	0.723	S	S	*	*			trans	74.8	126	175.7	-61.8	-172	60.5	0	0	115.9
70	R	25.3	Very low	28.9	Very low	213 Å²	213	153.8 Å²	153.8	80%	0.804	71%	0.713	S	S	*	*				85.4	147	55.5	-83.8	-174	172.1	178.3	-1.3	113.2
71	H	28.8	Very low	29	Very low	153 Å²	153	152.2 Å²	152.2	71%	0.708	71%	0.713	S	S	*	*			trans	87.3	150.6	169.4	-60.8	-67.3	0	0	0	117.4
72	N	26	Very low	29	Very low	116 Å²	116	148.9 Å²	148.9	62%	0.62	70%	0.7	S	S	*	*			cis	-174.7	157.6	-29.7	-160.3	3.2	0	0	0	108
73	R	27.5	Very low	29	Very low	195 Å²	195	153.8 Å²	153.8	74%	0.736	71%	0.713	S	S	*	*			trans	62.2	129	157.3	-76.7	169.8	179.9	-178.7	-1.4	120.2
74	N	26.7	Very low	29	Very low	137 Å²	137	148.5 Å²	148.5	73%	0.733	70%	0.701	S	S	*	*				54	133.6	125.2	-45.2	0.7	0	0	0	118.3
75	V	30.4	Very low	29	Very low	138 Å²	138	147.5 Å²	147.5	84%	0.836	70%	0.695	S	S	*	*				-164.5	142	71.3	149	0	0	0	0	111.5
76	L	33.6	Very low	28.9	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	68%	0.683	S	S	*	*			trans	-63.4	157.4	168.6	-88.8	164.1	0	0	0	111.8
77	P	34.6	Very low	28.9	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	68%	0.681	S	S	*	*				-154.7	165.8	57.2	41.4	-20	0	0	0	120
78	S	29.7	Very low	28.7	Very low	81 Å²	81	137.7 Å²	137.7	57%	0.566	68%	0.679	S	S	*	*			trans	16.8	139.2	135.2	-43.2	0	0	0	0	120.1
79	Y	32.4	Very low	28.9	Very low	212 Å²	212	139.1 Å²	139.1	83%	0.831	68%	0.682	S	S	*	*				-158.4	122.5	84.3	-110.2	-105.2	0	0	0	108.1
80	N	29.8	Very low	29	Very low	118 Å²	118	141.3 Å²	141.3	63%	0.631	69%	0.69	S	S	*	*				87.8	143.6	66.9	-113.4	-21.6	0	0	0	114.4
81	V	30.1	Very low	29.5	Very low	108 Å²	108	136.5 Å²	136.5	66%	0.655	69%	0.686	S	S	*	*			trans	73.9	129.9	147.9	166.6	0	0	0	0	116.4
82	H	30.5	Very low	30.1	Very low	122 Å²	122	134.5 Å²	134.5	57%	0.565	69%	0.687	S	S	*	*			cis	-153.9	157.6	1.3	-122.2	6.7	0	0	0	111.3
83	R	29.7	Very low	30.6	Very low	192 Å²	192	134.5 Å²	134.5	73%	0.725	69%	0.693	S	S	*	*				48	144.8	103	-68.7	-171.5	178.4	156.9	-15.2	116.2
84	N	28.1	Very low	31.2	Very low	103 Å²	103	129.9 Å²	129.9	55%	0.551	69%	0.689	S	S	*	*			cis	-154.9	173.8	10.6	-133.8	25.9	0	0	0	113.5
85	N	27.9	Very low	31.5	Very low	113 Å²	113	131 Å²	131	60%	0.604	69%	0.689	S	S	*	*			trans	-13.6	167.3	132.3	-48.4	-5	0	0	0	117.3
86	E	27.8	Very low	31.6	Very low	126 Å²	126	130 Å²	130	59%	0.589	68%	0.679	S	S	*	*			cis	-141.5	156.2	30.7	-113.4	94.3	-134.7	0	0	111.1
87	Q	27.5	Very low	31.5	Very low	150 Å²	150	128.7 Å²	128.7	70%	0.701	67%	0.673	S	S	*	*				41.8	128.2	95	-46	175	22.6	0	0	113.3
88	T	26.2	Very low	31.4	Very low	115 Å²	115	130.2 Å²	130.2	71%	0.706	67%	0.67	S	S	*	*				-161.1	138.5	55.1	31.8	0	0	0	0	110
89	Q	27.7	Very low	31.6	Very low	146 Å²	146	133.6 Å²	133.6	68%	0.682	68%	0.677	S	S	*	*				79.9	135.4	73.6	-76.5	-176.4	-11.7	0	0	118.1
90	F	28.1	Very low	31.6	Very low	170 Å²	170	127.9 Å²	127.9	75%	0.746	67%	0.668	S	S	*	*			trans	83.2	150.7	149.1	-69.3	-43.7	0	0	0	121.4
91	P	36.1	Very low	31.7	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	67%	0.665	S	S	*	*				-134.2	-125.3	-122.2	44.6	-22	0	0	0	117.7
92	P	40.8	Very low	31.6	Very low	111 Å²	111	130.4 Å²	130.4	72%	0.721	67%	0.671	S	S	*	*			trans	-96.2	-168.2	-152.9	47.7	-38.7	0	0	0	113.3
93	P	38.6	Very low	31.5	Very low	116 Å²	116	133.9 Å²	133.9	75%	0.753	68%	0.679	S	S	*	*			cis	-123.1	-127.2	-4.8	30.2	-3.8	0	0	0	109.7
94	P	39.4	Very low	31.5	Very low	98 Å²	98	130.8 Å²	130.8	64%	0.636	68%	0.676	S	S	*	*			cis	-138.6	-177.1	-25.9	37.8	-17.2	0	0	0	117.4
95	H	33.5	Very low	31.6	Very low	160 Å²	160	131.2 Å²	131.2	74%	0.741	69%	0.688	S	S	*	*			trans	80.3	128.1	144	-90	-62.2	0	0	0	125.1
96	N	31.4	Very low	32.3	Very low	116 Å²	116	131.4 Å²	131.4	62%	0.62	70%	0.695	S	S	*	*			trans	77.5	124.6	133.6	-77	5.6	0	0	0	124.6
97	N	30.9	Very low	32.9	Very low	121 Å²	121	130.4 Å²	130.4	65%	0.647	70%	0.7	S	S	*	*			trans	67.4	147.9	131.5	-63.7	0.1	0	0	0	119.6
98	Q	32.7	Very low	32.9	Very low	144 Å²	144	133.4 Å²	133.4	67%	0.673	71%	0.706	S	S	*	*			cis	-159.4	177.3	-5.7	-111.9	159.8	-65.4	0	0	105.2
99	H	33.7	Very low	33.2	Very low	152 Å²	152	139 Å²	139	70%	0.704	71%	0.714	S	S	*	*			cis	-165	151.2	7.3	-128.4	-73	0	0	0	104.4
100	S	32.9	Very low	33.5	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	72%	0.72	S	S	*	*			cis	-165.3	-150.4	-24.9	52	0	0	0	0	105.7
101	S	31.8	Very low	34	Very low	82 Å²	82	135.9 Å²	135.9	57%	0.573	72%	0.715	S	S	*	*			cis	-173.2	137.4	-1.2	20.7	0	0	0	0	110.4
102	Y	29.2	Very low	33.6	Very low	198 Å²	198	139.1 Å²	139.1	78%	0.776	72%	0.72	S	S	*	*			trans	64.1	146.6	149.1	-59.1	-44.5	0	0	0	121.1
103	R	27.6	Very low	33	Very low	194 Å²	194	141.2 Å²	141.2	73%	0.732	73%	0.725	S	S	*	*			cis	-170.3	151.9	-27.7	-128.8	-177.8	-171	171.3	1.7	111.8
104	N	29.6	Very low	32.4	Very low	127 Å²	127	142.8 Å²	142.8	68%	0.679	72%	0.722	S	S	*	*			trans	51.3	107.4	147.7	-63.6	0.6	0	0	0	123.8
105	S	30.7	Very low	31.8	Very low	113 Å²	113	145.7 Å²	145.7	79%	0.79	73%	0.727	S	S	*	*				55.3	174.9	109.8	-33.6	0	0	0	0	121.9
106	P	41.7	Very low	31.6	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	72%	0.721	S	S	*	*				-126.5	-152.7	-111.2	41.5	-18.8	0	0	0	112.1
107	P	41.2	Very low	31.5	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	73%	0.728	S	S	*	*			cis	-137.1	-169.2	-6.8	28.9	-2.7	0	0	0	116.3
108	Y	28	Very low	31.4	Very low	212 Å²	212	142.2 Å²	142.2	83%	0.831	72%	0.724	S	S	*	*			trans	98.2	131.9	156	-86.1	-71.1	0	0	0	123.5
109	R	32.4	Very low	31.1	Very low	232 Å²	232	145.2 Å²	145.2	88%	0.875	73%	0.731	S	S	*	*			trans	77.1	100.7	156.7	-66.9	-171.3	-178.7	-148.9	-1.4	122.2
110	N	32.4	Very low	30.9	Very low	151 Å²	151	148.9 Å²	148.9	81%	0.807	74%	0.739	S	S	*	*				-8.2	163.5	129.9	-90.7	9.1	0	0	0	120.1
111	P	38.7	Very low	30.5	Very low	100 Å²	100	152.6 Å²	152.6	65%	0.649	74%	0.744	S	S	*	*			cis	-142.7	159	-21.9	35.8	-16.4	0	0	0	117.4
112	H	28	Very low	30.4	Very low	181 Å²	181	157.9 Å²	157.9	84%	0.838	76%	0.759	S	S	*	*			trans	37.3	105.9	147.9	-71.9	-85	0	0	0	122.6
113	L	28.5	Very low	30.3	Very low	155 Å²	155	159.5 Å²	159.5	81%	0.812	76%	0.764	S	S	*	*			trans	-160.4	131.3	137.9	-118	160.6	0	0	0	111.7
114	Q	26.4	Very low	30.4	Very low	150 Å²	150	161.9 Å²	161.9	70%	0.701	77%	0.773	S	S	*	*			trans	46.3	143.6	151.7	-88.3	-179.3	25.2	0	0	125
115	Q	27.2	Very low	30.3	Very low	158 Å²	158	166.9 Å²	166.9	74%	0.738	78%	0.782	S	S	*	*			trans	80.9	128.8	141.7	-73.8	179.1	38.5	0	0	123.3
116	S	28.2	Very low	30.2	Very low	89 Å²	89	167.4 Å²	167.4	62%	0.622	78%	0.781	S	S	*	*			trans	54.8	132.9	138.2	66.3	0	0	0	0	122.7
117	N	29.4	Very low	29.9	Very low	143 Å²	143	166.8 Å²	166.8	77%	0.765	78%	0.777	S	S	*	*				172.1	152	118.7	-88.4	-26.6	0	0	0	112.3
118	T	29	Very low	29.2	Very low	92 Å²	92	172.3 Å²	172.3	56%	0.564	79%	0.785	S	S	*	*			cis	-178.2	139.6	-34.8	24	0	0	0	0	110
119	Y	26.6	Very low	29.2	Very low	208 Å²	208	166.8 Å²	166.8	82%	0.816	78%	0.778	S	S	*	*			trans	62.1	163.3	162.9	-57.5	-59.1	0	0	0	116.6
120	R	28.6	Very low	29.1	Very low	228 Å²	228	167.2 Å²	167.2	86%	0.86	78%	0.779	S	S	*	*			cis	-159.5	151.8	28.1	-159.2	174.8	-169	167	3.5	113.3
121	F	25.5	Very low	28.8	Very low	170 Å²	170	166.9 Å²	166.9	75%	0.746	78%	0.778	S	S	*	*			trans	-12.7	151.4	161.4	-62	-107.1	0	0	0	119.5
122	Q	30.4	Very low	28.2	Very low	193 Å²	193	169.3 Å²	169.3	90%	0.902	78%	0.783	S	S	*	*				-157.6	-176.4	60	-78.7	-170.4	2.6	0	0	115.7
123	R	26.7	Very low	28.1	Very low	232 Å²	232	168.6 Å²	168.6	88%	0.875	78%	0.781	S	S	*	*			trans	-116.7	149.2	-168.1	-58.5	172.8	171.7	177.7	-4.2	115.7
124	R	28.8	Very low	27.9	Very low	244 Å²	244	166 Å²	166	92%	0.921	78%	0.775	S	S	*	*			trans	179.4	151.2	148.6	-97.6	151	-159.7	-132.3	1.1	109.1
125	R	27.2	Very low	28	Very low	232 Å²	232	165.2 Å²	165.2	88%	0.875	78%	0.78	S	S	*	*			cis	71.5	125.2	8.3	-86.5	-167.1	-177.8	-154.7	0.6	116.7
126	V	29.9	Very low	28.2	Very low	124 Å²	124	164.5 Å²	164.5	75%	0.752	78%	0.782	S	S	*	*			cis	-148.5	-146.3	1.7	-137.2	0	0	0	0	107.9
127	P	34.6	Very low	28.4	Very low	104 Å²	104	164.4 Å²	164.4	68%	0.675	78%	0.779	S	S	*	*				-127.5	173.3	-57.6	38.7	-22.8	0	0	0	116.2
128	Y	26.2	Very low	28.2	Very low	221 Å²	221	166.8 Å²	166.8	87%	0.867	78%	0.778	S	S	*	*			trans	49	121.2	145.8	-92	-105.7	0	0	0	124.9
129	S	27.7	Very low	28.1	Very low	96 Å²	96	169.6 Å²	169.6	67%	0.671	79%	0.785	S	S	*	*				54	123.3	128	-169.1	0	0	0	0	123
130	R	30.4	Very low	28.1	Very low	241 Å²	241	163.6 Å²	163.6	91%	0.909	77%	0.773	S	S	*	*				-157.4	147.3	117.9	-108.5	177.9	-166.1	-159.5	2.3	112.2
131	N	26.3	Very low	27.9	Very low	144 Å²	144	162.4 Å²	162.4	77%	0.77	77%	0.77	S	S	*	*			trans	-74.9	156.3	170.5	-61.1	-16	0	0	0	111
132	I	27.5	Very low	28	Very low	150 Å²	150	159.4 Å²	159.4	77%	0.769	77%	0.77	S	S	*	*				-174.8	140.9	120.1	-95	157.6	0	0	0	110.4
133	E	25.2	Very low	27.7	Very low	167 Å²	167	154.3 Å²	154.3	78%	0.78	76%	0.756	S	S	*	*			trans	-11.4	155.5	155.3	-62.3	143.3	-147.7	0	0	119
134	S	24.8	Very low	27.8	Very low	100 Å²	100	154.2 Å²	154.2	70%	0.699	76%	0.756	S	S	*	*			cis	-174.9	-165.4	-9.8	53.6	0	0	0	0	109.3
135	V	28.5	Very low	27.6	Very low	133 Å²	133	151.5 Å²	151.5	81%	0.806	75%	0.75	S	S	*	*			trans	74.1	92.1	166.4	-174.5	0	0	0	0	117.1
136	N	30.5	Very low	27.7	Very low	144 Å²	144	151 Å²	151	77%	0.77	75%	0.75	S	S	*	*			trans	-45.5	147.9	144.6	-156.5	34.6	0	0	0	109.8
137	P	33.4	Very low	27.5	Very low	86 Å²	86	148.6 Å²	148.6	56%	0.558	74%	0.739	S	S	*	*			cis	-160.5	-171.9	49.9	46.2	-24.1	0	0	0	119.3
138	Y	24.6	Very low	27.1	Very low	194 Å²	194	151 Å²	151	76%	0.761	74%	0.741	S	S	*	*			trans	58	127	147.9	-81	-64	0	0	0	120.6
139	H	26.2	Very low	27.1	Very low	151 Å²	151	146.9 Å²	146.9	70%	0.699	73%	0.729	S	S	*	*			trans	39.9	129.4	130.6	-83.7	-127.8	0	0	0	118.4
140	S	26.8	Very low	27.1	Very low	82 Å²	82	150.9 Å²	150.9	57%	0.573	73%	0.73	S	S	*	*			cis	165.2	-171.5	24.3	44.7	0	0	0	0	109.7
141	Y	25.9	Very low	26.8	Very low	203 Å²	203	151.8 Å²	151.8	80%	0.796	73%	0.734	S	S	*	*			trans	60.8	98.7	155	-74.2	-63.2	0	0	0	120
142	S	25.7	Very low	26.8	Very low	106 Å²	106	151.7 Å²	151.7	74%	0.741	73%	0.726	S	S	*	*				78	175.6	123.7	93.4	0	0	0	0	116.7
143	S	25.5	Very low	26.8	Very low	87 Å²	87	153.7 Å²	153.7	61%	0.608	73%	0.729	S	S	*	*			cis	-155.8	153.1	-1.4	30.7	0	0	0	0	110
144	R	27.8	Very low	27	Very low	230 Å²	230	154.9 Å²	154.9	87%	0.868	73%	0.734	S	S	*	*			trans	164.6	123.3	135.8	-85.2	146.3	-158.7	-147.2	2.5	107.3
145	K	26.2	Very low	27.1	Very low	186 Å²	186	155.6 Å²	155.6	81%	0.809	74%	0.74	S	S	*	*				55.2	79.8	57.1	-71.7	-167.4	172.3	-177.6	0	113.5
146	Y	28	Very low	27.2	Very low	223 Å²	223	154.5 Å²	154.5	88%	0.875	74%	0.735	S	S	*	*				-117.4	128.9	112.8	-82.6	-99.5	0	0	0	106.2
147	S	25.5	Very low	27.1	Very low	73 Å²	73	153.6 Å²	153.6	51%	0.51	74%	0.74	S	S	.	*			cis	83.5	121.7	19.6	95.3	0	0	0	0	115.2
148	H	25.9	Very low	26.8	Very low	155 Å²	155	152.9 Å²	152.9	72%	0.718	75%	0.748	S	S	*	*			trans	82	141.8	165.3	-66.9	-134.8	0	0	0	116
149	E	27.6	Very low	27.2	Very low	133 Å²	133	150.7 Å²	150.7	62%	0.621	75%	0.75	S	S	*	*			cis	-155.8	163.5	-8	-126.3	166.3	156.3	0	0	115
150	W	27	Very low	27.5	Very low	180 Å²	180	153.9 Å²	153.9	68%	0.682	76%	0.757	S	S	*	*			trans	11.4	129.4	156.8	-69.4	2.9	0	0	0	122	K152	W150-K152 HydrophobicContact CB-CB 4.33Å; W150-K152 HydrophobicContact CD2-CD 3.9Å; W150-K152 HydrophobicContact CE3-CB 3.86Å; W150-K152 HydrophobicContact CE3-CD 3.31Å; W150-K152 HydrophobicContact CE3-CG 4.24Å; W150-K152 HydrophobicContact CH2-CD 4.07Å; W150-K152 HydrophobicContact CZ3-CD 3.41Å; W150-K152 VanDerWaalsContact CZ3-CD 3.41Å; W150-K152 PolarHBondContact O-N 3.34Å
151	W	24.7	Very low	28	Very low	261 Å²	261	154.5 Å²	154.5	99%	0.989	76%	0.759	S	S	*	*			trans	-61.6	107.8	133.1	-94.3	52.1	0	0	0	110.1
152	K	26	Very low	28.4	Very low	142 Å²	142	151.1 Å²	151.1	62%	0.617	76%	0.755	S	S	*	*			trans	-158.3	106.4	160.1	-118.2	162.5	-172.5	169.6	0	114.3	W150	W150-K152 HydrophobicContact CB-CB 4.33Å; W150-K152 HydrophobicContact CD2-CD 3.9Å; W150-K152 HydrophobicContact CE3-CB 3.86Å; W150-K152 HydrophobicContact CE3-CD 3.31Å; W150-K152 HydrophobicContact CE3-CG 4.24Å; W150-K152 HydrophobicContact CH2-CD 4.07Å; W150-K152 HydrophobicContact CZ3-CD 3.41Å; W150-K152 VanDerWaalsContact CZ3-CD 3.41Å; W150-K152 PolarHBondContact O-N 3.34Å
153	K	27.2	Very low	28.7	Very low	191 Å²	191	155 Å²	155	83%	0.83	75%	0.754	S	S	*	*			trans	53.7	123.7	155.2	-66.2	-171.3	171.3	-171.9	0	118.7
154	H	28.8	Very low	29	Very low	192 Å²	192	159.7 Å²	159.7	89%	0.889	76%	0.759	S	S	*	*			trans	-99.8	159.7	131.1	-83.7	20.6	0	0	0	110
155	S	26.5	Very low	29.2	Very low	116 Å²	116	153.8 Å²	153.8	81%	0.811	74%	0.743	S	S	*	*			trans	-76.5	173.4	-171.5	-66.2	0	0	0	0	113
156	P	31.5	Very low	29.4	Very low	109 Å²	109	150.7 Å²	150.7	71%	0.708	74%	0.736	S	S	*	*			cis	-138.8	168.3	13.6	41.5	-23.9	0	0	0	118.7
157	S	27.3	Very low	29.5	Very low	125 Å²	125	150.7 Å²	150.7	87%	0.874	74%	0.736	S	S	*	*			trans	64.6	160	155.6	66.7	0	0	0	0	119.4
158	G	28.4	Very low	29.9	Very low	71 Å²	71	150.7 Å²	150.7	73%	0.732	75%	0.747	S	S	*	*			trans	143	11.1	161.4	0	0	0	0	0	123
159	N	32	Very low	30.2	Very low	148 Å²	148	154.5 Å²	154.5	79%	0.791	76%	0.755	S	S	*	*			trans	45.6	119.4	158.6	-70	-8.9	0	0	0	124
160	Y	33	Very low	30.3	Very low	219 Å²	219	156.4 Å²	156.4	86%	0.859	76%	0.762	S	S	*	*			trans	81.3	155.8	135.2	-82.5	-106.3	0	0	0	122.8
161	P	38.3	Very low	30.4	Very low	95 Å²	95	153.5 Å²	153.5	62%	0.617	76%	0.759	S	S	*	*			trans	-135.7	-155.3	-155.4	45.8	-27.1	0	0	0	115.4
162	N	33.2	Very low	30.7	Very low	132 Å²	132	148.5 Å²	148.5	71%	0.706	75%	0.747	S	S	*	*			trans	96.3	148.7	172.8	-63.1	-59.4	0	0	0	115.1
163	R	33.1	Very low	30.8	Very low	188 Å²	188	147.3 Å²	147.3	71%	0.709	75%	0.752	S	S	*	*			cis	-167.4	149.5	4	-128.6	176	-170.6	-176.7	0.9	114.2
164	Y	31.2	Very low	30.9	Very low	184 Å²	184	146 Å²	146	72%	0.722	75%	0.753	S	S	*	*			trans	67.5	156.3	133.5	-87.8	-154.7	0	0	0	122.2
165	I	32	Very low	30.9	Very low	106 Å²	106	141.3 Å²	141.3	54%	0.544	75%	0.747	S	S	.	*			cis	-167.1	166.3	-18.7	-137.7	-166.8	0	0	0	113
166	D	31.1	Very low	31	Very low	121 Å²	121	142.7 Å²	142.7	65%	0.647	75%	0.746	S	S	*	*			trans	48.7	163.7	152.5	-70.2	13.5	0	0	0	123.7
167	Y	30.1	Very low	31.1	Very low	224 Å²	224	147.5 Å²	147.5	88%	0.878	75%	0.75	S	S	*	*			cis	166.5	140.3	-32.1	-117	-80.2	0	0	0	104.7
168	G	33	Very low	31.2	Very low	73 Å²	73	149.3 Å²	149.3	75%	0.753	74%	0.744	S	S	*	*			trans	-164.9	162.3	179.4	0	0	0	0	0	114.4
169	R	31.2	Very low	31.3	Very low	234 Å²	234	151.7 Å²	151.7	88%	0.883	74%	0.744	S	S	*	*			trans	-139.1	137.9	-168.5	-88	-178.8	170.7	175.1	-0.7	115.6
170	K	31.7	Very low	31.1	Very low	173 Å²	173	151 Å²	151	75%	0.752	74%	0.741	S	S	*	*			trans	68.4	130.5	138.3	-73.3	-170.5	172.3	-169.4	0	122.9
171	N	28.4	Very low	30.9	Very low	119 Å²	119	147.2 Å²	147.2	64%	0.636	74%	0.735	S	S	*	*			trans	80.7	117.6	132.3	-74.3	39.2	0	0	0	123.6
172	Q	30.8	Very low	30.4	Very low	157 Å²	157	153.4 Å²	153.4	73%	0.734	75%	0.748	S	S	*	*				93.3	128.2	127.5	-74.1	173.9	-77.1	0	0	123.6
173	T	28	Very low	30.2	Very low	116 Å²	116	153.6 Å²	153.6	71%	0.712	75%	0.753	S	S	*	*			trans	79.5	116	143.7	47	0	0	0	0	123.7
174	L	28.8	Very low	29.9	Very low	165 Å²	165	148.8 Å²	148.8	86%	0.864	75%	0.748	S	S	*	*			trans	48.2	113.1	146.6	-72.9	82.6	0	0	0	121.1
175	A	29.5	Very low	29.6	Very low	92 Å²	92	145.9 Å²	145.9	76%	0.76	74%	0.744	S	S	*	*				176.7	145.9	108.3	0	0	0	0	0	113.6
176	D	29.2	Very low	29.5	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	76%	0.756	S	S	*	*			trans	46.9	131.6	149.9	-59.4	-10.5	0	0	0	125.7
177	R	32	Very low	29.3	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	76%	0.764	S	S	*	*			trans	75.4	126	147.2	-74.2	-177.8	177.9	146.6	4.2	123.4
178	E	29.9	Very low	29.1	Very low	163 Å²	163	144.2 Å²	144.2	76%	0.762	76%	0.755	S	S	*	*				45.6	140.5	123.2	-59.7	167.8	147.9	0	0	120.9
179	V	30.1	Very low	28.9	Very low	121 Å²	121	147.9 Å²	147.9	73%	0.733	76%	0.757	S	S	*	*			cis	-167.8	161.3	-8.8	119.9	0	0	0	0	109.1
180	N	28.8	Very low	28.8	Very low	134 Å²	134	142.1 Å²	142.1	72%	0.717	75%	0.753	S	S	*	*			trans	73.3	118.6	168.8	-73.6	0.3	0	0	0	122.7
181	D	28.3	Very low	29	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	75%	0.753	S	S	*	*				66.1	158.8	129.3	-61.1	-13.3	0	0	0	126
182	Y	27.2	Very low	29	Very low	226 Å²	226	141.7 Å²	141.7	89%	0.886	76%	0.763	S	S	*	*			trans	70.8	67.2	173.4	-81.9	-86.3	0	0	0	119.8
183	V	29.4	Very low	28.8	Very low	135 Å²	135	141.6 Å²	141.6	82%	0.818	76%	0.763	S	S	*	*			trans	-139.8	124.2	164.3	177.9	0	0	0	0	108
184	S	27.1	Very low	28.7	Very low	87 Å²	87	146.4 Å²	146.4	61%	0.608	77%	0.77	S	S	*	*			cis	87.1	137.8	18.6	95.2	0	0	0	0	116.6
185	I	26.1	Very low	28.6	Very low	123 Å²	123	142.2 Å²	142.2	63%	0.631	77%	0.766	S	S	*	*			trans	50.8	118.2	167	-5.2	177.4	0	0	0	119.8
186	Y	28	Very low	28.5	Very low	202 Å²	202	145.8 Å²	145.8	79%	0.792	77%	0.772	S	S	*	*				167	144.1	103.9	-94.6	-66.8	0	0	0	113.7
187	S	27.1	Very low	28.5	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	78%	0.775	S	S	*	*			trans	-121.5	134.4	163.5	-53.8	0	0	0	0	109.2
188	S	27.5	Very low	28.4	Very low	97 Å²	97	143.4 Å²	143.4	68%	0.678	78%	0.78	S	S	*	*			trans	-165.9	133.5	158.5	41.9	0	0	0	0	112.6
189	D	27.7	Very low	28.4	Very low	149 Å²	149	141 Å²	141	80%	0.797	78%	0.778	S	S	*	*			trans	39.5	121.9	138.8	-39.7	-37.8	0	0	0	118.9
190	S	30	Very low	28.2	Very low	113 Å²	113	143.4 Å²	143.4	79%	0.79	78%	0.781	S	S	*	*				-168.4	161.5	61.5	-63.7	0	0	0	0	113.1
191	P	34.3	Very low	28	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	79%	0.788	S	S	*	*			trans	-99.3	171.7	-176.1	39.4	-36.2	0	0	0	114.5
192	I	28.4	Very low	27.9	Very low	168 Å²	168	148.8 Å²	148.8	86%	0.862	80%	0.795	S	S	*	*			trans	-169.9	144.1	130.9	-96.7	153	0	0	0	113.1
193	E	26.6	Very low	27.8	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	79%	0.793	S	S	*	*			trans	-52.2	155.2	-174.4	-74.3	-179.3	123	0	0	123.7
194	Y	27.6	Very low	27.6	Very low	218 Å²	218	150.4 Å²	150.4	86%	0.855	80%	0.799	S	S	*	*			trans	49.1	133.8	141.2	-75.7	-78.4	0	0	0	123.5
195	G	26.6	Very low	27.8	Very low	77 Å²	77	151.2 Å²	151.2	79%	0.794	80%	0.804	S	S	*	*			trans	178.1	99.6	163.1	0	0	0	0	0	115.9
196	N	26.8	Very low	27.8	Very low	166 Å²	166	150.5 Å²	150.5	89%	0.888	81%	0.806	S	S	*	*			trans	-62.1	128.1	-173.2	-63.4	-48.5	0	0	0	116.7
197	A	29.4	Very low	27.7	Very low	100 Å²	100	149.6 Å²	149.6	83%	0.826	81%	0.814	S	S	*	*			trans	-164	142	145	0	0	0	0	0	111.3
198	K	30.3	Very low	27.8	Very low	207 Å²	207	149.3 Å²	149.3	90%	0.9	81%	0.807	S	S	*	*			trans	-88.1	146.4	166.4	-68.5	-174.4	176	-175.6	0	109.3
199	P	28.5	Very low	27.9	Very low	111 Å²	111	152.6 Å²	152.6	72%	0.721	82%	0.816	S	S	*	*				-146.5	152.6	95.5	38.8	-23.3	0	0	0	116.8
200	E	25.7	Very low	28.2	Very low	173 Å²	173	148.2 Å²	148.2	81%	0.808	80%	0.797	S	S	*	*			trans	46.9	97.6	136.6	-62.2	169.5	177.9	0	0	121.8
201	N	26.2	Very low	28.6	Very low	160 Å²	160	149.5 Å²	149.5	86%	0.856	79%	0.791	S	S	*	*				40	78.8	128.4	-61.3	8.9	0	0	0	119.7
202	Y	25.1	Very low	28.8	Very low	224 Å²	224	148 Å²	148	88%	0.878	78%	0.781	S	S	*	*			trans	-142	145.5	147.9	-103.7	-92.9	0	0	0	109
203	F	26.4	Very low	29.5	Very low	196 Å²	196	146.8 Å²	146.8	86%	0.86	78%	0.776	S	S	*	*			trans	96	54.6	-175.1	-71.3	-78.4	0	0	0	119.4
204	E	25.2	Very low	30.4	Very low	199 Å²	199	141.5 Å²	141.5	93%	0.93	75%	0.752	S	S	*	*			trans	-130.3	116.3	140.9	-74.2	-164.6	150.2	0	0	109.4
205	S	29.8	Very low	31.2	Very low	104 Å²	104	137 Å²	137	73%	0.727	73%	0.734	S	S	*	*			trans	-149	92.8	173.6	52.6	0	0	0	0	113.8
206	V	27	Very low	32.1	Very low	109 Å²	109	135.6 Å²	135.6	66%	0.661	71%	0.71	S	S	*	*			trans	66.4	91.6	139.4	-170.9	0	0	0	0	117.5	T208	V206-T208 HydrophobicContact CG1-CG2 3.98Å; V206-T208 WeakPolarHBondContact CG1-OG1 3.37Å
207	L	26	Very low	33.1	Very low	183 Å²	183	135 Å²	135	96%	0.958	70%	0.695	S	S	*	*			trans	-110	72.6	134	-83.6	171.2	0	0	0	108.6	L209	L207-L209 PolarHBondContact O-N 2.91Å
208	T	29	Very low	34.2	Very low	112 Å²	112	132 Å²	132	69%	0.687	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-73.2	123.7	170.4	46.2	0	0	0	0	109.8	V206	V206-T208 HydrophobicContact CG1-CG2 3.98Å; V206-T208 WeakPolarHBondContact CG1-OG1 3.37Å
209	L	30.3	Very low	34.5	Very low	165 Å²	165	131.9 Å²	131.9	86%	0.864	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-57.5	156.7	168.9	-72.6	157	0	0	0	111.2	L207	L207-L209 PolarHBondContact O-N 2.91Å
210	S	33.8	Very low	35.1	Very low	58 Å²	58	134.4 Å²	134.4	41%	0.406	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-55.5	151.6	-167.8	39	0	0	0	0	114.6	D214 Y226	S210-D214 WeakPolarHBondContact CB-OD2 3.09Å; S210-Y226 WeakPolarHBondContact OG-CE1 3.37Å
211	H	37.3	Very low	35.7	Very low	140 Å²	140	134.1 Å²	134.1	65%	0.648	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-73.1	157	172.6	-103.3	35.4	0	0	0	110.5	N213 D214	H211-N213 PolarHBondContact O-N 2.92Å; H211-D214 PolarHBondContact N-OD2 2.03Å; H211-D214 PolarHBondContact O-N 2.82Å
212	P	38.2	Very low	36.1	Very low	85 Å²	85	131.5 Å²	131.5	55%	0.552	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-17.1	-179.1	-27.6	36.2	0	0	0	115.5	R215	P212-R215 PolarHBondContact O-NE 3.32Å
213	N	43.4	Very low	36.9	Very low	142 Å²	142	126.4 Å²	126.4	76%	0.759	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-8.6	-173.8	-61.7	-0.4	0	0	0	114.1	H211 R215	H211-N213 PolarHBondContact O-N 2.92Å; N213-R215 PolarHBondContact O-N 3.48Å; N213-R215 VanDerWaalsContact O-N 3.1Å
214	D	45.2	Very low	37.6	Very low	42 Å²	42	126 Å²	126	23%	0.225	62%	0.622	C	S	.	*			trans	-78	11	-174.6	-63.3	-42	0	0	0	113.8	S210 H211 Y226 V227	S210-D214 WeakPolarHBondContact CB-OD2 3.09Å; H211-D214 PolarHBondContact N-OD2 2.03Å; H211-D214 PolarHBondContact O-N 2.82Å; D214-Y226 HydrophobicContact CB-CD1 4.07Å; D214-Y226 VanDerWaalsContact O-CA 3.3Å; D214-Y226 WeakPolarHBondContact O-CA 3.49Å; D214-V227 PolarHBondContact O-N 2.8Å; D214-V227 VanDerWaalsContact O-N 3.11Å
215	R	46.2	Very low	38.4	Very low	125 Å²	125	117.3 Å²	117.3	47%	0.472	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.2	127.6	-172.3	-52.1	-177.3	-136.6	-145.9	2.4	111.8	P212 N213 Y223 Y226	P212-R215 PolarHBondContact O-NE 3.32Å; N213-R215 PolarHBondContact O-N 3.48Å; N213-R215 VanDerWaalsContact O-N 3.1Å; R215-Y223 HydrophobicContact CB-CD2 4.48Å; R215-Y223 HydrophobicContact CB-CE2 4.21Å; R215-Y223 HydrophobicContact CG-CE2 4.35Å; R215-Y226 HydrophobicContact CG-CE1 4.28Å
216	V	45.5	Very low	38.9	Very low	46 Å²	46	118.7 Å²	118.7	28%	0.279	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	135.6	171.1	-171.9	0	0	0	0	110.2	W224 G225 V227	V216-W224 HydrophobicContact CB-CB 3.86Å; V216-W224 HydrophobicContact CG1-CB 3.79Å; V216-W224 HydrophobicContact CG1-CE3 4.26Å; V216-W224 PolarHBondContact O-N 3.15Å; V216-G225 PolarHBondContact N-O 2.85Å; V216-V227 HydrophobicContact CG2-CG2 3.39Å
217	W	46.9	Very low	39.7	Very low	153 Å²	153	117.4 Å²	117.4	58%	0.58	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.6	141.9	171.1	-55.7	89.1	0	0	0	108.6	E221 Q222	W217-E221 VanDerWaalsContact CE3-O 3.27Å; W217-E221 WeakPolarHBondContact CZ3-O 3.25Å; W217-Q222 WeakPolarHBondContact CA-O 3.37Å
218	N	52.5	Low	40.2	Very low	37 Å²	37	113.6 Å²	113.6	20%	0.198	56%	0.555	C	S	.	*			trans	-87.1	177.1	169.2	75.5	3.7	0	0	0	111.6	K220 E221 Q222 W224	N218-K220 PolarHBondContact O-N 2.79Å; N218-K220 WeakPolarHBondContact OD1-CA 3.33Å; N218-K220 WeakPolarHBondContact OD1-CB 3.37Å; N218-K220 PolarHBondContact OD1-N 3.33Å; N218-E221 PolarHBondContact O-N 3.05Å; N218-E221 PolarHBondContact OD1-N 3Å; N218-Q222 PolarHBondContact N-O 3.36Å; N218-Q222 PolarHBondContact ND2-OE1 2.96Å; N218-Q222 WeakPolarHBondContact OD1-CB 3.02Å; N218-Q222 PolarHBondContact OD1-N 3.41Å; N218-W224 HydrophobicContact CB-CD2 4.23Å; N218-W224 HydrophobicContact CB-CZ2 4.28Å
219	E	37.2	Very low	40.2	Very low	206 Å²	206	113.4 Å²	113.4	96%	0.963	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	0.3	178.2	-58.3	177.9	165	0	0	115.1
220	K	40.3	Very low	40.3	Very low	163 Å²	163	110.3 Å²	110.3	71%	0.709	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	17.5	178.6	-59.2	177.5	-178.3	173.7	0	112.4	N218 Q222	N218-K220 PolarHBondContact O-N 2.79Å; N218-K220 WeakPolarHBondContact OD1-CA 3.33Å; N218-K220 WeakPolarHBondContact OD1-CB 3.37Å; N218-K220 PolarHBondContact OD1-N 3.33Å; K220-Q222 HydrophobicContact CB-CG 3.99Å; K220-Q222 PolarHBondContact O-N 3.33Å
221	E	37.6	Very low	40.2	Very low	168 Å²	168	113.5 Å²	113.5	79%	0.785	55%	0.546	S	S	*	.	S	Bend	trans	56.1	29	-175.3	-56.5	-174	152.2	0	0	113.5	W217 N218	W217-E221 VanDerWaalsContact CE3-O 3.27Å; W217-E221 WeakPolarHBondContact CZ3-O 3.25Å; N218-E221 PolarHBondContact O-N 3.05Å; N218-E221 PolarHBondContact OD1-N 3Å
222	Q	36.5	Very low	39.8	Very low	104 Å²	104	109.4 Å²	109.4	49%	0.486	53%	0.533	S	S	.	.			trans	-92.4	130.4	174.8	-50.7	177.9	-69.6	0	0	109.9	W217 N218 K220 W224	W217-Q222 WeakPolarHBondContact CA-O 3.37Å; N218-Q222 PolarHBondContact N-O 3.36Å; N218-Q222 PolarHBondContact ND2-OE1 2.96Å; N218-Q222 WeakPolarHBondContact OD1-CB 3.02Å; N218-Q222 PolarHBondContact OD1-N 3.41Å; K220-Q222 HydrophobicContact CB-CG 3.99Å; K220-Q222 PolarHBondContact O-N 3.33Å; Q222-W224 PolarHBondContact O-N 2.85Å
223	Y	40.3	Very low	39.3	Very low	117 Å²	117	108.3 Å²	108.3	46%	0.459	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	127.3	178.7	175.1	-111.1	0	0	0	111.7	R215 G225 Y226	R215-Y223 HydrophobicContact CB-CD2 4.48Å; R215-Y223 HydrophobicContact CB-CE2 4.21Å; R215-Y223 HydrophobicContact CG-CE2 4.35Å; Y223-G225 VanDerWaalsContact CZ-CA 3.43Å; Y223-Y226 WeakPolarHBondContact OH-CE2 3.19Å
224	W	41.4	Very low	38.5	Very low	187 Å²	187	108.6 Å²	108.6	71%	0.708	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	13.6	-178	-95.8	20.1	0	0	0	113.4	V216 N218 Q222	V216-W224 HydrophobicContact CB-CB 3.86Å; V216-W224 HydrophobicContact CG1-CB 3.79Å; V216-W224 HydrophobicContact CG1-CE3 4.26Å; V216-W224 PolarHBondContact O-N 3.15Å; N218-W224 HydrophobicContact CB-CD2 4.23Å; N218-W224 HydrophobicContact CB-CZ2 4.28Å; Q222-W224 PolarHBondContact O-N 2.85Å
225	G	42.5	Very low	37.8	Very low	18 Å²	18	114.6 Å²	114.6	19%	0.186	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.7	-162.1	-179.7	0	0	0	0	0	113.7	V216 Y223	V216-G225 PolarHBondContact N-O 2.85Å; Y223-G225 VanDerWaalsContact CZ-CA 3.43Å
226	Y	39.8	Very low	36.8	Very low	132 Å²	132	111.6 Å²	111.6	52%	0.518	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	142.6	178	-63	-74.3	0	0	0	111.4	S210 D214 R215 Y223 P228	S210-Y226 WeakPolarHBondContact OG-CE1 3.37Å; D214-Y226 HydrophobicContact CB-CD1 4.07Å; D214-Y226 VanDerWaalsContact O-CA 3.3Å; D214-Y226 WeakPolarHBondContact O-CA 3.49Å; R215-Y226 HydrophobicContact CG-CE1 4.28Å; Y223-Y226 WeakPolarHBondContact OH-CE2 3.19Å; Y226-P228 WeakPolarHBondContact O-CD 3.32Å
227	V	44.2	Very low	35.8	Very low	82 Å²	82	115.9 Å²	115.9	50%	0.497	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-69.6	128.3	173.7	-166.4	0	0	0	0	110	D214 V216 N229	D214-V227 PolarHBondContact O-N 2.8Å; D214-V227 VanDerWaalsContact O-N 3.11Å; V216-V227 HydrophobicContact CG2-CG2 3.39Å; V227-N229 PolarHBondContact O-N 3.03Å
228	P	35.9	Very low	34.9	Very low	103 Å²	103	117.8 Å²	117.8	67%	0.669	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-61.4	132.3	166	-20.9	33.4	0	0	0	110.2	Y226 S230	Y226-P228 WeakPolarHBondContact O-CD 3.32Å; P228-S230 VanDerWaalsContact C-N 3.25Å; P228-S230 PolarHBondContact O-N 3.33Å
229	N	30.3	Very low	33.7	Very low	108 Å²	108	123.7 Å²	123.7	58%	0.578	63%	0.628	S	S	*	*	S	Bend	trans	-77.1	67.2	-171.4	-115.9	-61.9	0	0	0	113.1	V227	V227-N229 PolarHBondContact O-N 3.03Å
230	S	32.3	Very low	33.1	Very low	101 Å²	101	118.1 Å²	118.1	71%	0.706	61%	0.612	S	S	*	*			trans	-125.6	18.7	-177.2	60.3	0	0	0	0	115.3	P228 S232	P228-S230 VanDerWaalsContact C-N 3.25Å; P228-S230 PolarHBondContact O-N 3.33Å; S230-S232 PolarHBondContact O-N 2.87Å
231	Y	30.6	Very low	32.4	Very low	124 Å²	124	117.2 Å²	117.2	49%	0.486	62%	0.62	S	S	.	*				41.1	86.2	119.4	-109.6	-146.1	0	0	0	117.3	S606 N607	Y231-S606 WeakPolarHBondContact CE1-O 3.12Å; Y231-N607 VanDerWaalsContact CA-OD1 3.23Å; Y231-N607 WeakPolarHBondContact CA-OD1 3.02Å; Y231-N607 WeakPolarHBondContact CB-OD1 3.17Å; Y231-N607 HydrophobicContact CD1-CB 4.14Å; Y231-N607 WeakPolarHBondContact CD1-ND2 3.11Å; Y231-N607 VanDerWaalsContact CD1-OD1 3.3Å; Y231-N607 WeakPolarHBondContact CD1-OD1 3.45Å; Y231-N607 HydrophobicContact CE1-CB 4.49Å; Y231-N607 WeakPolarHBondContact CE1-ND2 3.45Å; Y231-N607 VanDerWaalsContact CG-ND2 3.31Å; Y231-N607 PolarHBondContact O-OD1 3.34Å
232	S	28.9	Very low	31.8	Very low	54 Å²	54	115.9 Å²	115.9	38%	0.378	61%	0.609	S	S	.	*			trans	58	153.4	140.5	109.3	0	0	0	0	122.2	S230 N607	S230-S232 PolarHBondContact O-N 2.87Å; S232-N607 VanDerWaalsContact CB-CG 3.43Å; S232-N607 WeakPolarHBondContact CB-OD1 3.02Å; S232-N607 PolarHBondContact N-OD1 2.67Å; S232-N607 WeakPolarHBondContact OG-CB 3.47Å; S232-N607 PolarHBondContact OG-ND2 2.83Å; S232-N607 PolarHBondContact OG-OD1 2.74Å
233	T	28.7	Very low	31.3	Very low	63 Å²	63	117.5 Å²	117.5	39%	0.387	62%	0.62	S	S	.	*			cis	-166.9	150.3	-6.2	12.9	0	0	0	0	111.7	K608 Y650	T233-K608 WeakPolarHBondContact OG1-CE 3.25Å; T233-K608 PolarHBondContact OG1-NZ 2.74Å; T233-K608 VanDerWaalsContact OG1-NZ 3.14Å; T233-Y650 VanDerWaalsContact O-CD1 3.23Å; T233-Y650 WeakPolarHBondContact O-CD1 3.4Å
234	Q	26.5	Very low	30.6	Very low	147 Å²	147	124.6 Å²	124.6	69%	0.687	65%	0.646	S	S	*	*			trans	23.5	144.6	138.5	-66.8	-179.4	4.8	0	0	120.7
235	Q	29.1	Very low	29.9	Very low	168 Å²	168	117.9 Å²	117.9	79%	0.785	63%	0.628	S	S	*	*			cis	-164.6	169.7	18.1	-119.4	170.1	80.4	0	0	108
236	G	25	Very low	29.2	Very low	63 Å²	63	121.7 Å²	121.7	65%	0.649	64%	0.641	S	S	*	*			cis	140.5	93.1	-6.7	0	0	0	0	0	114.5
237	T	26.3	Very low	28.6	Very low	135 Å²	135	120.7 Å²	120.7	83%	0.828	65%	0.653	S	S	*	*			trans	-140.8	108.4	170.7	47.7	0	0	0	0	113
238	E	26.4	Very low	27.9	Very low	193 Å²	193	121 Å²	121	90%	0.902	66%	0.664	S	S	*	*	S	Bend	trans	57.8	178.7	172.5	-58.7	-170.6	170.5	0	0	116.5
239	I	27.1	Very low	27.7	Very low	162 Å²	162	124.4 Å²	124.4	83%	0.831	66%	0.664	S	S	*	*	S	Bend	trans	70.2	100.3	178	-49.8	170.1	0	0	0	116.4
240	S	25.3	Very low	27.8	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	67%	0.671	S	S	*	*			trans	50.5	104.1	147.9	-158.2	0	0	0	0	120.2	Y242	S240-Y242 VanDerWaalsContact C-N 3.33Å; S240-Y242 PolarHBondContact O-N 2.98Å
241	T	24.8	Very low	27.7	Very low	143 Å²	143	128.6 Å²	128.6	88%	0.877	67%	0.667	S	S	*	*			trans	-73.6	81.4	162.3	51.1	0	0	0	0	111.3
242	Y	25	Very low	27.7	Very low	141 Å²	141	130 Å²	130	55%	0.553	68%	0.682	S	S	*	*			trans	-126.6	159.6	176.8	-118.9	-109.7	0	0	0	111.2	S240 Q246	S240-Y242 VanDerWaalsContact C-N 3.33Å; S240-Y242 PolarHBondContact O-N 2.98Å; Y242-Q246 PolarHBondContact OH-NE2 3.4Å
243	L	26.3	Very low	28.1	Very low	137 Å²	137	129.7 Å²	129.7	72%	0.717	68%	0.675	S	S	*	*	S	Bend	trans	65	50.9	168.1	-66.7	147.5	0	0	0	117.6
244	W	25.3	Very low	28.2	Very low	266 Å²	266	130 Å²	130	100%	1.008	68%	0.679	S	S	*	*	S	Bend		-153.6	35.9	128.9	-95.8	5.2	0	0	0	111.7
245	S	27.6	Very low	28.9	Very low	47 Å²	47	125.5 Å²	125.5	33%	0.329	66%	0.659	S	S	.	*	S	Bend	trans	-132.5	1.6	-176.2	53.4	0	0	0	0	114.1
246	Q	26.9	Very low	29.3	Very low	98 Å²	98	122.2 Å²	122.2	46%	0.458	65%	0.653	S	S	.	*	S	Bend	trans	-121.2	18.4	-173.9	-67.5	-173.3	-13	0	0	114	Y242	Y242-Q246 PolarHBondContact OH-NE2 3.4Å
247	S	28.3	Very low	29.8	Very low	110 Å²	110	122.7 Å²	122.7	77%	0.769	64%	0.644	S	S	*	*	S	Bend	trans	-122.1	-4.9	173.8	-47.4	0	0	0	0	113.5
248	A	29.8	Very low	30.3	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	63%	0.633	S	S	*	*	S	Bend	trans	-128	24.3	-177.3	0	0	0	0	0	112.5
249	R	30.7	Very low	30.7	Very low	176 Å²	176	118.1 Å²	118.1	66%	0.664	62%	0.621	S	S	*	*	S	Bend	trans	-135.9	19.1	175.5	-65.1	-170.9	-178.7	-175.2	2.1	112.9	F1023	R249-F1023 VanDerWaalsContact NH1-CE1 3.3Å
250	Q	32.3	Very low	31	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.724	62%	0.618	S	S	*	*	S	Bend	trans	-128.8	9	173.3	-160.1	164.6	0.9	0	0	112
251	F	30	Very low	31.3	Very low	142 Å²	142	118.8 Å²	118.8	62%	0.623	62%	0.624	S	S	*	*			trans	-141.1	105.6	166.4	-70	-83.2	0	0	0	106.7	E253	F251-E253 HydrophobicContact CB-CB 4.39Å; F251-E253 PolarHBondContact O-N 2.74Å
252	D	30.5	Very low	31.6	Very low	152 Å²	152	116.2 Å²	116.2	81%	0.813	62%	0.617	S	S	*	*	S	Bend	trans	-73.9	36.1	172.4	-80.8	-38.4	0	0	0	111.6	N306	D252-N306 PolarHBondContact O-ND2 3.49Å
253	E	39.1	Very low	32.1	Very low	49 Å²	49	118.6 Å²	118.6	23%	0.229	63%	0.633	C	S	.	*			trans	-139.5	23	-149.1	-50.5	-157.8	119.8	0	0	115.8	F251 N306 V309	F251-E253 HydrophobicContact CB-CB 4.39Å; F251-E253 PolarHBondContact O-N 2.74Å; E253-N306 HydrophobicContact CB-CB 3.69Å; E253-N306 HydrophobicContact CG-CB 3.62Å; E253-N306 WeakPolarHBondContact OE1-CB 3.43Å; E253-V309 HydrophobicContact CB-CG2 4.43Å; E253-V309 HydrophobicContact CG-CG2 4.39Å; E253-V309 WeakPolarHBondContact OE1-CG2 3.27Å; E253-V309 WeakPolarHBondContact OE2-CG2 3.26Å
254	C	30.9	Very low	32.7	Very low	68 Å²	68	114.4 Å²	114.4	46%	0.459	62%	0.615	S	S	.	*			trans	-126.8	112.4	173.2	-60.5	0	0	0	0	111	C302	C254-C302 HydrophobicContact CB-CB 3.75Å; C254-C302 WeakPolarHBondContact CB-SG 3.48Å; C254-C302 WeakPolarHBondContact SG-CB 3.39Å; C254-C302 CovalentContact SG-SG 2.03Å; C254-C302 PolarHBondContact SG-SG 3.05Å
255	I	40.6	Very low	33.3	Very low	54 Å²	54	107.9 Å²	107.9	28%	0.277	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-97.3	126.4	166.8	-56.9	-171.4	0	0	0	108.8	F258 V304 F320	I255-F258 HydrophobicContact CG2-CE2 4.44Å; I255-V304 HydrophobicContact CB-CB 4.46Å; I255-V304 HydrophobicContact CB-CG1 4.2Å; I255-F320 HydrophobicContact CD1-CB 4Å; I255-F320 HydrophobicContact CD1-CD1 3.49Å; I255-F320 VanDerWaalsContact CD1-CD1 3.49Å; I255-F320 HydrophobicContact CD1-CE1 4.15Å; I255-F320 HydrophobicContact CD1-CG 3.9Å; I255-F320 WeakPolarHBondContact CD1-O 3.35Å; I255-F320 HydrophobicContact CG2-CD1 4.28Å
256	P	36.2	Very low	33.7	Very low	99 Å²	99	114.3 Å²	114.3	64%	0.643	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-65.9	134.9	176	27.2	-33.8	0	0	0	110.5
257	P	37.3	Very low	34.3	Very low	72 Å²	72	118.2 Å²	118.2	47%	0.468	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-70.2	133.9	-174.8	27.7	-34.5	0	0	0	112.1	C259	P257-C259 PolarHBondContact O-N 2.79Å
258	F	35.2	Very low	34.9	Very low	138 Å²	138	119.8 Å²	119.8	61%	0.605	64%	0.635	S	S	*	*			trans	-79.4	110.2	174	-53.8	-79.1	0	0	0	110.4	I255 I260 F320	I255-F258 HydrophobicContact CG2-CE2 4.44Å; F258-I260 PolarHBondContact O-N 3.35Å; F258-I260 VanDerWaalsContact O-N 3.14Å; F258-F320 HydrophobicContact CE2-CD1 4.47Å; F258-F320 HydrophobicContact CE2-CE1 4.22Å; F258-F320 HydrophobicContact CZ-CE1 4.37Å
259	C	34.4	Very low	35.5	Very low	95 Å²	95	121 Å²	121	64%	0.642	63%	0.629	S	S	*	*			trans	-72.9	102.6	166.6	-73.1	0	0	0	0	110.2	P257 P261	P257-C259 PolarHBondContact O-N 2.79Å; C259-P261 WeakPolarHBondContact O-CD 3.32Å
260	I	34.6	Very low	36	Very low	152 Å²	152	115.8 Å²	115.8	78%	0.779	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-75.6	119.5	162.3	-56	176.7	0	0	0	107.1	F258	F258-I260 PolarHBondContact O-N 3.35Å; F258-I260 VanDerWaalsContact O-N 3.14Å
261	P	31.7	Very low	36.5	Very low	113 Å²	113	118.1 Å²	118.1	73%	0.734	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-71	132.1	175.8	29.3	-33.1	0	0	0	110	C259	C259-P261 WeakPolarHBondContact O-CD 3.32Å
262	A	30.7	Very low	36.7	Very low	89 Å²	89	115 Å²	115	74%	0.736	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-65.7	135.9	172.2	0	0	0	0	0	110.4	C264	A262-C264 PolarHBondContact O-N 3.26Å
263	Q	35.8	Very low	37.2	Very low	191 Å²	191	114.3 Å²	114.3	89%	0.893	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-72.5	122.4	166.2	-73.7	177.4	-69.8	0	0	108.9
264	C	38.3	Very low	37.2	Very low	49 Å²	49	116.6 Å²	116.6	33%	0.331	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-97.5	121.6	170.9	-62.6	0	0	0	0	109	A262 Y266 P272	A262-C264 PolarHBondContact O-N 3.26Å; C264-Y266 HydrophobicContact CB-CE2 4.39Å; C264-Y266 VanDerWaalsContact O-CD2 3.23Å; C264-Y266 WeakPolarHBondContact O-CD2 3.31Å; C264-Y266 PolarHBondContact O-N 3.06Å; C264-P272 HydrophobicContact CB-CB 4.48Å
265	D	37.4	Very low	37.5	Very low	129 Å²	129	119.1 Å²	119.1	69%	0.69	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-68.7	129.1	171.4	-102.1	-24.8	0	0	0	110.9	Y267	D265-Y267 HydrophobicContact CB-CE2 4.41Å
266	Y	35.9	Very low	37.3	Very low	181 Å²	181	124.8 Å²	124.8	71%	0.71	68%	0.68	S	S	*	*			trans	-102.5	99.5	178	-77.5	-91.4	0	0	0	110.8	C264	C264-Y266 HydrophobicContact CB-CE2 4.39Å; C264-Y266 VanDerWaalsContact O-CD2 3.23Å; C264-Y266 WeakPolarHBondContact O-CD2 3.31Å; C264-Y266 PolarHBondContact O-N 3.06Å
267	Y	40.3	Very low	37.3	Very low	181 Å²	181	128.1 Å²	128.1	71%	0.71	69%	0.692	S	S	*	*			trans	-75.2	162.9	161.3	-74.6	-91.4	0	0	0	110.8	D265 D269	D265-Y267 HydrophobicContact CB-CE2 4.41Å; Y267-D269 PolarHBondContact O-N 2.84Å
268	T	40.4	Very low	37.2	Very low	142 Å²	142	131.9 Å²	131.9	87%	0.871	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	0.6	-169.7	42.4	0	0	0	0	117.2
269	D	43.1	Very low	37.1	Very low	114 Å²	114	130.5 Å²	130.5	61%	0.61	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	4.3	-159.2	-63.1	31.8	0	0	0	112.1	Y267 R271	Y267-D269 PolarHBondContact O-N 2.84Å; D269-R271 VanDerWaalsContact C-N 3.29Å; D269-R271 PolarHBondContact O-N 3.39Å
270	G	40.6	Very low	36.9	Very low	66 Å²	66	130.2 Å²	130.2	68%	0.68	71%	0.71	S	S	*	*	S	Bend	trans	71.7	13.2	171.7	0	0	0	0	0	115.9
271	R	44	Very low	36.8	Very low	205 Å²	205	128.5 Å²	128.5	77%	0.774	70%	0.702	S	S	*	*			trans	-118.2	120.2	178.4	-66.2	-176.1	178.7	-166.7	-1.2	111.2	D269	D269-R271 VanDerWaalsContact C-N 3.29Å; D269-R271 PolarHBondContact O-N 3.39Å
272	P	34.3	Very low	36.8	Very low	76 Å²	76	123.8 Å²	123.8	49%	0.494	68%	0.675	S	S	.	*			trans	-72.6	136.5	169.6	30.7	-32.9	0	0	0	110	C264	C264-P272 HydrophobicContact CB-CB 4.48Å
273	I	41.1	Very low	37	Very low	138 Å²	138	124 Å²	124	71%	0.708	67%	0.671	S	S	*	*			trans	-117.7	96.3	167.5	-58.1	179.8	0	0	0	107.7	T275	I273-T275 HydrophobicContact CG2-CG2 4.11Å; I273-T275 PolarHBondContact O-N 3.43Å
274	C	38.2	Very low	37.1	Very low	96 Å²	96	119.6 Å²	119.6	65%	0.649	66%	0.657	S	S	*	*			trans	-73.9	104.2	170.4	-54.4	0	0	0	0	108.6	Q276	C274-Q276 PolarHBondContact O-N 3.01Å
275	T	37.5	Very low	36.9	Very low	121 Å²	121	123 Å²	123	74%	0.742	68%	0.679	S	S	*	*			trans	-79.2	111.1	179.7	47.9	0	0	0	0	111.6	I273	I273-T275 HydrophobicContact CG2-CG2 4.11Å; I273-T275 PolarHBondContact O-N 3.43Å
276	Q	36.4	Very low	36.6	Very low	173 Å²	173	121.6 Å²	121.6	81%	0.808	68%	0.677	S	S	*	*	S	Bend	trans	78.7	142.5	171.2	-49.9	-171	12.2	0	0	117	C274 L278	C274-Q276 PolarHBondContact O-N 3.01Å; Q276-L278 PolarHBondContact O-N 2.83Å
277	N	35.6	Very low	36.5	Very low	169 Å²	169	122.8 Å²	122.8	90%	0.904	68%	0.682	S	S	*	*			trans	-86	100.4	-180	-65.4	-36	0	0	0	110.3
278	L	35.1	Very low	36.2	Very low	152 Å²	152	123.2 Å²	123.2	80%	0.796	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-100.3	133	153.5	-96.3	68.9	0	0	0	108.7	Q276	Q276-L278 PolarHBondContact O-N 2.83Å
279	P	33.1	Very low	36.1	Very low	109 Å²	109	123.5 Å²	123.5	71%	0.708	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-71.9	143.2	-179.7	30	-34.3	0	0	0	110.9	L281	P279-L281 PolarHBondContact O-N 2.03Å
280	C	30.7	Very low	35.9	Very low	88 Å²	88	122.4 Å²	122.4	60%	0.595	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-61.6	125.7	163.9	-66.7	0	0	0	0	109.1	G282	C280-G282 WeakPolarHBondContact CB-O 3.5Å; C280-G282 PolarHBondContact O-N 2.99Å
281	L	31.7	Very low	35.9	Very low	116 Å²	116	125.5 Å²	125.5	61%	0.607	69%	0.689	S	S	*	*	S	Bend	trans	-73.2	70.6	169	-80.2	165.7	0	0	0	109.5	P279 L333	P279-L281 PolarHBondContact O-N 2.03Å; L281-L333 HydrophobicContact CD2-CD1 4.26Å
282	G	32.6	Very low	35.6	Very low	15 Å²	15	120.3 Å²	120.3	16%	0.155	68%	0.684	C	S	.	*	S	Bend	trans	152.4	96.4	-165.2	0	0	0	0	0	108.4	C280 T284	C280-G282 WeakPolarHBondContact CB-O 3.5Å; C280-G282 PolarHBondContact O-N 2.99Å; G282-T284 PolarHBondContact O-N 2.87Å
283	S	35.3	Very low	35.5	Very low	94 Å²	94	120.6 Å²	120.6	66%	0.657	69%	0.687	S	S	*	*			trans	-67.2	113	-174.9	50.5	0	0	0	0	111.6	N303	S283-N303 PolarHBondContact OG-ND2 3.5Å
284	T	38	Very low	35.2	Very low	98 Å²	98	125 Å²	125	60%	0.601	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65	142.6	164.1	41.8	0	0	0	0	110.1	G282 C286	G282-T284 PolarHBondContact O-N 2.87Å; T284-C286 PolarHBondContact O-N 2.94Å
285	P	34.4	Very low	34.7	Very low	121 Å²	121	129.2 Å²	129.2	79%	0.786	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-70	123.1	176.7	28	-33.2	0	0	0	110.2	Y287	P285-Y287 PolarHBondContact O-N 2.87Å
286	C	31.4	Very low	34.5	Very low	98 Å²	98	127.6 Å²	127.6	66%	0.662	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.2	172.4	-69	0	0	0	0	110.4	T284 Q288	T284-C286 PolarHBondContact O-N 2.94Å; C286-Q288 PolarHBondContact O-N 2.94Å
287	Y	33.5	Very low	34.2	Very low	206 Å²	206	126.8 Å²	126.8	81%	0.808	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-64.3	133	174.1	-119	-99.3	0	0	0	109.8	P285 N289 D290	P285-Y287 PolarHBondContact O-N 2.87Å; Y287-N289 PolarHBondContact O-N 3.43Å; Y287-D290 PolarHBondContact O-N 2.74Å
288	Q	33	Very low	33.8	Very low	190 Å²	190	129.3 Å²	129.3	89%	0.888	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	9.3	-169.2	-71.6	-176.9	-37.3	0	0	116.5	C286	C286-Q288 PolarHBondContact O-N 2.94Å
289	N	39.2	Very low	33.6	Very low	149 Å²	149	125.1 Å²	125.1	80%	0.797	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	9	-175.6	-69.5	-32.6	0	0	0	114.2	Y287 P291	Y287-N289 PolarHBondContact O-N 3.43Å; N289-P291 WeakPolarHBondContact O-CD 3.39Å
290	D	38	Very low	33.4	Very low	90 Å²	90	127.1 Å²	127.1	48%	0.481	71%	0.707	S	S	.	*			trans	-90.8	115.9	176.9	-167	-30.2	0	0	0	111.9	Y287 S292 C293	Y287-D290 PolarHBondContact O-N 2.74Å; D290-S292 PolarHBondContact O-N 3.35Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 WeakPolarHBondContact OD1-CB 3.26Å; D290-S292 PolarHBondContact OD1-N 2.04Å; D290-S292 PolarHBondContact OD1-OG 3.37Å; D290-C293 PolarHBondContact O-N 2.85Å
291	P	40.7	Very low	33.7	Very low	132 Å²	132	129.6 Å²	129.6	86%	0.857	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-4.2	179.1	30.6	-36.5	0	0	0	114.4	N289 C293	N289-P291 WeakPolarHBondContact O-CD 3.39Å; P291-C293 VanDerWaalsContact C-N 3.32Å
292	S	38.4	Very low	33.8	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-17.3	176.7	-44.9	0	0	0	0	113.3	D290 R294	D290-S292 PolarHBondContact O-N 3.35Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 WeakPolarHBondContact OD1-CB 3.26Å; D290-S292 PolarHBondContact OD1-N 2.04Å; D290-S292 PolarHBondContact OD1-OG 3.37Å; S292-R294 PolarHBondContact O-N 2.92Å
293	C	32.4	Very low	34.7	Very low	82 Å²	82	130.3 Å²	130.3	55%	0.554	72%	0.719	S	S	*	*			trans	-83	96.1	-167.4	-161.5	0	0	0	0	112.8	D290 P291	D290-C293 PolarHBondContact O-N 2.85Å; P291-C293 VanDerWaalsContact C-N 3.32Å
294	R	34.1	Very low	35.5	Very low	230 Å²	230	126.5 Å²	126.5	87%	0.868	69%	0.692	S	S	*	*			trans	-83.6	155.8	176.3	-73.3	-170.5	175.7	-167.3	-1.2	113.5	S292 A296	S292-R294 PolarHBondContact O-N 2.92Å; R294-A296 PolarHBondContact O-N 2.92Å
295	Q	28.4	Very low	36.6	Very low	185 Å²	185	124.3 Å²	124.3	86%	0.864	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	30	-153.2	-156.7	169	-8	0	0	116.6
296	A	33.6	Very low	37.7	Very low	87 Å²	87	120.3 Å²	120.3	72%	0.719	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-23	-171.4	0	0	0	0	0	115.7	R294	R294-A296 PolarHBondContact O-N 2.92Å
297	N	30.2	Very low	39.2	Very low	157 Å²	157	117.8 Å²	117.8	84%	0.84	63%	0.631	S	S	*	*			trans	-113	45.2	-166.9	-68.8	-3.8	0	0	0	113.8
298	Y	25.3	Very low	40.7	Very low	222 Å²	222	111 Å²	111	87%	0.871	61%	0.611	S	S	*	*			trans	-88.3	104.3	166.8	-87	-89.6	0	0	0	109.9
299	G	30.9	Very low	42.1	Very low	64 Å²	64	102.6 Å²	102.6	66%	0.66	57%	0.573	S	S	*	*			trans	-166.5	108.4	176.6	0	0	0	0	0	112.3	N301	G299-N301 PolarHBondContact O-N 3.38Å
300	V	29	Very low	43.3	Very low	151 Å²	151	95.5 Å²	95.5	92%	0.915	54%	0.535	S	S	*	.			trans	-88.8	101.3	174.7	-170.3	0	0	0	0	108.1
301	N	38	Very low	44.5	Very low	139 Å²	139	96.3 Å²	96.3	74%	0.743	53%	0.534	S	S	*	.			trans	-150.9	155	176.6	-92.6	-42.2	0	0	0	111.6	G299 N303	G299-N301 PolarHBondContact O-N 3.38Å; N301-N303 PolarHBondContact O-N 2.84Å
302	C	33.4	Very low	45.4	Very low	64 Å²	64	97 Å²	97	43%	0.432	53%	0.526	S	S	.	.			trans	-70.5	110.6	171.9	-61.8	0	0	0	0	110.1	C254 V304	C254-C302 HydrophobicContact CB-CB 3.75Å; C254-C302 WeakPolarHBondContact CB-SG 3.48Å; C254-C302 WeakPolarHBondContact SG-CB 3.39Å; C254-C302 CovalentContact SG-SG 2.03Å; C254-C302 PolarHBondContact SG-SG 3.05Å; C302-V304 VanDerWaalsContact C-N 3.29Å; C302-V304 PolarHBondContact O-N 2.87Å
303	N	51.4	Low	46.4	Very low	82 Å²	82	98.5 Å²	98.5	44%	0.439	52%	0.524	S	S	.	.	S	Bend	trans	-76.6	-11.5	-178.1	-73	-26.6	0	0	0	114.2	S283 N301 V323	S283-N303 PolarHBondContact OG-ND2 3.5Å; N301-N303 PolarHBondContact O-N 2.84Å; N303-V323 VanDerWaalsContact O-CA 3.32Å; N303-V323 WeakPolarHBondContact O-CA 3.12Å; N303-V323 WeakPolarHBondContact O-CG2 3.15Å
304	V	53	Low	47.9	Very low	14 Å²	14	97.3 Å²	97.3	9%	0.085	51%	0.508	C	S	.	.	S	Bend	trans	-105.4	103.7	170.1	-176.6	0	0	0	0	108.8	I255 C302 C322 V323 V335	I255-V304 HydrophobicContact CB-CB 4.46Å; I255-V304 HydrophobicContact CB-CG1 4.2Å; C302-V304 VanDerWaalsContact C-N 3.29Å; C302-V304 PolarHBondContact O-N 2.87Å; V304-C322 WeakPolarHBondContact CA-O 3.49Å; V304-V323 HydrophobicContact CG2-CG2 4.11Å; V304-V335 HydrophobicContact CG1-CB 4.44Å; V304-V335 HydrophobicContact CG1-CG2 3.87Å; V304-V335 HydrophobicContact CG2-CG2 4.1Å
305	M	60.5	Low	49.2	Very low	53 Å²	53	90.3 Å²	90.3	26%	0.261	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-78.6	143.6	172.1	-63	151.6	170.8	0	0	109.4	V309 C310 W314 G321 C322 K324	M305-V309 HydrophobicContact CB-CB 4.01Å; M305-V309 HydrophobicContact CB-CG1 4.13Å; M305-V309 HydrophobicContact CB-CG2 4.36Å; M305-V309 HydrophobicContact CG-CG1 4.46Å; M305-C310 PolarHBondContact O-SG 2.99Å; M305-W314 HydrophobicContact CE-CH2 3.96Å; M305-W314 HydrophobicContact CE-CZ3 4.46Å; M305-W314 HydrophobicContact SD-CH2 3.53Å; M305-W314 VanDerWaalsContact SD-CH2 3.53Å; M305-W314 HydrophobicContact SD-CZ3 3.44Å; M305-W314 WeakPolarHBondContact SD-CZ3 3.49Å; M305-G321 CarbonylContact O-C 3.54Å; M305-G321 WeakPolarHBondContact O-CA 3.08Å; M305-C322 PolarHBondContact N-O 2.84Å; M305-C322 PolarHBondContact O-N 2.72Å; M305-K324 HydrophobicContact CE-CB 4.43Å
306	N	58.4	Low	50.7	Low	37 Å²	37	81.8 Å²	81.8	20%	0.198	45%	0.448	C	S	.	.			trans	-59.8	149.2	179.4	-166.5	-31.9	0	0	0	111.6	D252 E253 T308 V309 C310	D252-N306 PolarHBondContact O-ND2 3.49Å; E253-N306 HydrophobicContact CB-CB 3.69Å; E253-N306 HydrophobicContact CG-CB 3.62Å; E253-N306 WeakPolarHBondContact OE1-CB 3.43Å; N306-T308 PolarHBondContact O-N 3.06Å; N306-T308 PolarHBondContact OD1-N 2.89Å; N306-T308 VanDerWaalsContact OD1-N 3.16Å; N306-T308 PolarHBondContact OD1-OG1 3.11Å; N306-V309 HydrophobicContact CB-CG2 4.23Å; N306-V309 WeakPolarHBondContact O-CA 3.29Å; N306-V309 WeakPolarHBondContact O-CB 3.48Å; N306-V309 PolarHBondContact O-N 3.47Å; N306-C310 PolarHBondContact O-N 2.91Å; N306-C310 PolarHBondContact O-SG 3.44Å
307	S	62.7	Low	52.2	Low	45 Å²	45	84.5 Å²	84.5	32%	0.315	45%	0.446	S	S	.	.	H	α-helix	trans	-40.6	-34.4	163.4	67	0	0	0	0	114	C310 K311 C318	S307-C310 PolarHBondContact O-N 2.89Å; S307-K311 WeakPolarHBondContact O-CB 3.18Å; S307-K311 PolarHBondContact O-N 2.9Å; S307-C318 VanDerWaalsContact CB-O 3.25Å; S307-C318 WeakPolarHBondContact CB-O 3.06Å
308	T	63.9	Low	53.7	Low	62 Å²	62	77.5 Å²	77.5	38%	0.38	41%	0.409	S	S	.	.	H	α-helix	trans	-63.1	-54.3	172.7	-27.1	0	0	0	0	112.3	N306 C310 K311 Q312	N306-T308 PolarHBondContact O-N 3.06Å; N306-T308 PolarHBondContact OD1-N 2.89Å; N306-T308 VanDerWaalsContact OD1-N 3.16Å; N306-T308 PolarHBondContact OD1-OG1 3.11Å; T308-C310 VanDerWaalsContact C-N 3.29Å; T308-C310 PolarHBondContact O-N 3.1Å; T308-K311 PolarHBondContact O-N 3.08Å; T308-Q312 WeakPolarHBondContact O-CB 3.49Å; T308-Q312 WeakPolarHBondContact O-CG 2.99Å; T308-Q312 PolarHBondContact O-N 2.04Å
309	V	62.5	Low	55.5	Low	14 Å²	14	69.2 Å²	69.2	9%	0.085	38%	0.383	C	S	.	.	H	α-helix	trans	-56.7	-43.5	173.2	-169.2	0	0	0	0	111.1	E253 M305 N306 K311 Q312 M313 W314	E253-V309 HydrophobicContact CB-CG2 4.43Å; E253-V309 HydrophobicContact CG-CG2 4.39Å; E253-V309 WeakPolarHBondContact OE1-CG2 3.27Å; E253-V309 WeakPolarHBondContact OE2-CG2 3.26Å; M305-V309 HydrophobicContact CB-CB 4.01Å; M305-V309 HydrophobicContact CB-CG1 4.13Å; M305-V309 HydrophobicContact CB-CG2 4.36Å; M305-V309 HydrophobicContact CG-CG1 4.46Å; N306-V309 HydrophobicContact CB-CG2 4.23Å; N306-V309 WeakPolarHBondContact O-CA 3.29Å; N306-V309 WeakPolarHBondContact O-CB 3.48Å; N306-V309 PolarHBondContact O-N 3.47Å; V309-K311 VanDerWaalsContact C-N 3.27Å; V309-K311 PolarHBondContact O-N 3.3Å; V309-Q312 CarbonylContact O-C 3.56Å; V309-Q312 PolarHBondContact O-N 3.46Å; V309-M313 HydrophobicContact CG1-CB 4.49Å; V309-M313 HydrophobicContact CG1-CE 4.17Å; V309-M313 HydrophobicContact CG1-CG 3.94Å; V309-M313 HydrophobicContact CG1-SD 3.69Å; V309-M313 WeakPolarHBondContact O-CB 2.89Å; V309-M313 PolarHBondContact O-N 3.19Å; V309-W314 HydrophobicContact CG1-CZ3 4.39Å
310	C	63.9	Low	57	Low	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-40.7	-178.9	-55.2	0	0	0	0	111.5	M305 N306 S307 T308 W314 N315 L316 C322	M305-C310 PolarHBondContact O-SG 2.99Å; N306-C310 PolarHBondContact O-N 2.91Å; N306-C310 PolarHBondContact O-SG 3.44Å; S307-C310 PolarHBondContact O-N 2.89Å; T308-C310 VanDerWaalsContact C-N 3.29Å; T308-C310 PolarHBondContact O-N 3.1Å; C310-W314 CarbonylContact O-C 3.56Å; C310-W314 WeakPolarHBondContact O-CA 3.49Å; C310-W314 PolarHBondContact O-N 3.33Å; C310-W314 VanDerWaalsContact O-N 3.08Å; C310-N315 PolarHBondContact O-N 2.62Å; C310-L316 CarbonylContact C-O 3.59Å; C310-L316 HydrophobicContact CB-CB 4.18Å; C310-L316 VanDerWaalsContact CB-O 3.24Å; C310-L316 WeakPolarHBondContact CB-O 3.48Å; C310-L316 PolarHBondContact O-N 2.85Å; C310-C322 VanDerWaalsContact CA-SG 3.56Å; C310-C322 HydrophobicContact CB-CB 3.95Å; C310-C322 WeakPolarHBondContact CB-SG 3.42Å; C310-C322 VanDerWaalsContact SG-CA 3.58Å; C310-C322 WeakPolarHBondContact SG-CB 3.38Å; C310-C322 PolarHBondContact SG-N 2.94Å; C310-C322 CovalentContact SG-SG 2.03Å; C310-C322 PolarHBondContact SG-SG 2.79Å
311	K	63	Low	58.9	Low	108 Å²	108	61.7 Å²	61.7	47%	0.47	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-31.7	173.3	-170.9	171.9	-179.1	174.9	0	113.1	S307 T308 V309 N315 L316	S307-K311 WeakPolarHBondContact O-CB 3.18Å; S307-K311 PolarHBondContact O-N 2.9Å; T308-K311 PolarHBondContact O-N 3.08Å; V309-K311 VanDerWaalsContact C-N 3.27Å; V309-K311 PolarHBondContact O-N 3.3Å; K311-N315 WeakPolarHBondContact O-CA 3.36Å; K311-N315 PolarHBondContact O-N 2.85Å; K311-L316 PolarHBondContact N-O 3.45Å
312	Q	60.7	Low	60.4	Low	147 Å²	147	55 Å²	55	69%	0.687	29%	0.285	S	S	*	.	H	α-helix	trans	-81.9	-39.4	-179.8	-74.1	173.5	-11.8	0	0	114.1	T308 V309	T308-Q312 WeakPolarHBondContact O-CB 3.49Å; T308-Q312 WeakPolarHBondContact O-CG 2.99Å; T308-Q312 PolarHBondContact O-N 2.04Å; V309-Q312 CarbonylContact O-C 3.56Å; V309-Q312 PolarHBondContact O-N 3.46Å
313	M	60	Low	62.1	Low	126 Å²	126	52.9 Å²	52.9	62%	0.621	27%	0.27	S	S	*	.	H	α-helix	trans	-94.9	-28.1	-176.1	-72.2	-169	175.8	0	0	113.9	V309	V309-M313 HydrophobicContact CG1-CB 4.49Å; V309-M313 HydrophobicContact CG1-CE 4.17Å; V309-M313 HydrophobicContact CG1-CG 3.94Å; V309-M313 HydrophobicContact CG1-SD 3.69Å; V309-M313 WeakPolarHBondContact O-CB 2.89Å; V309-M313 PolarHBondContact O-N 3.19Å
314	W	63.3	Low	62.6	Low	56 Å²	56	53.2 Å²	53.2	21%	0.212	27%	0.267	C	S	.	.	S	Bend	trans	-136.9	6.5	-175.5	-59.8	-74.1	0	0	0	114.5	M305 V309 C310 L316 K324 V332	M305-W314 HydrophobicContact CE-CH2 3.96Å; M305-W314 HydrophobicContact CE-CZ3 4.46Å; M305-W314 HydrophobicContact SD-CH2 3.53Å; M305-W314 VanDerWaalsContact SD-CH2 3.53Å; M305-W314 HydrophobicContact SD-CZ3 3.44Å; M305-W314 WeakPolarHBondContact SD-CZ3 3.49Å; V309-W314 HydrophobicContact CG1-CZ3 4.39Å; C310-W314 CarbonylContact O-C 3.56Å; C310-W314 WeakPolarHBondContact O-CA 3.49Å; C310-W314 PolarHBondContact O-N 3.33Å; C310-W314 VanDerWaalsContact O-N 3.08Å; W314-L316 HydrophobicContact CB-CB 4.5Å; W314-L316 HydrophobicContact CB-CD1 3.87Å; W314-L316 HydrophobicContact CB-CG 4.03Å; W314-L316 PolarHBondContact O-N 2.04Å; W314-L316 VanDerWaalsContact O-N 3.09Å; W314-K324 HydrophobicContact CZ2-CD 4.09Å; W314-V332 HydrophobicContact CD2-CG1 4.18Å; W314-V332 HydrophobicContact CD2-CG2 3.86Å; W314-V332 HydrophobicContact CE3-CG1 4.09Å; W314-V332 HydrophobicContact CE3-CG2 4.45Å; W314-V332 HydrophobicContact CG-CG1 4.45Å; W314-V332 HydrophobicContact CG-CG2 4.01Å; W314-V332 HydrophobicContact CZ2-CG2 4.4Å
315	N	61.5	Low	62.8	Low	84 Å²	84	57.5 Å²	57.5	45%	0.449	29%	0.29	S	S	.	.			trans	57.3	17.7	-175.4	-157.1	20.7	0	0	0	114.7	C310 K311	C310-N315 PolarHBondContact O-N 2.62Å; K311-N315 WeakPolarHBondContact O-CA 3.36Å; K311-N315 PolarHBondContact O-N 2.85Å
316	L	59.9	Low	62.4	Low	5 Å²	5	56.8 Å²	56.8	3%	0.026	30%	0.296	C	S	.	.			trans	-87.6	119.1	-174.5	-75.7	171.6	0	0	0	112.4	C310 K311 W314 C318 V332	C310-L316 CarbonylContact C-O 3.59Å; C310-L316 HydrophobicContact CB-CB 4.18Å; C310-L316 VanDerWaalsContact CB-O 3.24Å; C310-L316 WeakPolarHBondContact CB-O 3.48Å; C310-L316 PolarHBondContact O-N 2.85Å; K311-L316 PolarHBondContact N-O 3.45Å; W314-L316 HydrophobicContact CB-CB 4.5Å; W314-L316 HydrophobicContact CB-CD1 3.87Å; W314-L316 HydrophobicContact CB-CG 4.03Å; W314-L316 PolarHBondContact O-N 2.04Å; W314-L316 VanDerWaalsContact O-N 3.09Å; L316-C318 PolarHBondContact O-N 2.79Å; L316-V332 HydrophobicContact CD1-CB 3.8Å; L316-V332 HydrophobicContact CD1-CG1 3.49Å; L316-V332 VanDerWaalsContact CD1-CG1 3.49Å
317	Q	65.6	Low	61.9	Low	145 Å²	145	60.4 Å²	60.4	68%	0.678	32%	0.324	S	S	*	.			trans	-89.6	71	179.5	-169	173.8	-46.2	0	0	112.3
318	C	61.4	Low	61.2	Low	9 Å²	9	63.5 Å²	63.5	6%	0.061	33%	0.332	C	S	.	.			trans	-83.7	152	-178.9	-52.1	0	0	0	0	113.8	S307 L316 G321 C334	S307-C318 VanDerWaalsContact CB-O 3.25Å; S307-C318 WeakPolarHBondContact CB-O 3.06Å; L316-C318 PolarHBondContact O-N 2.79Å; C318-G321 WeakPolarHBondContact CB-O 3.09Å; C318-C334 VanDerWaalsContact CA-SG 3.51Å; C318-C334 HydrophobicContact CB-CB 3.55Å; C318-C334 WeakPolarHBondContact CB-SG 3.47Å; C318-C334 WeakPolarHBondContact SG-CA 3.39Å; C318-C334 WeakPolarHBondContact SG-CB 3.33Å; C318-C334 CovalentContact SG-SG 2.04Å; C318-C334 PolarHBondContact SG-SG 2.75Å
319	S	62.9	Low	60.3	Low	48 Å²	48	65.4 Å²	65.4	34%	0.336	35%	0.345	S	S	.	.	S	Bend	trans	-74.9	-41.9	-174.6	178.6	0	0	0	0	114.4	S347	S319-S347 WeakPolarHBondContact CB-O 3.29Å
320	F	62.3	Low	59.8	Low	57 Å²	57	68.6 Å²	68.6	25%	0.25	37%	0.368	C	S	.	.	S	Bend	trans	-113.2	-22.8	177.9	-103.3	-134	0	0	0	112.8	I255 F258 V335 N337	I255-F320 HydrophobicContact CD1-CB 4Å; I255-F320 HydrophobicContact CD1-CD1 3.49Å; I255-F320 VanDerWaalsContact CD1-CD1 3.49Å; I255-F320 HydrophobicContact CD1-CE1 4.15Å; I255-F320 HydrophobicContact CD1-CG 3.9Å; I255-F320 WeakPolarHBondContact CD1-O 3.35Å; I255-F320 HydrophobicContact CG2-CD1 4.28Å; F258-F320 HydrophobicContact CE2-CD1 4.47Å; F258-F320 HydrophobicContact CE2-CE1 4.22Å; F258-F320 HydrophobicContact CZ-CE1 4.37Å; F320-V335 HydrophobicContact CB-CB 3.99Å; F320-V335 HydrophobicContact CB-CG1 3.78Å; F320-V335 PolarHBondContact N-O 2.71Å; F320-N337 HydrophobicContact CD2-CB 3.83Å; F320-N337 HydrophobicContact CE2-CB 3.55Å; F320-N337 HydrophobicContact CZ-CB 4.19Å
321	G	69.1	Low	59.6	Low	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.8	-169.1	-174.6	0	0	0	0	0	111.8	M305 C318 V335	M305-G321 CarbonylContact O-C 3.54Å; M305-G321 WeakPolarHBondContact O-CA 3.08Å; C318-G321 WeakPolarHBondContact CB-O 3.09Å; G321-V335 PolarHBondContact O-N 3.32Å
322	C	69.9	Low	59.5	Low	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	155.8	177.6	58.1	0	0	0	0	112.7	V304 M305 C310 V332 L333	V304-C322 WeakPolarHBondContact CA-O 3.49Å; M305-C322 PolarHBondContact N-O 2.84Å; M305-C322 PolarHBondContact O-N 2.72Å; C310-C322 VanDerWaalsContact CA-SG 3.56Å; C310-C322 HydrophobicContact CB-CB 3.95Å; C310-C322 WeakPolarHBondContact CB-SG 3.42Å; C310-C322 VanDerWaalsContact SG-CA 3.58Å; C310-C322 WeakPolarHBondContact SG-CB 3.38Å; C310-C322 PolarHBondContact SG-N 2.94Å; C310-C322 CovalentContact SG-SG 2.03Å; C310-C322 PolarHBondContact SG-SG 2.79Å; C322-V332 HydrophobicContact CB-CG1 3.73Å; C322-L333 CarbonylContact C-O 3.45Å; C322-L333 WeakPolarHBondContact CA-O 3.45Å; C322-L333 WeakPolarHBondContact CB-O 3Å
323	V	67.6	Low	59.5	Low	19 Å²	19	63 Å²	63	12%	0.115	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.3	-178.3	-176.3	0	0	0	0	109	N303 V304 N325 V332 L333 V335	N303-V323 VanDerWaalsContact O-CA 3.32Å; N303-V323 WeakPolarHBondContact O-CA 3.12Å; N303-V323 WeakPolarHBondContact O-CG2 3.15Å; V304-V323 HydrophobicContact CG2-CG2 4.11Å; V323-N325 PolarHBondContact O-N 2.96Å; V323-V332 WeakPolarHBondContact O-CA 3.14Å; V323-L333 PolarHBondContact N-O 3.42Å; V323-L333 PolarHBondContact O-N 3.09Å; V323-V335 HydrophobicContact CG2-CG2 3.74Å
324	K	63	Low	59.8	Low	88 Å²	88	58.6 Å²	58.6	38%	0.383	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	101.9	172.1	-170.2	-176.1	-173.3	-167.3	0	110	M305 W314 G326 V332	M305-K324 HydrophobicContact CE-CB 4.43Å; W314-K324 HydrophobicContact CZ2-CD 4.09Å; K324-G326 WeakPolarHBondContact CE-O 3Å; K324-G326 PolarHBondContact O-N 3.09Å; K324-V332 HydrophobicContact CB-CG2 4.34Å; K324-V332 HydrophobicContact CG-CG2 4.09Å
325	N	56.5	Low	59.6	Low	104 Å²	104	57.5 Å²	57.5	56%	0.556	33%	0.329	S	S	*	.			trans	-96	37.6	-175.2	-167.5	31.4	0	0	0	112.9	V323 D331 L333	V323-N325 PolarHBondContact O-N 2.96Å; N325-D331 WeakPolarHBondContact CA-O 3.18Å; N325-D331 WeakPolarHBondContact CB-O 3.17Å; N325-D331 PolarHBondContact N-O 3.07Å; N325-L333 HydrophobicContact CB-CD1 4.18Å
326	G	52.3	Low	59.2	Low	39 Å²	39	56.1 Å²	56.1	40%	0.402	33%	0.325	S	S	.	.	S	Bend	trans	166.9	-167.4	-177.6	0	0	0	0	0	114.4	K324 D331	K324-G326 WeakPolarHBondContact CE-O 3Å; K324-G326 PolarHBondContact O-N 3.09Å; G326-D331 VanDerWaalsContact CA-OD2 3.32Å; G326-D331 WeakPolarHBondContact CA-OD2 3.32Å
327	S	47.3	Very low	58.7	Low	112 Å²	112	57.8 Å²	57.8	78%	0.783	33%	0.334	S	S	*	.	S	Bend	trans	-102.4	-17.8	-176.5	53.9	0	0	0	0	113.9	D331	S327-D331 PolarHBondContact N-OD2 3.5Å; S327-D331 VanDerWaalsContact N-OD2 3.09Å
328	K	48.5	Very low	57.7	Low	110 Å²	110	54.9 Å²	54.9	48%	0.478	33%	0.328	S	S	.	.	S	Bend	trans	-86.1	162.8	176	-59.7	-179.9	174	-172.6	0	111.5	S330 D331	K328-S330 VanDerWaalsContact CB-OG 3.24Å; K328-S330 WeakPolarHBondContact CB-OG 3.33Å; K328-S330 PolarHBondContact O-N 2.88Å; K328-D331 WeakPolarHBondContact CB-OD2 3.44Å; K328-D331 PolarHBondContact N-OD2 3.09Å; K328-D331 PolarHBondContact O-N 2.89Å
329	P	46.2	Very low	56.7	Low	102 Å²	102	65.3 Å²	65.3	66%	0.662	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-65	-25.5	170.1	-21.8	34.4	0	0	0	113.9	D331	P329-D331 PolarHBondContact O-N 2.63Å
330	S	51.2	Low	55.6	Low	81 Å²	81	66.5 Å²	66.5	57%	0.566	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-66.5	-11.3	178.4	47.9	0	0	0	0	115	K328 V332	K328-S330 VanDerWaalsContact CB-OG 3.24Å; K328-S330 WeakPolarHBondContact CB-OG 3.33Å; K328-S330 PolarHBondContact O-N 2.88Å; S330-V332 VanDerWaalsContact C-N 3.31Å; S330-V332 PolarHBondContact O-N 3.1Å
331	D	59.8	Low	54.4	Low	43 Å²	43	71.3 Å²	71.3	23%	0.23	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-97	21.9	-162.3	-50.1	-15.6	0	0	0	111.6	N325 G326 S327 K328 P329	N325-D331 WeakPolarHBondContact CA-O 3.18Å; N325-D331 WeakPolarHBondContact CB-O 3.17Å; N325-D331 PolarHBondContact N-O 3.07Å; G326-D331 VanDerWaalsContact CA-OD2 3.32Å; G326-D331 WeakPolarHBondContact CA-OD2 3.32Å; S327-D331 PolarHBondContact N-OD2 3.5Å; S327-D331 VanDerWaalsContact N-OD2 3.09Å; K328-D331 WeakPolarHBondContact CB-OD2 3.44Å; K328-D331 PolarHBondContact N-OD2 3.09Å; K328-D331 PolarHBondContact O-N 2.89Å; P329-D331 PolarHBondContact O-N 2.63Å
332	V	60.8	Low	52.8	Low	14 Å²	14	80 Å²	80	9%	0.085	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.3	-168.9	-174	0	0	0	0	111.6	W314 L316 C322 V323 K324 S330	W314-V332 HydrophobicContact CD2-CG1 4.18Å; W314-V332 HydrophobicContact CD2-CG2 3.86Å; W314-V332 HydrophobicContact CE3-CG1 4.09Å; W314-V332 HydrophobicContact CE3-CG2 4.45Å; W314-V332 HydrophobicContact CG-CG1 4.45Å; W314-V332 HydrophobicContact CG-CG2 4.01Å; W314-V332 HydrophobicContact CZ2-CG2 4.4Å; L316-V332 HydrophobicContact CD1-CB 3.8Å; L316-V332 HydrophobicContact CD1-CG1 3.49Å; L316-V332 VanDerWaalsContact CD1-CG1 3.49Å; C322-V332 HydrophobicContact CB-CG1 3.73Å; V323-V332 WeakPolarHBondContact O-CA 3.14Å; K324-V332 HydrophobicContact CB-CG2 4.34Å; K324-V332 HydrophobicContact CG-CG2 4.09Å; S330-V332 VanDerWaalsContact C-N 3.31Å; S330-V332 PolarHBondContact O-N 3.1Å
333	L	61.1	Low	51.1	Low	82 Å²	82	86.9 Å²	86.9	43%	0.429	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.3	-173.8	-66.6	167.3	0	0	0	111.6	L281 C322 V323 N325	L281-L333 HydrophobicContact CD2-CD1 4.26Å; C322-L333 CarbonylContact C-O 3.45Å; C322-L333 WeakPolarHBondContact CA-O 3.45Å; C322-L333 WeakPolarHBondContact CB-O 3Å; V323-L333 PolarHBondContact N-O 3.42Å; V323-L333 PolarHBondContact O-N 3.09Å; N325-L333 HydrophobicContact CB-CD1 4.18Å
334	C	65	Low	49.6	Very low	33 Å²	33	94.3 Å²	94.3	22%	0.223	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	140.9	173.3	-74.9	0	0	0	0	113.1	C318	C318-C334 VanDerWaalsContact CA-SG 3.51Å; C318-C334 HydrophobicContact CB-CB 3.55Å; C318-C334 WeakPolarHBondContact CB-SG 3.47Å; C318-C334 WeakPolarHBondContact SG-CA 3.39Å; C318-C334 WeakPolarHBondContact SG-CB 3.33Å; C318-C334 CovalentContact SG-SG 2.04Å; C318-C334 PolarHBondContact SG-SG 2.75Å
335	V	60.3	Low	48.4	Very low	33 Å²	33	98.4 Å²	98.4	20%	0.2	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	137.4	170.6	-173.6	0	0	0	0	110	V304 F320 G321 V323	V304-V335 HydrophobicContact CG1-CB 4.44Å; V304-V335 HydrophobicContact CG1-CG2 3.87Å; V304-V335 HydrophobicContact CG2-CG2 4.1Å; F320-V335 HydrophobicContact CB-CB 3.99Å; F320-V335 HydrophobicContact CB-CG1 3.78Å; F320-V335 PolarHBondContact N-O 2.71Å; G321-V335 PolarHBondContact O-N 3.32Å; V323-V335 HydrophobicContact CG2-CG2 3.74Å
336	C	53.6	Low	47.5	Very low	55 Å²	55	98.4 Å²	98.4	37%	0.372	54%	0.544	S	S	.	.			trans	-117.3	151.3	-174.3	-74	0	0	0	0	112.5	C348	C336-C348 HydrophobicContact CB-CB 4.47Å; C336-C348 WeakPolarHBondContact CB-SG 3.33Å; C336-C348 WeakPolarHBondContact SG-CB 3.34Å; C336-C348 CovalentContact SG-SG 2.03Å; C336-C348 PolarHBondContact SG-SG 2.92Å
337	N	47.6	Very low	47	Very low	39 Å²	39	99.6 Å²	99.6	21%	0.209	55%	0.547	C	S	.	.			trans	-84.9	123.7	173.6	-173	-1.7	0	0	0	110.8	F320 W339 T340	F320-N337 HydrophobicContact CD2-CB 3.83Å; F320-N337 HydrophobicContact CE2-CB 3.55Å; F320-N337 HydrophobicContact CZ-CB 4.19Å; N337-W339 PolarHBondContact O-N 2.59Å; N337-W339 WeakPolarHBondContact OD1-CB 3.34Å; N337-W339 PolarHBondContact OD1-N 2.89Å; N337-T340 HydrophobicContact CB-CG2 4.49Å; N337-T340 PolarHBondContact O-OG1 3.48Å
338	P	44.7	Very low	46.7	Very low	85 Å²	85	96.9 Å²	96.9	55%	0.552	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-11.1	174.9	25.6	-31	0	0	0	114.3
339	W	40.8	Very low	46.6	Very low	228 Å²	228	95.4 Å²	95.4	86%	0.864	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	4.2	-172.9	-66.1	82.8	0	0	0	115.8	N337	N337-W339 PolarHBondContact O-N 2.59Å; N337-W339 WeakPolarHBondContact OD1-CB 3.34Å; N337-W339 PolarHBondContact OD1-N 2.89Å
340	T	41	Very low	46.5	Very low	72 Å²	72	94.1 Å²	94.1	44%	0.442	52%	0.52	S	S	.	.			trans	-100.8	11.6	-174.6	40.4	0	0	0	0	115.5	N337 Q342	N337-T340 HydrophobicContact CB-CG2 4.49Å; N337-T340 PolarHBondContact O-OG1 3.48Å; T340-Q342 VanDerWaalsContact C-N 3.29Å; T340-Q342 PolarHBondContact O-N 2.86Å
341	L	36.9	Very low	46.1	Very low	159 Å²	159	92.7 Å²	92.7	83%	0.832	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	53.6	-177	-71.4	164.7	0	0	0	114.1
342	Q	35.7	Very low	45.2	Very low	182 Å²	182	96 Å²	96	85%	0.85	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	-4.7	175.7	-103.7	-170.4	3	0	0	116.1	T340	T340-Q342 VanDerWaalsContact C-N 3.29Å; T340-Q342 PolarHBondContact O-N 2.86Å
343	N	34	Very low	44.1	Very low	145 Å²	145	99.8 Å²	99.8	78%	0.775	55%	0.545	S	S	*	.	S	Bend	trans	-142.6	154.1	163.9	-82.6	-60.4	0	0	0	109.2	E345	N343-E345 PolarHBondContact O-N 3.01Å
344	N	36.4	Very low	43.1	Very low	175 Å²	175	102.9 Å²	102.9	94%	0.936	56%	0.562	S	S	*	*	S	Bend	trans	-83.9	41.4	-161.9	-149.5	21.9	0	0	0	114.2
345	E	37.3	Very low	42.1	Very low	174 Å²	174	108 Å²	108	81%	0.813	59%	0.586	S	S	*	*			trans	-114.2	114.5	178.7	-67.5	-173	164.3	0	0	110.3	N343 S347	N343-E345 PolarHBondContact O-N 3.01Å; E345-S347 PolarHBondContact O-N 3.38Å
346	S	36.9	Very low	41.2	Very low	104 Å²	104	112.1 Å²	112.1	73%	0.727	60%	0.601	S	S	*	*			trans	-76	90.1	-175.3	44.1	0	0	0	0	112.1	C348	S346-C348 PolarHBondContact O-N 3.22Å
347	S	40.9	Very low	41.1	Very low	64 Å²	64	118.7 Å²	118.7	45%	0.448	62%	0.623	S	S	.	*			trans	-70.8	32.5	176.7	72.9	0	0	0	0	114.5	S319 E345	S319-S347 WeakPolarHBondContact CB-O 3.29Å; E345-S347 PolarHBondContact O-N 3.38Å
348	C	41.5	Very low	41.6	Very low	54 Å²	54	119.1 Å²	119.1	37%	0.365	63%	0.629	S	S	.	*			trans	-141.6	77.3	-171	-77.1	0	0	0	0	109.7	C336 S346	C336-C348 HydrophobicContact CB-CB 4.47Å; C336-C348 WeakPolarHBondContact CB-SG 3.33Å; C336-C348 WeakPolarHBondContact SG-CB 3.34Å; C336-C348 CovalentContact SG-SG 2.03Å; C336-C348 PolarHBondContact SG-SG 2.92Å; S346-C348 PolarHBondContact O-N 3.22Å
349	V	46.4	Very low	42.5	Very low	79 Å²	79	116.2 Å²	116.2	48%	0.479	61%	0.61	S	S	.	*			trans	-121.6	110.9	-178.6	-167.2	0	0	0	0	109.9	V351	V349-V351 HydrophobicContact CB-CG2 4.22Å; V349-V351 HydrophobicContact CG1-CG2 3.8Å; V349-V351 PolarHBondContact O-N 2.03Å
350	S	43.6	Very low	43.5	Very low	75 Å²	75	113.4 Å²	113.4	52%	0.524	61%	0.611	S	S	.	*			trans	-72	103.2	162.1	50.6	0	0	0	0	108.6	D352	S350-D352 PolarHBondContact O-N 2.93Å
351	V	43.3	Very low	44.4	Very low	51 Å²	51	111.6 Å²	111.6	31%	0.309	61%	0.606	S	S	.	*			trans	-95.6	85.5	179.2	-159.2	0	0	0	0	109.5	V349 L353	V349-V351 HydrophobicContact CB-CG2 4.22Å; V349-V351 HydrophobicContact CG1-CG2 3.8Å; V349-V351 PolarHBondContact O-N 2.03Å; V351-L353 HydrophobicContact CG1-CD1 3.91Å; V351-L353 HydrophobicContact CG1-CG 3.9Å; V351-L353 PolarHBondContact O-N 2.88Å; V351-L353 VanDerWaalsContact O-N 3.12Å
352	D	41.7	Very low	46	Very low	112 Å²	112	104 Å²	104	60%	0.599	57%	0.567	S	S	*	*			trans	-63.7	109.3	169.2	-82.1	-43.2	0	0	0	110	S350	S350-D352 PolarHBondContact O-N 2.93Å
353	L	36.7	Very low	46.7	Very low	94 Å²	94	102 Å²	102	49%	0.492	56%	0.562	S	S	.	*			trans	-122.3	80	178.1	-80.2	168.5	0	0	0	110.9	V351	V351-L353 HydrophobicContact CG1-CD1 3.91Å; V351-L353 HydrophobicContact CG1-CG 3.9Å; V351-L353 PolarHBondContact O-N 2.88Å; V351-L353 VanDerWaalsContact O-N 3.12Å
354	D	40.6	Very low	48	Very low	148 Å²	148	97.8 Å²	97.8	79%	0.791	55%	0.553	S	S	*	*	S	Bend	trans	-169	-5.2	151.7	-114.8	-17.3	0	0	0	116.7
355	I	44.4	Very low	49.7	Very low	141 Å²	141	93.1 Å²	93.1	72%	0.723	52%	0.522	S	S	*	.	S	Bend	trans	-81.7	-18.9	-167.7	-65	178.9	0	0	0	114.6
356	F	42	Very low	51.4	Low	118 Å²	118	84.9 Å²	84.9	52%	0.518	48%	0.484	S	S	.	.	S	Bend	trans	-129.7	114.1	172.5	-70.9	-78.2	0	0	0	111.9	C358	F356-C358 PolarHBondContact O-N 2.03Å
357	K	51.6	Low	53.3	Low	194 Å²	194	85.2 Å²	85.2	84%	0.843	47%	0.474	S	S	*	.			trans	-72.5	109.5	177.6	-74.9	-171.9	174.9	-177.3	0	111.6
358	C	57.2	Low	54.8	Low	48 Å²	48	82.8 Å²	82.8	32%	0.324	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-58.8	139.2	165.7	-51.7	0	0	0	0	110.8	F356 C368	F356-C358 PolarHBondContact O-N 2.03Å; C358-C368 HydrophobicContact CB-CB 3.76Å; C358-C368 WeakPolarHBondContact CB-SG 3.49Å; C358-C368 WeakPolarHBondContact SG-CB 3.3Å; C358-C368 CovalentContact SG-SG 2.02Å; C358-C368 PolarHBondContact SG-SG 3.46Å
359	P	63.2	Low	56	Low	23 Å²	23	81.8 Å²	81.8	15%	0.149	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-62.9	143.9	175.8	23.1	-32.7	0	0	0	112.8	G361 C362 H384	P359-G361 PolarHBondContact O-N 3.42Å; P359-C362 WeakPolarHBondContact O-CB 3.41Å; P359-C362 PolarHBondContact O-N 2.82Å; P359-C362 VanDerWaalsContact O-N 3.16Å; P359-H384 WeakPolarHBondContact CG-O 3.42Å
360	L	62	Low	56.1	Low	170 Å²	170	81 Å²	81	89%	0.89	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	125.5	178.9	-75	165.4	0	0	0	110.9	S385	L360-S385 WeakPolarHBondContact O-CB 3.23Å
361	G	60.9	Low	56.4	Low	33 Å²	33	85.9 Å²	85.9	34%	0.34	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.8	-20.9	-174.3	0	0	0	0	0	113.8	P359 R365 S385	P359-G361 PolarHBondContact O-N 3.42Å; G361-R365 WeakPolarHBondContact O-CB 3.44Å; G361-S385 CarbonylContact C-O 3.16Å; G361-S385 VanDerWaalsContact C-O 3.29Å
362	C	70	Confident	57.6	Low	0 Å²	0	87.3 Å²	87.3	0%	0	47%	0.465	C	S	.	.			trans	-63.9	-50.6	-178.9	-174.1	0	0	0	0	113.1	P359 G364 R365 G366 C375 S385	P359-C362 WeakPolarHBondContact O-CB 3.41Å; P359-C362 PolarHBondContact O-N 2.82Å; P359-C362 VanDerWaalsContact O-N 3.16Å; C362-G364 PolarHBondContact O-N 2.96Å; C362-R365 CarbonylContact O-C 3.55Å; C362-R365 PolarHBondContact O-N 2.84Å; C362-G366 PolarHBondContact O-N 3.04Å; C362-G366 VanDerWaalsContact O-O 3.06Å; C362-C375 HydrophobicContact CB-CB 4.08Å; C362-C375 WeakPolarHBondContact CB-SG 3.46Å; C362-C375 WeakPolarHBondContact SG-CB 3.34Å; C362-C375 CovalentContact SG-SG 2.02Å; C362-C375 PolarHBondContact SG-SG 3.06Å; C362-S385 PolarHBondContact N-O 3.06Å
363	N	50.8	Low	58.6	Low	140 Å²	140	82.4 Å²	82.4	75%	0.749	44%	0.441	S	S	*	.	B	Isolated β-bridge	trans	-66.3	105.9	173.3	-75.2	-6.5	0	0	0	109.7
364	G	61.5	Low	60.3	Low	57 Å²	57	83.6 Å²	83.6	59%	0.588	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.8	-16.7	-173.8	0	0	0	0	0	114.2	C362	C362-G364 PolarHBondContact O-N 2.96Å
365	R	70.4	Confident	61.9	Low	76 Å²	76	77.2 Å²	77.2	29%	0.287	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-0.8	-179.9	-58.5	-179.3	174.4	173.8	-4.5	113.8	G361 C362 Y378 F381 C386 N400	G361-R365 WeakPolarHBondContact O-CB 3.44Å; C362-R365 CarbonylContact O-C 3.55Å; C362-R365 PolarHBondContact O-N 2.84Å; R365-Y378 PolarHBondContact O-N 2.73Å; R365-F381 HydrophobicContact CB-CD1 3.77Å; R365-F381 HydrophobicContact CB-CD2 3.99Å; R365-F381 HydrophobicContact CB-CE1 3.88Å; R365-F381 HydrophobicContact CB-CE2 4.07Å; R365-F381 HydrophobicContact CB-CG 3.83Å; R365-F381 HydrophobicContact CB-CZ 4.03Å; R365-F381 HydrophobicContact CG-CD1 3.96Å; R365-F381 HydrophobicContact CG-CE1 3.55Å; R365-F381 HydrophobicContact CG-CE2 4.17Å; R365-F381 HydrophobicContact CG-CG 4.43Å; R365-F381 HydrophobicContact CG-CZ 3.67Å; R365-F381 WeakPolarHBondContact O-CD2 3.47Å; R365-C386 HydrophobicContact CB-CB 3.6Å; R365-C386 WeakPolarHBondContact CB-O 3.49Å; R365-C386 WeakPolarHBondContact CD-O 3.41Å; R365-C386 WeakPolarHBondContact O-CB 3.06Å; R365-N400 PolarHBondContact NE-OD1 3.43Å; R365-N400 PolarHBondContact NH2-OD1 3.34Å
366	G	73.3	Confident	63.5	Low	2 Å²	2	75.6 Å²	75.6	2%	0.021	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-177.8	171.2	0	0	0	0	0	112.6	C362 F376 Y378	C362-G366 PolarHBondContact O-N 3.04Å; C362-G366 VanDerWaalsContact O-O 3.06Å; G366-F376 CarbonylContact C-O 3.54Å; G366-F376 VanDerWaalsContact CA-O 3.28Å; G366-F376 WeakPolarHBondContact CA-O 3.02Å; G366-Y378 VanDerWaalsContact N-CD2 3.34Å
367	H	78	Confident	65.1	Low	111 Å²	111	71.9 Å²	71.9	51%	0.514	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.7	166	175.5	67.1	0	0	0	109.1	F376	H367-F376 PolarHBondContact N-O 3.14Å; H367-F376 WeakPolarHBondContact O-CB 3.48Å; H367-F376 PolarHBondContact O-N 2.85Å
368	C	71.4	Confident	66	Low	12 Å²	12	66.8 Å²	66.8	8%	0.081	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.9	170.9	-173.4	0	0	0	0	110.5	C358 P370	C358-C368 HydrophobicContact CB-CB 3.76Å; C358-C368 WeakPolarHBondContact CB-SG 3.49Å; C358-C368 WeakPolarHBondContact SG-CB 3.3Å; C358-C368 CovalentContact SG-SG 2.02Å; C358-C368 PolarHBondContact SG-SG 3.46Å; C368-P370 VanDerWaalsContact O-CD 3.3Å; C368-P370 WeakPolarHBondContact O-CD 3.31Å
369	D	66.3	Low	66.3	Low	34 Å²	34	68 Å²	68	18%	0.182	37%	0.368	C	S	.	.			trans	-76.7	111.2	169	179.9	-4	0	0	0	110.5	K371 T372 G373 K374 F376	D369-K371 PolarHBondContact O-N 2.88Å; D369-K371 VanDerWaalsContact O-N 3.16Å; D369-K371 WeakPolarHBondContact OD1-CA 3.32Å; D369-K371 WeakPolarHBondContact OD1-CB 3.5Å; D369-K371 PolarHBondContact OD1-N 3.32Å; D369-T372 WeakPolarHBondContact CB-OG1 3.28Å; D369-T372 PolarHBondContact O-N 3.04Å; D369-T372 PolarHBondContact OD1-N 2.83Å; D369-T372 WeakPolarHBondContact OD2-CB 3.01Å; D369-T372 VanDerWaalsContact OD2-CG2 3.25Å; D369-T372 WeakPolarHBondContact OD2-CG2 3.01Å; D369-T372 PolarHBondContact OD2-OG1 3.15Å; D369-G373 WeakPolarHBondContact O-CA 3.3Å; D369-G373 PolarHBondContact O-N 3.08Å; D369-K374 WeakPolarHBondContact CB-O 3.29Å; D369-K374 PolarHBondContact N-O 3.35Å; D369-F376 HydrophobicContact CB-CD2 4.21Å; D369-F376 HydrophobicContact CB-CE2 3.84Å
370	P	49.9	Very low	66.1	Low	61 Å²	61	67.2 Å²	67.2	40%	0.396	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16	-179.8	29.2	-35.5	0	0	0	113.1	C368	C368-P370 VanDerWaalsContact O-CD 3.3Å; C368-P370 WeakPolarHBondContact O-CD 3.31Å
371	K	50.1	Low	66.5	Low	178 Å²	178	59.7 Å²	59.7	77%	0.774	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-17.1	178.8	-62.3	-171.5	176.4	-173.1	0	113.9	D369	D369-K371 PolarHBondContact O-N 2.88Å; D369-K371 VanDerWaalsContact O-N 3.16Å; D369-K371 WeakPolarHBondContact OD1-CA 3.32Å; D369-K371 WeakPolarHBondContact OD1-CB 3.5Å; D369-K371 PolarHBondContact OD1-N 3.32Å
372	T	67.8	Low	66.9	Low	81 Å²	81	63.9 Å²	63.9	50%	0.497	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-6.4	-178.9	68.4	0	0	0	0	115	D369 K374	D369-T372 WeakPolarHBondContact CB-OG1 3.28Å; D369-T372 PolarHBondContact O-N 3.04Å; D369-T372 PolarHBondContact OD1-N 2.83Å; D369-T372 WeakPolarHBondContact OD2-CB 3.01Å; D369-T372 VanDerWaalsContact OD2-CG2 3.25Å; D369-T372 WeakPolarHBondContact OD2-CG2 3.01Å; D369-T372 PolarHBondContact OD2-OG1 3.15Å; T372-K374 PolarHBondContact O-N 2.8Å; T372-K374 VanDerWaalsContact O-N 3.15Å; T372-K374 VanDerWaalsContact OG1-CB 3.27Å; T372-K374 WeakPolarHBondContact OG1-CB 3.34Å
373	G	62.9	Low	67	Low	10 Å²	10	66.5 Å²	66.5	10%	0.103	36%	0.361	C	S	.	.			trans	65.8	9	-174.7	0	0	0	0	0	113.8	D369	D369-G373 WeakPolarHBondContact O-CA 3.3Å; D369-G373 PolarHBondContact O-N 3.08Å
374	K	71.2	Confident	68	Low	118 Å²	118	66.2 Å²	66.2	51%	0.513	35%	0.354	S	S	.	.			trans	-89.5	133.2	-175.7	-174.1	-175.3	177	-174	0	110.4	D369 T372	D369-K374 WeakPolarHBondContact CB-O 3.29Å; D369-K374 PolarHBondContact N-O 3.35Å; T372-K374 PolarHBondContact O-N 2.8Å; T372-K374 VanDerWaalsContact O-N 3.15Å; T372-K374 VanDerWaalsContact OG1-CB 3.27Å; T372-K374 WeakPolarHBondContact OG1-CB 3.34Å
375	C	74.1	Confident	68.4	Low	14 Å²	14	65 Å²	65	10%	0.095	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.6	174.3	-67.7	0	0	0	0	111.7	C362 C377	C362-C375 HydrophobicContact CB-CB 4.08Å; C362-C375 WeakPolarHBondContact CB-SG 3.46Å; C362-C375 WeakPolarHBondContact SG-CB 3.34Å; C362-C375 CovalentContact SG-SG 2.02Å; C362-C375 PolarHBondContact SG-SG 3.06Å; C375-C377 PolarHBondContact O-N 3.3Å
376	F	79.1	Confident	68.5	Low	107 Å²	107	61.3 Å²	61.3	47%	0.469	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	89.3	164.4	-66.8	-72.7	0	0	0	107.8	G366 H367 D369	G366-F376 CarbonylContact C-O 3.54Å; G366-F376 VanDerWaalsContact CA-O 3.28Å; G366-F376 WeakPolarHBondContact CA-O 3.02Å; H367-F376 PolarHBondContact N-O 3.14Å; H367-F376 WeakPolarHBondContact O-CB 3.48Å; H367-F376 PolarHBondContact O-N 2.85Å; D369-F376 HydrophobicContact CB-CD2 4.21Å; D369-F376 HydrophobicContact CB-CE2 3.84Å
377	C	76.2	Confident	68.2	Low	40 Å²	40	66.5 Å²	66.5	27%	0.27	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	142	-176.8	-59	0	0	0	0	112.6	C375 F381 C386	C375-C377 PolarHBondContact O-N 3.3Å; C377-F381 HydrophobicContact CB-CB 3.85Å; C377-F381 VanDerWaalsContact CB-O 3.25Å; C377-F381 WeakPolarHBondContact CB-O 3.42Å; C377-C386 WeakPolarHBondContact CA-SG 2.96Å; C377-C386 HydrophobicContact CB-CB 3.84Å; C377-C386 WeakPolarHBondContact CB-SG 3.49Å; C377-C386 WeakPolarHBondContact SG-CA 2.97Å; C377-C386 WeakPolarHBondContact SG-CB 3.34Å; C377-C386 CovalentContact SG-SG 2.05Å; C377-C386 PolarHBondContact SG-SG 2.73Å
378	Y	68.8	Low	67.3	Low	88 Å²	88	65.2 Å²	65.2	35%	0.345	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-66.1	158.1	171.1	-65	-45.6	0	0	0	109.7	R365 G366 G380 F381	R365-Y378 PolarHBondContact O-N 2.73Å; G366-Y378 VanDerWaalsContact N-CD2 3.34Å; Y378-G380 PolarHBondContact O-N 3.49Å; Y378-F381 PolarHBondContact O-N 2.88Å; Y378-F381 VanDerWaalsContact O-N 3.1Å
379	P	63.6	Low	66.7	Low	73 Å²	73	68.3 Å²	68.3	47%	0.474	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	126.8	176	-26.7	35.8	0	0	0	111.4	P393 L396	P379-P393 HydrophobicContact CB-CG 3.44Å; P379-P393 VanDerWaalsContact CB-CG 3.44Å; P379-P393 WeakPolarHBondContact O-CD 3.22Å; P379-L396 HydrophobicContact CB-CD1 4.25Å; P379-L396 WeakPolarHBondContact O-CD1 3.36Å
380	G	59.7	Low	66.5	Low	7 Å²	7	74.4 Å²	74.4	7%	0.072	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	-1.1	-177	0	0	0	0	0	115.7	Y378 E389	Y378-G380 PolarHBondContact O-N 3.49Å; G380-E389 PolarHBondContact O-N 2.84Å
381	F	71.4	Confident	67.2	Low	11 Å²	11	77.7 Å²	77.7	5%	0.048	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	140.2	177.4	-63.2	-78.8	0	0	0	112	R365 C377 Y378 C386 E387 L388 N400 C401	R365-F381 HydrophobicContact CB-CD1 3.77Å; R365-F381 HydrophobicContact CB-CD2 3.99Å; R365-F381 HydrophobicContact CB-CE1 3.88Å; R365-F381 HydrophobicContact CB-CE2 4.07Å; R365-F381 HydrophobicContact CB-CG 3.83Å; R365-F381 HydrophobicContact CB-CZ 4.03Å; R365-F381 HydrophobicContact CG-CD1 3.96Å; R365-F381 HydrophobicContact CG-CE1 3.55Å; R365-F381 HydrophobicContact CG-CE2 4.17Å; R365-F381 HydrophobicContact CG-CG 4.43Å; R365-F381 HydrophobicContact CG-CZ 3.67Å; R365-F381 WeakPolarHBondContact O-CD2 3.47Å; C377-F381 HydrophobicContact CB-CB 3.85Å; C377-F381 VanDerWaalsContact CB-O 3.25Å; C377-F381 WeakPolarHBondContact CB-O 3.42Å; Y378-F381 PolarHBondContact O-N 2.88Å; Y378-F381 VanDerWaalsContact O-N 3.1Å; F381-C386 HydrophobicContact CB-CB 3.82Å; F381-C386 VanDerWaalsContact CD1-O 3.26Å; F381-C386 WeakPolarHBondContact CD1-O 3.37Å; F381-C386 HydrophobicContact CG-CB 4.42Å; F381-E387 CarbonylContact C-O 3.49Å; F381-E387 VanDerWaalsContact CA-O 3.28Å; F381-E387 WeakPolarHBondContact CA-O 3.43Å; F381-L388 HydrophobicContact CD1-CB 4.25Å; F381-L388 HydrophobicContact CD1-CD1 4.32Å; F381-L388 HydrophobicContact CE1-CB 3.97Å; F381-L388 HydrophobicContact CE1-CD1 3.44Å; F381-L388 VanDerWaalsContact CE1-CD1 3.44Å; F381-L388 HydrophobicContact CE1-CG 4.24Å; F381-L388 HydrophobicContact CZ-CD1 3.76Å; F381-N400 HydrophobicContact CZ-CB 4.42Å; F381-N400 VanDerWaalsContact CZ-O 3.23Å; F381-N400 WeakPolarHBondContact CZ-O 3.49Å; F381-C401 HydrophobicContact CE2-CB 3.88Å; F381-C401 HydrophobicContact CZ-CB 4.18Å
382	K	69.1	Low	67.8	Low	122 Å²	122	71.2 Å²	71.2	53%	0.53	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	174.2	-179.7	-75.3	-175.3	178.3	149.9	0	111.5	C386 E387 E389	K382-C386 CarbonylContact O-C 3.18Å; K382-C386 WeakPolarHBondContact O-CA 3.47Å; K382-E387 PolarHBondContact N-O 3.06Å; K382-E387 PolarHBondContact O-N 2.96Å; K382-E389 HydrophobicContact CB-CG 4.36Å; K382-E389 VanDerWaalsContact CD-CD 3.43Å; K382-E389 HydrophobicContact CD-CG 3.87Å; K382-E389 WeakPolarHBondContact CD-OE2 3.35Å; K382-E389 VanDerWaalsContact CE-CD 3.41Å; K382-E389 WeakPolarHBondContact CE-OE1 3.37Å; K382-E389 WeakPolarHBondContact CE-OE2 3.13Å; K382-E389 HydrophobicContact CG-CG 4.02Å; K382-E389 IonicContact NZ-OE1 2.79Å; K382-E389 PolarHBondContact NZ-OE1 3.33Å; K382-E389 IonicContact NZ-OE2 3.18Å; K382-E389 PolarHBondContact NZ-OE2 3.43Å
383	G	71.4	Confident	67.7	Low	55 Å²	55	69.6 Å²	69.6	57%	0.567	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-177.3	-177.4	0	0	0	0	0	113.3
384	H	72.1	Confident	68.1	Low	133 Å²	133	74.8 Å²	74.8	62%	0.616	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-37.6	-172.7	-169.7	49.2	0	0	0	112.3	P359	P359-H384 WeakPolarHBondContact CG-O 3.42Å
385	S	70.2	Confident	68.2	Low	31 Å²	31	69.4 Å²	69.4	22%	0.217	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	5.4	-175.9	-46.8	0	0	0	0	113.9	L360 G361 C362	L360-S385 WeakPolarHBondContact O-CB 3.23Å; G361-S385 CarbonylContact C-O 3.16Å; G361-S385 VanDerWaalsContact C-O 3.29Å; C362-S385 PolarHBondContact N-O 3.06Å
386	C	71.4	Confident	68.3	Low	0 Å²	0	69.1 Å²	69.1	0%	0	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	65.5	-168.4	-57.1	0	0	0	0	111.8	R365 C377 F381 K382	R365-C386 HydrophobicContact CB-CB 3.6Å; R365-C386 WeakPolarHBondContact CB-O 3.49Å; R365-C386 WeakPolarHBondContact CD-O 3.41Å; R365-C386 WeakPolarHBondContact O-CB 3.06Å; C377-C386 WeakPolarHBondContact CA-SG 2.96Å; C377-C386 HydrophobicContact CB-CB 3.84Å; C377-C386 WeakPolarHBondContact CB-SG 3.49Å; C377-C386 WeakPolarHBondContact SG-CA 2.97Å; C377-C386 WeakPolarHBondContact SG-CB 3.34Å; C377-C386 CovalentContact SG-SG 2.05Å; C377-C386 PolarHBondContact SG-SG 2.73Å; F381-C386 HydrophobicContact CB-CB 3.82Å; F381-C386 VanDerWaalsContact CD1-O 3.26Å; F381-C386 WeakPolarHBondContact CD1-O 3.37Å; F381-C386 HydrophobicContact CG-CB 4.42Å; K382-C386 CarbonylContact O-C 3.18Å; K382-C386 WeakPolarHBondContact O-CA 3.47Å
387	E	68.2	Low	68.4	Low	111 Å²	111	67.4 Å²	67.4	52%	0.519	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	144.1	173.3	-71	149.1	-130.2	0	0	110.1	F381 K382 E389	F381-E387 CarbonylContact C-O 3.49Å; F381-E387 VanDerWaalsContact CA-O 3.28Å; F381-E387 WeakPolarHBondContact CA-O 3.43Å; K382-E387 PolarHBondContact N-O 3.06Å; K382-E387 PolarHBondContact O-N 2.96Å; E387-E389 PolarHBondContact O-N 2.02Å
388	L	59.3	Low	68.2	Low	83 Å²	83	67 Å²	67	44%	0.435	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	128.9	-174.2	-167.3	96.8	0	0	0	110.1	F381	F381-L388 HydrophobicContact CD1-CB 4.25Å; F381-L388 HydrophobicContact CD1-CD1 4.32Å; F381-L388 HydrophobicContact CE1-CB 3.97Å; F381-L388 HydrophobicContact CE1-CD1 3.44Å; F381-L388 VanDerWaalsContact CE1-CD1 3.44Å; F381-L388 HydrophobicContact CE1-CG 4.24Å; F381-L388 HydrophobicContact CZ-CD1 3.76Å
389	E	58.8	Low	68.2	Low	77 Å²	77	67.2 Å²	67.2	36%	0.36	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-69.2	153.5	159.5	-71.1	-162.8	91.2	0	0	109.7	G380 K382 E387 N391	G380-E389 PolarHBondContact O-N 2.84Å; K382-E389 HydrophobicContact CB-CG 4.36Å; K382-E389 VanDerWaalsContact CD-CD 3.43Å; K382-E389 HydrophobicContact CD-CG 3.87Å; K382-E389 WeakPolarHBondContact CD-OE2 3.35Å; K382-E389 VanDerWaalsContact CE-CD 3.41Å; K382-E389 WeakPolarHBondContact CE-OE1 3.37Å; K382-E389 WeakPolarHBondContact CE-OE2 3.13Å; K382-E389 HydrophobicContact CG-CG 4.02Å; K382-E389 IonicContact NZ-OE1 2.79Å; K382-E389 PolarHBondContact NZ-OE1 3.33Å; K382-E389 IonicContact NZ-OE2 3.18Å; K382-E389 PolarHBondContact NZ-OE2 3.43Å; E387-E389 PolarHBondContact O-N 2.02Å; E389-N391 PolarHBondContact O-N 3.03Å
390	D	61.4	Low	68.1	Low	163 Å²	163	66.3 Å²	66.3	87%	0.872	39%	0.385	S	S	*	.	S	Bend	trans	-57.3	-7.9	-177.1	-63.6	-60	0	0	0	115
391	N	63.7	Low	68.6	Low	130 Å²	130	66.1 Å²	66.1	70%	0.695	38%	0.383	S	S	*	.	S	Bend	trans	-142.2	133.4	173.3	-58.5	-99.1	0	0	0	110.4	E389	E389-N391 PolarHBondContact O-N 3.03Å
392	C	62.6	Low	68.6	Low	42 Å²	42	68.9 Å²	68.9	28%	0.284	40%	0.396	S	S	.	.			trans	-61.8	143.4	160.9	-61.2	0	0	0	0	109.6	L396 C401	C392-L396 WeakPolarHBondContact CB-O 3.45Å; C392-C401 VanDerWaalsContact CA-SG 3.58Å; C392-C401 HydrophobicContact CB-CB 3.94Å; C392-C401 WeakPolarHBondContact CB-SG 3.06Å; C392-C401 WeakPolarHBondContact SG-CA 3.35Å; C392-C401 WeakPolarHBondContact SG-CB 3.48Å; C392-C401 CovalentContact SG-SG 2.04Å; C392-C401 PolarHBondContact SG-SG 2.8Å
393	P	66.4	Low	69	Low	47 Å²	47	69.1 Å²	69.1	31%	0.305	39%	0.394	S	S	.	.			trans	-75.2	161.3	177.4	31.7	-35.9	0	0	0	111.2	P379 G395 L396	P379-P393 HydrophobicContact CB-CG 3.44Å; P379-P393 VanDerWaalsContact CB-CG 3.44Å; P379-P393 WeakPolarHBondContact O-CD 3.22Å; P393-G395 PolarHBondContact O-N 3.21Å; P393-G395 VanDerWaalsContact O-N 3.08Å; P393-L396 PolarHBondContact O-N 2.9Å; P393-L396 VanDerWaalsContact O-N 3.11Å
394	S	70.6	Confident	69.4	Low	118 Å²	118	68.9 Å²	68.9	83%	0.825	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	114.4	169.9	-51.3	0	0	0	0	110.9
395	G	73.4	Confident	69.8	Low	6 Å²	6	65 Å²	65	6%	0.062	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	123.4	-19.8	-176.5	0	0	0	0	0	114.1	P393 V405	P393-G395 PolarHBondContact O-N 3.21Å; P393-G395 VanDerWaalsContact O-N 3.08Å; G395-V405 WeakPolarHBondContact O-CB 3.42Å; G395-V405 PolarHBondContact O-N 3.11Å
396	L	78	Confident	70.3	Confident	7 Å²	7	66.2 Å²	66.2	4%	0.037	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147	-179	-64.6	173.5	0	0	0	113.4	P379 C392 P393 C401 Y423	P379-L396 HydrophobicContact CB-CD1 4.25Å; P379-L396 WeakPolarHBondContact O-CD1 3.36Å; C392-L396 WeakPolarHBondContact CB-O 3.45Å; P393-L396 PolarHBondContact O-N 2.9Å; P393-L396 VanDerWaalsContact O-N 3.11Å; L396-C401 HydrophobicContact CB-CB 3.85Å; L396-C401 HydrophobicContact CD1-CB 4.1Å; L396-Y423 HydrophobicContact CD2-CD1 4.46Å; L396-Y423 HydrophobicContact CD2-CE1 3.97Å
397	T	79.5	Confident	70.9	Confident	72 Å²	72	67.6 Å²	67.6	44%	0.442	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	175.6	177.8	51.4	0	0	0	0	112.1	C401 E402 Y403 V405	T397-C401 CarbonylContact O-C 3.59Å; T397-C401 VanDerWaalsContact O-C 3.23Å; T397-C401 VanDerWaalsContact O-CA 3.28Å; T397-C401 WeakPolarHBondContact O-CA 3.31Å; T397-E402 PolarHBondContact O-N 2.98Å; T397-Y403 PolarHBondContact N-O 3.31Å; T397-Y403 PolarHBondContact O-N 3.2Å; T397-Y403 PolarHBondContact OG1-O 3.36Å; T397-V405 HydrophobicContact CG2-CG2 3.45Å; T397-V405 VanDerWaalsContact CG2-CG2 3.45Å
398	G	72.9	Confident	71.7	Confident	30 Å²	30	64.2 Å²	64.2	31%	0.309	36%	0.364	S	S	.	.	S	Bend	trans	92.3	167.1	-176	0	0	0	0	0	113.1	N400 C401	G398-N400 PolarHBondContact O-N 2.83Å; G398-C401 PolarHBondContact O-N 3.24Å; G398-C401 VanDerWaalsContact O-N 3.13Å
399	P	68.8	Low	72.6	Confident	94 Å²	94	67.4 Å²	67.4	61%	0.61	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.4	-171.7	27.8	-35	0	0	0	114
400	N	61.7	Low	73	Confident	54 Å²	54	65.7 Å²	65.7	29%	0.289	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	31.7	170.3	-51.8	-86.4	0	0	0	112.2	R365 F381 G398 E402	R365-N400 PolarHBondContact NE-OD1 3.43Å; R365-N400 PolarHBondContact NH2-OD1 3.34Å; F381-N400 HydrophobicContact CZ-CB 4.42Å; F381-N400 VanDerWaalsContact CZ-O 3.23Å; F381-N400 WeakPolarHBondContact CZ-O 3.49Å; G398-N400 PolarHBondContact O-N 2.83Å; N400-E402 HydrophobicContact CB-CB 4.45Å; N400-E402 WeakPolarHBondContact CB-OE2 3.01Å; N400-E402 PolarHBondContact N-OE2 3.5Å; N400-E402 PolarHBondContact ND2-OE2 2.04Å; N400-E402 PolarHBondContact O-N 2.89Å
401	C	69	Low	73	Confident	2 Å²	2	64 Å²	64	1%	0.014	38%	0.379	C	S	.	.	S	Bend	trans	49.7	35.9	-176.6	-44.9	0	0	0	0	112.4	F381 C392 L396 T397 G398 Y423	F381-C401 HydrophobicContact CE2-CB 3.88Å; F381-C401 HydrophobicContact CZ-CB 4.18Å; C392-C401 VanDerWaalsContact CA-SG 3.58Å; C392-C401 HydrophobicContact CB-CB 3.94Å; C392-C401 WeakPolarHBondContact CB-SG 3.06Å; C392-C401 WeakPolarHBondContact SG-CA 3.35Å; C392-C401 WeakPolarHBondContact SG-CB 3.48Å; C392-C401 CovalentContact SG-SG 2.04Å; C392-C401 PolarHBondContact SG-SG 2.8Å; L396-C401 HydrophobicContact CB-CB 3.85Å; L396-C401 HydrophobicContact CD1-CB 4.1Å; T397-C401 CarbonylContact O-C 3.59Å; T397-C401 VanDerWaalsContact O-C 3.23Å; T397-C401 VanDerWaalsContact O-CA 3.28Å; T397-C401 WeakPolarHBondContact O-CA 3.31Å; G398-C401 PolarHBondContact O-N 3.24Å; G398-C401 VanDerWaalsContact O-N 3.13Å; C401-Y423 PolarHBondContact O-OH 3.12Å
402	E	72.1	Confident	73.1	Confident	69 Å²	69	68.2 Å²	68.2	32%	0.322	39%	0.385	S	S	.	.			trans	-94.1	-12.3	-167.6	60	-172.4	-112.6	0	0	113.4	T397 N400 Y423	T397-E402 PolarHBondContact O-N 2.98Å; N400-E402 HydrophobicContact CB-CB 4.45Å; N400-E402 WeakPolarHBondContact CB-OE2 3.01Å; N400-E402 PolarHBondContact N-OE2 3.5Å; N400-E402 PolarHBondContact ND2-OE2 2.04Å; N400-E402 PolarHBondContact O-N 2.89Å; E402-Y423 WeakPolarHBondContact CA-OH 3.33Å; E402-Y423 PolarHBondContact O-OH 2.86Å
403	Y	76.8	Confident	73.2	Confident	128 Å²	128	67 Å²	67	50%	0.502	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	108.9	177.2	-51.4	-41.6	0	0	0	109.8	T397 V405	T397-Y403 PolarHBondContact N-O 3.31Å; T397-Y403 PolarHBondContact O-N 3.2Å; T397-Y403 PolarHBondContact OG1-O 3.36Å; Y403-V405 PolarHBondContact O-N 3.24Å
404	D	80.5	Confident	73.7	Confident	50 Å²	50	67.2 Å²	67.2	27%	0.267	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	128.1	171.1	-167.2	34	0	0	0	111.2	D406 N421 Y423 G424	D404-D406 PolarHBondContact O-N 2.81Å; D404-N421 PolarHBondContact OD2-ND2 2.64Å; D404-Y423 HydrophobicContact CB-CD2 3.99Å; D404-Y423 HydrophobicContact CB-CE2 4.23Å; D404-G424 PolarHBondContact OD1-N 2.75Å
405	V	80.7	Confident	74.4	Confident	50 Å²	50	62.8 Å²	62.8	30%	0.303	36%	0.356	S	S	.	.			trans	-91.2	97.8	177	-177.8	0	0	0	0	107.7	G395 T397 Y403 E407	G395-V405 WeakPolarHBondContact O-CB 3.42Å; G395-V405 PolarHBondContact O-N 3.11Å; T397-V405 HydrophobicContact CG2-CG2 3.45Å; T397-V405 VanDerWaalsContact CG2-CG2 3.45Å; Y403-V405 PolarHBondContact O-N 3.24Å; V405-E407 VanDerWaalsContact C-N 3.33Å; V405-E407 HydrophobicContact CG1-CG 4.36Å; V405-E407 WeakPolarHBondContact O-CG 3.43Å; V405-E407 PolarHBondContact O-N 2.03Å
406	D	80.5	Confident	74.9	Confident	57 Å²	57	67.8 Å²	67.8	31%	0.305	38%	0.378	S	S	.	.			trans	-62.4	94	176.5	-171.8	-32.1	0	0	0	111	D404 C408 L409 S410 N421	D404-D406 PolarHBondContact O-N 2.81Å; D406-C408 PolarHBondContact O-N 2.97Å; D406-C408 VanDerWaalsContact OD1-CA 3.3Å; D406-C408 WeakPolarHBondContact OD1-CA 3.37Å; D406-C408 WeakPolarHBondContact OD1-CB 3.09Å; D406-C408 PolarHBondContact OD1-N 3.29Å; D406-L409 HydrophobicContact CB-CB 4.25Å; D406-L409 HydrophobicContact CB-CD1 3.97Å; D406-L409 HydrophobicContact CB-CG 4.12Å; D406-L409 PolarHBondContact O-N 3.02Å; D406-L409 PolarHBondContact OD1-N 3.37Å; D406-S410 PolarHBondContact O-N 2.87Å; D406-N421 WeakPolarHBondContact CA-OD1 3.07Å
407	E	84.5	Confident	75.3	Confident	29 Å²	29	70 Å²	70	14%	0.136	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.3	-178.7	-70.3	140.4	131.3	0	0	111.7	V405 S410 S413 S425 F426	V405-E407 VanDerWaalsContact C-N 3.33Å; V405-E407 HydrophobicContact CG1-CG 4.36Å; V405-E407 WeakPolarHBondContact O-CG 3.43Å; V405-E407 PolarHBondContact O-N 2.03Å; E407-S410 WeakPolarHBondContact O-CB 3.41Å; E407-S410 PolarHBondContact O-N 2.85Å; E407-S410 PolarHBondContact O-OG 2.8Å; E407-S413 WeakPolarHBondContact O-CB 3.05Å; E407-S425 WeakPolarHBondContact OE2-CA 3.4Å; E407-F426 HydrophobicContact CB-CB 4.34Å; E407-F426 HydrophobicContact CB-CD1 3.52Å; E407-F426 HydrophobicContact CB-CE1 4.06Å; E407-F426 HydrophobicContact CB-CG 4.07Å; E407-F426 HydrophobicContact CG-CD1 4.07Å; E407-F426 HydrophobicContact CG-CE1 4.46Å; E407-F426 WeakPolarHBondContact OE2-CD1 3.41Å; E407-F426 PolarHBondContact OE2-N 3.39Å
408	C	84.9	Confident	75.6	Confident	40 Å²	40	73.7 Å²	73.7	27%	0.27	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-30.6	172.5	-55.7	0	0	0	0	112.5	D406 C419 N421	D406-C408 PolarHBondContact O-N 2.97Å; D406-C408 VanDerWaalsContact OD1-CA 3.3Å; D406-C408 WeakPolarHBondContact OD1-CA 3.37Å; D406-C408 WeakPolarHBondContact OD1-CB 3.09Å; D406-C408 PolarHBondContact OD1-N 3.29Å; C408-C419 WeakPolarHBondContact CA-SG 3.41Å; C408-C419 HydrophobicContact CB-CB 3.7Å; C408-C419 WeakPolarHBondContact CB-SG 3.26Å; C408-C419 WeakPolarHBondContact SG-CB 3.4Å; C408-C419 CovalentContact SG-SG 2.03Å; C408-C419 PolarHBondContact SG-SG 2.83Å; C408-N421 PolarHBondContact SG-N 2.82Å; C408-N421 VanDerWaalsContact SG-N 3.44Å
409	L	78.5	Confident	76.3	Confident	150 Å²	150	73.8 Å²	73.8	79%	0.785	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-22.9	166.2	-71.2	178.4	0	0	0	112.1	D406	D406-L409 HydrophobicContact CB-CB 4.25Å; D406-L409 HydrophobicContact CB-CD1 3.97Å; D406-L409 HydrophobicContact CB-CG 4.12Å; D406-L409 PolarHBondContact O-N 3.02Å; D406-L409 PolarHBondContact OD1-N 3.37Å
410	S	67.5	Low	77.1	Confident	42 Å²	42	70.7 Å²	70.7	29%	0.294	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	140.5	169.1	95.6	0	0	0	0	111.5	D406 E407 R412	D406-S410 PolarHBondContact O-N 2.87Å; E407-S410 WeakPolarHBondContact O-CB 3.41Å; E407-S410 PolarHBondContact O-N 2.85Å; E407-S410 PolarHBondContact O-OG 2.8Å; S410-R412 PolarHBondContact O-N 2.8Å; S410-R412 WeakPolarHBondContact OG-CB 3.49Å; S410-R412 PolarHBondContact OG-N 3.39Å
411	S	61.4	Low	78.1	Confident	128 Å²	128	70.3 Å²	70.3	90%	0.895	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	36.7	170	72.8	0	0	0	0	112.7
412	R	64.5	Low	78.7	Confident	217 Å²	217	73.3 Å²	73.3	82%	0.819	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	-11	-173.9	-61.6	-177.5	174.9	-179.4	-1.2	114.7	S410 G414	S410-R412 PolarHBondContact O-N 2.8Å; S410-R412 WeakPolarHBondContact OG-CB 3.49Å; S410-R412 PolarHBondContact OG-N 3.39Å; R412-G414 PolarHBondContact O-N 3.15Å
413	S	65.7	Low	79.1	Confident	17 Å²	17	76.4 Å²	76.4	12%	0.119	39%	0.392	C	S	.	.	S	Bend	trans	-48	-48.5	172.1	48.9	0	0	0	0	111.3	E407 C415 C419 F426 K442	E407-S413 WeakPolarHBondContact O-CB 3.05Å; S413-C415 VanDerWaalsContact C-N 3.28Å; S413-C415 PolarHBondContact O-N 3Å; S413-C419 WeakPolarHBondContact CB-SG 3.37Å; S413-F426 WeakPolarHBondContact O-CE2 3.05Å; S413-F426 WeakPolarHBondContact O-CZ 3.32Å; S413-K442 WeakPolarHBondContact O-CD 3.13Å; S413-K442 VanDerWaalsContact O-CE 3.3Å; S413-K442 WeakPolarHBondContact O-CE 2.99Å; S413-K442 PolarHBondContact O-NZ 3.27Å
414	G	77.3	Confident	79	Confident	52 Å²	52	70.8 Å²	70.8	54%	0.536	37%	0.373	S	S	.	.			trans	75.3	15.8	172.9	0	0	0	0	0	114.1	R412	R412-G414 PolarHBondContact O-N 3.15Å
415	C	84	Confident	79.1	Confident	24 Å²	24	70.8 Å²	70.8	16%	0.162	38%	0.377	C	S	.	.			trans	-59.6	141.8	166.8	-58.8	0	0	0	0	110.8	S413 C419 C428	S413-C415 VanDerWaalsContact C-N 3.28Å; S413-C415 PolarHBondContact O-N 3Å; C415-C419 HydrophobicContact CB-CB 4.35Å; C415-C428 WeakPolarHBondContact CA-SG 3.39Å; C415-C428 HydrophobicContact CB-CB 3.62Å; C415-C428 WeakPolarHBondContact CB-SG 3.04Å; C415-C428 WeakPolarHBondContact SG-CA 3.42Å; C415-C428 WeakPolarHBondContact SG-CB 3.47Å; C415-C428 CovalentContact SG-SG 2.03Å; C415-C428 PolarHBondContact SG-SG 3.18Å
416	E	84.8	Confident	79.3	Confident	112 Å²	112	70.1 Å²	70.1	52%	0.523	37%	0.37	S	S	.	.	S	Bend	trans	-72.4	-31.7	177.3	-174.7	170.9	-175.7	0	0	112.9	K442 R443 C444	E416-K442 WeakPolarHBondContact CB-O 3.32Å; E416-K442 PolarHBondContact N-O 2.98Å; E416-R443 VanDerWaalsContact OE2-CA 3.24Å; E416-R443 WeakPolarHBondContact OE2-CA 3.34Å; E416-R443 WeakPolarHBondContact OE2-CB 3.48Å; E416-C444 PolarHBondContact OE2-N 2.83Å
417	Q	85.4	Confident	79.7	Confident	54 Å²	54	73.1 Å²	73.1	25%	0.252	38%	0.377	S	S	.	.	S	Bend	trans	-126.7	-95.5	-174.8	-64.6	-178.9	-6.9	0	0	111.8	C430 E431 Y434 C444	Q417-C430 VanDerWaalsContact OE1-CA 3.25Å; Q417-E431 HydrophobicContact CB-CG 4.43Å; Q417-Y434 VanDerWaalsContact NE2-CD1 3.28Å; Q417-Y434 VanDerWaalsContact NE2-CG 3.34Å; Q417-C444 VanDerWaalsContact CD-CB 3.43Å; Q417-C444 HydrophobicContact CG-CB 3.96Å
418	R	85.8	Confident	79.8	Confident	148 Å²	148	72.4 Å²	72.4	56%	0.558	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.5	-179.3	-171.7	-176.2	-171	-165.3	10.3	110.4	V420 C428 E429	R418-V420 HydrophobicContact CG-CG2 4.09Å; R418-C428 CarbonylContact O-C 3.16Å; R418-C428 VanDerWaalsContact O-CA 3.31Å; R418-C428 WeakPolarHBondContact O-CA 3.23Å; R418-E429 WeakPolarHBondContact CA-O 3.21Å; R418-E429 HydrophobicContact CB-CB 4.03Å; R418-E429 VanDerWaalsContact CB-O 3.32Å; R418-E429 WeakPolarHBondContact CB-O 3.07Å; R418-E429 WeakPolarHBondContact CD-OE2 3.29Å; R418-E429 HydrophobicContact CG-CB 4.33Å; R418-E429 IonicContact CZ-OE2 3.73Å; R418-E429 PolarHBondContact N-O 3.09Å; R418-E429 IonicContact NE-OE2 3.09Å; R418-E429 IonicContact NH1-OE2 2.68Å; R418-E429 PolarHBondContact NH1-OE2 2.94Å; R418-E429 PolarHBondContact O-N 3.44Å
419	C	88.1	Confident	79.8	Confident	33 Å²	33	72.7 Å²	72.7	22%	0.223	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.3	166.6	-172.1	0	0	0	0	108.2	C408 S413 C415	C408-C419 WeakPolarHBondContact CA-SG 3.41Å; C408-C419 HydrophobicContact CB-CB 3.7Å; C408-C419 WeakPolarHBondContact CB-SG 3.26Å; C408-C419 WeakPolarHBondContact SG-CB 3.4Å; C408-C419 CovalentContact SG-SG 2.03Å; C408-C419 PolarHBondContact SG-SG 2.83Å; S413-C419 WeakPolarHBondContact CB-SG 3.37Å; C415-C419 HydrophobicContact CB-CB 4.35Å
420	V	85.1	Confident	80	Confident	28 Å²	28	66.9 Å²	66.9	17%	0.17	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	113.9	173.3	178.5	0	0	0	0	108.6	R418 R427 E429	R418-V420 HydrophobicContact CG-CG2 4.09Å; V420-R427 HydrophobicContact CB-CG 4.05Å; V420-R427 PolarHBondContact N-O 3.29Å; V420-R427 PolarHBondContact O-N 3.32Å; V420-E429 HydrophobicContact CG2-CB 4.43Å; V420-E429 VanDerWaalsContact CG2-CD 3.48Å; V420-E429 HydrophobicContact CG2-CG 4.06Å; V420-E429 WeakPolarHBondContact CG2-OE2 2.99Å
421	N	82.8	Confident	80.6	Confident	47 Å²	47	71 Å²	71	25%	0.251	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.3	177.4	-167.1	53.2	0	0	0	110.8	D404 D406 C408 S425	D404-N421 PolarHBondContact OD2-ND2 2.64Å; D406-N421 WeakPolarHBondContact CA-OD1 3.07Å; C408-N421 PolarHBondContact SG-N 2.82Å; C408-N421 VanDerWaalsContact SG-N 3.44Å; N421-S425 PolarHBondContact OD1-O 2.63Å
422	I	81.6	Confident	80.9	Confident	65 Å²	65	72.8 Å²	72.8	33%	0.333	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	144.1	178.7	53.6	176.5	0	0	0	108.6	G424 S425 R427	I422-G424 PolarHBondContact O-N 3.28Å; I422-S425 CarbonylContact C-O 3.54Å; I422-S425 VanDerWaalsContact CG1-O 3.28Å; I422-S425 WeakPolarHBondContact CG1-O 3.38Å; I422-S425 PolarHBondContact N-O 2.88Å; I422-S425 CarbonylContact O-C 3.57Å; I422-S425 PolarHBondContact O-N 3Å; I422-R427 VanDerWaalsContact CG2-NH1 3.31Å
423	Y	80.6	Confident	80.8	Confident	133 Å²	133	64.1 Å²	64.1	52%	0.522	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	111	-172.2	-172.3	-87.3	0	0	0	113.1	L396 C401 E402 D404	L396-Y423 HydrophobicContact CD2-CD1 4.46Å; L396-Y423 HydrophobicContact CD2-CE1 3.97Å; C401-Y423 PolarHBondContact O-OH 3.12Å; E402-Y423 WeakPolarHBondContact CA-OH 3.33Å; E402-Y423 PolarHBondContact O-OH 2.86Å; D404-Y423 HydrophobicContact CB-CD2 3.99Å; D404-Y423 HydrophobicContact CB-CE2 4.23Å
424	G	75.4	Confident	81.3	Confident	10 Å²	10	68.2 Å²	68.2	10%	0.103	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	8.7	-176.6	0	0	0	0	0	116.6	D404 I422	D404-G424 PolarHBondContact OD1-N 2.75Å; I422-G424 PolarHBondContact O-N 3.28Å
425	S	81.7	Confident	81.3	Confident	50 Å²	50	68.5 Å²	68.5	35%	0.35	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	-168.9	175.8	-150	0	0	0	0	113.8	E407 N421 I422	E407-S425 WeakPolarHBondContact OE2-CA 3.4Å; N421-S425 PolarHBondContact OD1-O 2.63Å; I422-S425 CarbonylContact C-O 3.54Å; I422-S425 VanDerWaalsContact CG1-O 3.28Å; I422-S425 WeakPolarHBondContact CG1-O 3.38Å; I422-S425 PolarHBondContact N-O 2.88Å; I422-S425 CarbonylContact O-C 3.57Å; I422-S425 PolarHBondContact O-N 3Å
426	F	86.4	Confident	81	Confident	37 Å²	37	70.2 Å²	70.2	16%	0.162	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.8	166.2	67.9	-74.3	0	0	0	110.3	E407 S413	E407-F426 HydrophobicContact CB-CB 4.34Å; E407-F426 HydrophobicContact CB-CD1 3.52Å; E407-F426 HydrophobicContact CB-CE1 4.06Å; E407-F426 HydrophobicContact CB-CG 4.07Å; E407-F426 HydrophobicContact CG-CD1 4.07Å; E407-F426 HydrophobicContact CG-CE1 4.46Å; E407-F426 WeakPolarHBondContact OE2-CD1 3.41Å; E407-F426 PolarHBondContact OE2-N 3.39Å; S413-F426 WeakPolarHBondContact O-CE2 3.05Å; S413-F426 WeakPolarHBondContact O-CZ 3.32Å
427	R	87.5	Confident	80.9	Confident	119 Å²	119	66.3 Å²	66.3	45%	0.449	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	149.2	164.3	68.5	173.5	-176.4	-95	1.8	110.1	V420 I422 E429	V420-R427 HydrophobicContact CB-CG 4.05Å; V420-R427 PolarHBondContact N-O 3.29Å; V420-R427 PolarHBondContact O-N 3.32Å; I422-R427 VanDerWaalsContact CG2-NH1 3.31Å; R427-E429 IonicContact CZ-OE1 3.66Å; R427-E429 IonicContact NE-OE1 2.77Å; R427-E429 PolarHBondContact NE-OE1 3.46Å; R427-E429 IonicContact NH2-OE1 3.74Å; R427-E429 PolarHBondContact NH2-OE1 2.04Å
428	C	87.3	Confident	80.3	Confident	15 Å²	15	69 Å²	69	10%	0.101	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.1	166	-53.5	0	0	0	0	109.1	C415 R418 P441	C415-C428 WeakPolarHBondContact CA-SG 3.39Å; C415-C428 HydrophobicContact CB-CB 3.62Å; C415-C428 WeakPolarHBondContact CB-SG 3.04Å; C415-C428 WeakPolarHBondContact SG-CA 3.42Å; C415-C428 WeakPolarHBondContact SG-CB 3.47Å; C415-C428 CovalentContact SG-SG 2.03Å; C415-C428 PolarHBondContact SG-SG 3.18Å; R418-C428 CarbonylContact O-C 3.16Å; R418-C428 VanDerWaalsContact O-CA 3.31Å; R418-C428 WeakPolarHBondContact O-CA 3.23Å; C428-P441 WeakPolarHBondContact CB-O 3.15Å
429	E	85.1	Confident	80.1	Confident	46 Å²	46	69.3 Å²	69.3	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	151.3	170.4	-76	-180	-173.2	0	0	108.8	R418 V420 R427	R418-E429 WeakPolarHBondContact CA-O 3.21Å; R418-E429 HydrophobicContact CB-CB 4.03Å; R418-E429 VanDerWaalsContact CB-O 3.32Å; R418-E429 WeakPolarHBondContact CB-O 3.07Å; R418-E429 WeakPolarHBondContact CD-OE2 3.29Å; R418-E429 HydrophobicContact CG-CB 4.33Å; R418-E429 IonicContact CZ-OE2 3.73Å; R418-E429 PolarHBondContact N-O 3.09Å; R418-E429 IonicContact NE-OE2 3.09Å; R418-E429 IonicContact NH1-OE2 2.68Å; R418-E429 PolarHBondContact NH1-OE2 2.94Å; R418-E429 PolarHBondContact O-N 3.44Å; V420-E429 HydrophobicContact CG2-CB 4.43Å; V420-E429 VanDerWaalsContact CG2-CD 3.48Å; V420-E429 HydrophobicContact CG2-CG 4.06Å; V420-E429 WeakPolarHBondContact CG2-OE2 2.99Å; R427-E429 IonicContact CZ-OE1 3.66Å; R427-E429 IonicContact NE-OE1 2.77Å; R427-E429 PolarHBondContact NE-OE1 3.46Å; R427-E429 IonicContact NH2-OE1 3.74Å; R427-E429 PolarHBondContact NH2-OE1 2.04Å
430	C	83.1	Confident	79.8	Confident	27 Å²	27	70.2 Å²	70.2	18%	0.182	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-102.6	149.2	176.8	-56.1	0	0	0	0	110.4	Q417 V435 V436 C444	Q417-C430 VanDerWaalsContact OE1-CA 3.25Å; C430-V435 VanDerWaalsContact SG-C 3.54Å; C430-V436 PolarHBondContact SG-N 3.14Å; C430-C444 WeakPolarHBondContact CA-SG 3.05Å; C430-C444 HydrophobicContact CB-CB 3.82Å; C430-C444 WeakPolarHBondContact CB-SG 3.43Å; C430-C444 VanDerWaalsContact SG-CA 3.52Å; C430-C444 WeakPolarHBondContact SG-CB 3.23Å; C430-C444 CovalentContact SG-SG 2.04Å; C430-C444 PolarHBondContact SG-SG 3.02Å
431	E	79.9	Confident	79.5	Confident	130 Å²	130	73 Å²	73	61%	0.607	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-68.9	158.1	171.3	-64.8	-175.7	164.9	0	0	110.5	Q417 G433 Y434	Q417-E431 HydrophobicContact CB-CG 4.43Å; E431-G433 PolarHBondContact O-N 2.76Å; E431-Y434 PolarHBondContact O-N 2.04Å
432	N	66.9	Low	79.5	Confident	164 Å²	164	74.7 Å²	74.7	88%	0.877	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	127.3	-177	-70.3	-10.6	0	0	0	111.6
433	G	61.8	Low	79.7	Confident	35 Å²	35	78.8 Å²	78.8	36%	0.361	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	-5.5	-175.4	0	0	0	0	0	114.9	E431 S447	E431-G433 PolarHBondContact O-N 2.76Å; G433-S447 WeakPolarHBondContact O-CB 3.5Å; G433-S447 PolarHBondContact O-N 2.89Å
434	Y	77.1	Confident	79.8	Confident	104 Å²	104	72.6 Å²	72.6	41%	0.408	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	156	175.3	-68	-102.7	0	0	0	111.7	Q417 E431 C444 K445 P446	Q417-Y434 VanDerWaalsContact NE2-CD1 3.28Å; Q417-Y434 VanDerWaalsContact NE2-CG 3.34Å; E431-Y434 PolarHBondContact O-N 2.04Å; Y434-C444 HydrophobicContact CD1-CB 4.35Å; Y434-C444 WeakPolarHBondContact CD1-O 3.41Å; Y434-K445 CarbonylContact C-O 3.54Å; Y434-K445 WeakPolarHBondContact CA-O 3.04Å; Y434-P446 HydrophobicContact CD1-CB 4.46Å; Y434-P446 HydrophobicContact CD1-CG 4.19Å; Y434-P446 HydrophobicContact CE1-CB 4.36Å; Y434-P446 HydrophobicContact CE1-CG 3.79Å
435	V	75.9	Confident	79.9	Confident	58 Å²	58	75.9 Å²	75.9	35%	0.352	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.1	176.7	-64.2	0	0	0	0	110.8	C430 C444 K445	C430-V435 VanDerWaalsContact SG-C 3.54Å; V435-C444 CarbonylContact O-C 3.57Å; V435-C444 WeakPolarHBondContact O-CA 3.04Å; V435-K445 HydrophobicContact CG2-CG 3.82Å; V435-K445 PolarHBondContact N-O 3.11Å; V435-K445 PolarHBondContact O-N 3.13Å
436	V	79.4	Confident	79.2	Confident	59 Å²	59	77.3 Å²	77.3	36%	0.358	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	137.3	179	-178.5	0	0	0	0	110.1	C430 P441 R443	C430-V436 PolarHBondContact SG-N 3.14Å; V436-P441 HydrophobicContact CG1-CB 4.38Å; V436-R443 WeakPolarHBondContact CA-O 3.11Å
437	V	81.2	Confident	77.9	Confident	31 Å²	31	77.2 Å²	77.2	19%	0.188	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.3	176.2	178.9	0	0	0	0	109.3	D439 D440 R443 K445	V437-D439 VanDerWaalsContact C-N 3.25Å; V437-D439 PolarHBondContact O-N 2.96Å; V437-D440 HydrophobicContact CB-CB 4.42Å; V437-D440 HydrophobicContact CG1-CB 4.38Å; V437-D440 CarbonylContact O-C 3.54Å; V437-D440 PolarHBondContact O-N 3.46Å; V437-D440 VanDerWaalsContact O-N 3.12Å; V437-D440 VanDerWaalsContact O-O 3.14Å; V437-R443 HydrophobicContact CB-CB 4.23Å; V437-R443 HydrophobicContact CG2-CB 3.79Å; V437-R443 PolarHBondContact N-O 2.94Å; V437-K445 HydrophobicContact CG2-CB 3.93Å; V437-K445 HydrophobicContact CG2-CD 4.48Å; V437-K445 HydrophobicContact CG2-CG 4.06Å
438	P	74	Confident	76.3	Confident	110 Å²	110	77.8 Å²	77.8	71%	0.714	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.4	-176.4	-28.4	36.1	0	0	0	114.7
439	D	80.4	Confident	74.5	Confident	155 Å²	155	80 Å²	80	83%	0.829	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-13.2	-178.8	-49.3	-71.2	0	0	0	114	V437	V437-D439 VanDerWaalsContact C-N 3.25Å; V437-D439 PolarHBondContact O-N 2.96Å
440	D	82.2	Confident	72.9	Confident	52 Å²	52	84.7 Å²	84.7	28%	0.278	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	87.7	177.5	-174.4	-10.8	0	0	0	109.3	V437 K442 R443	V437-D440 HydrophobicContact CB-CB 4.42Å; V437-D440 HydrophobicContact CG1-CB 4.38Å; V437-D440 CarbonylContact O-C 3.54Å; V437-D440 PolarHBondContact O-N 3.46Å; V437-D440 VanDerWaalsContact O-N 3.12Å; V437-D440 VanDerWaalsContact O-O 3.14Å; D440-K442 PolarHBondContact O-N 3.06Å; D440-K442 WeakPolarHBondContact OD1-CB 3.23Å; D440-K442 PolarHBondContact OD1-N 3.21Å; D440-K442 VanDerWaalsContact OD1-N 3.15Å; D440-R443 HydrophobicContact CB-CB 4.36Å; D440-R443 HydrophobicContact CB-CG 4.39Å; D440-R443 PolarHBondContact O-N 3.49Å; D440-R443 WeakPolarHBondContact OD2-CD 3.14Å; D440-R443 VanDerWaalsContact OD2-CG 3.29Å; D440-R443 WeakPolarHBondContact OD2-CG 3.41Å; D440-R443 IonicContact OD2-CZ 2.59Å; D440-R443 IonicContact OD2-NE 3.18Å; D440-R443 PolarHBondContact OD2-NE 3.23Å
441	P	78.2	Confident	71.5	Confident	86 Å²	86	89.1 Å²	89.1	56%	0.558	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	-5.5	-178.2	-27	36.2	0	0	0	115.4	C428 V436	C428-P441 WeakPolarHBondContact CB-O 3.15Å; V436-P441 HydrophobicContact CG1-CB 4.38Å
442	K	84.6	Confident	70.3	Confident	83 Å²	83	90.8 Å²	90.8	36%	0.361	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-13.9	176.2	-57.9	-168.4	177.7	-165.5	0	113.6	S413 E416 D440	S413-K442 WeakPolarHBondContact O-CD 3.13Å; S413-K442 VanDerWaalsContact O-CE 3.3Å; S413-K442 WeakPolarHBondContact O-CE 2.99Å; S413-K442 PolarHBondContact O-NZ 3.27Å; E416-K442 WeakPolarHBondContact CB-O 3.32Å; E416-K442 PolarHBondContact N-O 2.98Å; D440-K442 PolarHBondContact O-N 3.06Å; D440-K442 WeakPolarHBondContact OD1-CB 3.23Å; D440-K442 PolarHBondContact OD1-N 3.21Å; D440-K442 VanDerWaalsContact OD1-N 3.15Å
443	R	84.9	Confident	70.2	Confident	150 Å²	150	83.4 Å²	83.4	57%	0.566	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	149.9	-179	-72.9	-176.3	-167.1	-145.9	-6.7	113.4	E416 V436 V437 D440	E416-R443 VanDerWaalsContact OE2-CA 3.24Å; E416-R443 WeakPolarHBondContact OE2-CA 3.34Å; E416-R443 WeakPolarHBondContact OE2-CB 3.48Å; V436-R443 WeakPolarHBondContact CA-O 3.11Å; V437-R443 HydrophobicContact CB-CB 4.23Å; V437-R443 HydrophobicContact CG2-CB 3.79Å; V437-R443 PolarHBondContact N-O 2.94Å; D440-R443 HydrophobicContact CB-CB 4.36Å; D440-R443 HydrophobicContact CB-CG 4.39Å; D440-R443 PolarHBondContact O-N 3.49Å; D440-R443 WeakPolarHBondContact OD2-CD 3.14Å; D440-R443 VanDerWaalsContact OD2-CG 3.29Å; D440-R443 WeakPolarHBondContact OD2-CG 3.41Å; D440-R443 IonicContact OD2-CZ 2.59Å; D440-R443 IonicContact OD2-NE 3.18Å; D440-R443 PolarHBondContact OD2-NE 3.23Å
444	C	82.4	Confident	70.4	Confident	4 Å²	4	86.1 Å²	86.1	3%	0.027	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	102	-179.2	-72.7	0	0	0	0	109.3	E416 Q417 C430 Y434 V435	E416-C444 PolarHBondContact OE2-N 2.83Å; Q417-C444 VanDerWaalsContact CD-CB 3.43Å; Q417-C444 HydrophobicContact CG-CB 3.96Å; C430-C444 WeakPolarHBondContact CA-SG 3.05Å; C430-C444 HydrophobicContact CB-CB 3.82Å; C430-C444 WeakPolarHBondContact CB-SG 3.43Å; C430-C444 VanDerWaalsContact SG-CA 3.52Å; C430-C444 WeakPolarHBondContact SG-CB 3.23Å; C430-C444 CovalentContact SG-SG 2.04Å; C430-C444 PolarHBondContact SG-SG 3.02Å; Y434-C444 HydrophobicContact CD1-CB 4.35Å; Y434-C444 WeakPolarHBondContact CD1-O 3.41Å; V435-C444 CarbonylContact O-C 3.57Å; V435-C444 WeakPolarHBondContact O-CA 3.04Å
445	K	77.4	Confident	69.8	Low	79 Å²	79	86 Å²	86	34%	0.343	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	148	171.1	67.8	170.5	-169.9	161.1	0	110.2	Y434 V435 V437 S447 E448	Y434-K445 CarbonylContact C-O 3.54Å; Y434-K445 WeakPolarHBondContact CA-O 3.04Å; V435-K445 HydrophobicContact CG2-CG 3.82Å; V435-K445 PolarHBondContact N-O 3.11Å; V435-K445 PolarHBondContact O-N 3.13Å; V437-K445 HydrophobicContact CG2-CB 3.93Å; V437-K445 HydrophobicContact CG2-CD 4.48Å; V437-K445 HydrophobicContact CG2-CG 4.06Å; K445-S447 PolarHBondContact O-N 3.23Å; K445-E448 IonicContact NZ-OE1 2.68Å; K445-E448 PolarHBondContact NZ-OE1 2.91Å
446	P	66.7	Low	69.5	Low	80 Å²	80	85.6 Å²	85.6	52%	0.519	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	141.4	168.4	-24.2	33.4	0	0	0	110.5	Y434 E448	Y434-P446 HydrophobicContact CD1-CB 4.46Å; Y434-P446 HydrophobicContact CD1-CG 4.19Å; Y434-P446 HydrophobicContact CE1-CB 4.36Å; Y434-P446 HydrophobicContact CE1-CG 3.79Å; P446-E448 PolarHBondContact O-N 2.64Å
447	S	59.7	Low	69.6	Low	35 Å²	35	83.7 Å²	83.7	25%	0.245	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-69.9	117.3	174.7	97	0	0	0	0	108.7	G433 K445 C449	G433-S447 WeakPolarHBondContact O-CB 3.5Å; G433-S447 PolarHBondContact O-N 2.89Å; K445-S447 PolarHBondContact O-N 3.23Å; S447-C449 PolarHBondContact O-N 3.18Å
448	E	54.4	Low	69.5	Low	130 Å²	130	82.8 Å²	82.8	61%	0.607	46%	0.457	S	S	*	.			trans	-74.9	63.5	-179	-68.5	165.4	-127	0	0	111	K445 P446 L450	K445-E448 IonicContact NZ-OE1 2.68Å; K445-E448 PolarHBondContact NZ-OE1 2.91Å; P446-E448 PolarHBondContact O-N 2.64Å; E448-L450 PolarHBondContact O-N 2.83Å
449	C	49.4	Very low	69.7	Low	63 Å²	63	84.8 Å²	84.8	43%	0.426	46%	0.455	S	S	.	.	S	Bend	trans	49.5	28.7	178.9	-167	0	0	0	0	115.5	S447 C460	S447-C449 PolarHBondContact O-N 3.18Å; C449-C460 HydrophobicContact CB-CB 3.65Å; C449-C460 WeakPolarHBondContact CB-SG 3.34Å; C449-C460 WeakPolarHBondContact SG-CB 3.49Å; C449-C460 CovalentContact SG-SG 2.03Å; C449-C460 PolarHBondContact SG-SG 3.26Å
450	L	52.1	Low	69.2	Low	144 Å²	144	79 Å²	79	75%	0.754	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	13.1	-165.6	-102.1	162.4	0	0	0	116.4	E448	E448-L450 PolarHBondContact O-N 2.83Å
451	T	52.2	Low	68.9	Low	119 Å²	119	79 Å²	79	73%	0.73	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	33.9	166.2	-6.8	0	0	0	0	114.3
452	K	54.7	Low	68.3	Low	165 Å²	165	82.3 Å²	82.3	72%	0.717	45%	0.445	S	S	*	.			trans	67.7	113.8	158	-53.1	172.8	-176.8	174.5	0	117.5	H454	K452-H454 PolarHBondContact O-N 2.86Å
453	C	66.2	Low	67.6	Low	9 Å²	9	83.7 Å²	83.7	6%	0.061	46%	0.461	C	S	.	.	S	Bend	trans	-54.4	132.9	143.5	-49.7	0	0	0	0	107.9	S455 G456 C466	C453-S455 PolarHBondContact O-N 3.06Å; C453-G456 PolarHBondContact O-N 2.03Å; C453-C466 VanDerWaalsContact CA-SG 3.57Å; C453-C466 HydrophobicContact CB-CB 3.97Å; C453-C466 WeakPolarHBondContact CB-SG 3.45Å; C453-C466 WeakPolarHBondContact SG-CB 2.99Å; C453-C466 CovalentContact SG-SG 2.04Å; C453-C466 PolarHBondContact SG-SG 3.1Å
454	H	66.3	Low	66.5	Low	92 Å²	92	78.4 Å²	78.4	43%	0.426	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-46	110.4	-160.9	176.6	-89	0	0	0	113.3	K452 G456 N457 W476 N478	K452-H454 PolarHBondContact O-N 2.86Å; H454-G456 PolarHBondContact O-N 3.48Å; H454-N457 PolarHBondContact ND1-ND2 3.09Å; H454-N457 WeakPolarHBondContact O-CB 3.21Å; H454-N457 PolarHBondContact O-N 2.9Å; H454-N457 PolarHBondContact O-ND2 3.28Å; H454-N457 PolarHBondContact O-OD1 3.37Å; H454-W476 WeakPolarHBondContact CB-O 3.25Å; H454-W476 PolarHBondContact N-O 3.28Å; H454-N478 HydrophobicContact CB-CB 3.95Å
455	S	63.9	Low	66	Low	101 Å²	101	84.6 Å²	84.6	71%	0.706	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	47.4	23.2	174.4	-60.8	0	0	0	0	117.3	C453	C453-S455 PolarHBondContact O-N 3.06Å
456	G	70.1	Confident	65.9	Low	50 Å²	50	81.5 Å²	81.5	52%	0.515	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	99.9	1.6	-178.2	0	0	0	0	0	115.4	C453 H454 G458 L469	C453-G456 PolarHBondContact O-N 2.03Å; H454-G456 PolarHBondContact O-N 3.48Å; G456-G458 PolarHBondContact O-N 2.04Å; G456-L469 WeakPolarHBondContact O-CD1 3.11Å
457	N	80.8	Confident	66.8	Low	20 Å²	20	82.5 Å²	82.5	11%	0.107	47%	0.465	C	S	.	.	S	Bend	trans	-67.7	3.2	-179.7	-62.7	-1.4	0	0	0	114.5	H454 C468 L469 Y472 C477	H454-N457 PolarHBondContact ND1-ND2 3.09Å; H454-N457 WeakPolarHBondContact O-CB 3.21Å; H454-N457 PolarHBondContact O-N 2.9Å; H454-N457 PolarHBondContact O-ND2 3.28Å; H454-N457 PolarHBondContact O-OD1 3.37Å; N457-C468 WeakPolarHBondContact O-CA 3.41Å; N457-L469 PolarHBondContact O-N 2.72Å; N457-Y472 HydrophobicContact CB-CD1 4.08Å; N457-Y472 HydrophobicContact CB-CD2 3.78Å; N457-Y472 HydrophobicContact CB-CE1 4.28Å; N457-Y472 HydrophobicContact CB-CE2 3.99Å; N457-Y472 HydrophobicContact CB-CG 3.8Å; N457-Y472 VanDerWaalsContact CG-CZ 3.45Å; N457-Y472 WeakPolarHBondContact ND2-CD1 3.41Å; N457-Y472 WeakPolarHBondContact ND2-CE1 3.4Å; N457-C477 HydrophobicContact CB-CB 3.86Å; N457-C477 VanDerWaalsContact CB-O 3.31Å; N457-C477 WeakPolarHBondContact CB-O 3.35Å; N457-C477 PolarHBondContact ND2-O 3.15Å; N457-C477 WeakPolarHBondContact O-CB 3.2Å
458	G	78.9	Confident	68	Low	11 Å²	11	83 Å²	83	11%	0.113	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	169.1	178.3	0	0	0	0	0	112.9	G456 H467	G456-G458 PolarHBondContact O-N 2.04Å; G458-H467 CarbonylContact C-O 3.36Å; G458-H467 WeakPolarHBondContact CA-O 2.99Å
459	K	78.9	Confident	69.4	Low	152 Å²	152	80.2 Å²	80.2	66%	0.661	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	131.3	178.2	-60.9	176.6	-178.1	176.3	0	109.5	H467	K459-H467 PolarHBondContact N-O 3.02Å; K459-H467 PolarHBondContact O-N 3.08Å
460	C	70.4	Confident	71.1	Confident	35 Å²	35	83 Å²	83	24%	0.236	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	148.2	169.4	-48.3	0	0	0	0	111	C449 K465	C449-C460 HydrophobicContact CB-CB 3.65Å; C449-C460 WeakPolarHBondContact CB-SG 3.34Å; C449-C460 WeakPolarHBondContact SG-CB 3.49Å; C449-C460 CovalentContact SG-SG 2.03Å; C449-C460 PolarHBondContact SG-SG 3.26Å; C460-K465 CarbonylContact C-O 3.58Å; C460-K465 VanDerWaalsContact CA-O 3.3Å; C460-K465 WeakPolarHBondContact CA-O 3.31Å
461	D	75.9	Confident	72.7	Confident	51 Å²	51	76.5 Å²	76.5	27%	0.273	44%	0.442	S	S	.	.			trans	-88.1	-178.5	155.1	64.6	27.1	0	0	0	111.8	T463 G464 K465 H467	D461-T463 PolarHBondContact O-N 2.82Å; D461-T463 VanDerWaalsContact O-N 3.15Å; D461-T463 VanDerWaalsContact OD1-CA 3.29Å; D461-T463 WeakPolarHBondContact OD1-CA 3.48Å; D461-T463 WeakPolarHBondContact OD1-CB 3.42Å; D461-T463 PolarHBondContact OD1-N 2.59Å; D461-T463 PolarHBondContact OD1-OG1 2.91Å; D461-T463 PolarHBondContact OD2-OG1 2.75Å; D461-G464 PolarHBondContact O-N 3.38Å; D461-G464 VanDerWaalsContact O-N 3.08Å; D461-G464 PolarHBondContact OD1-N 3.16Å; D461-K465 PolarHBondContact N-O 2.86Å; D461-K465 PolarHBondContact OD1-N 2.77Å; D461-K465 VanDerWaalsContact OD1-N 3.17Å; D461-H467 IonicContact OD2-CD2 2.66Å; D461-H467 IonicContact OD2-CE1 3.62Å; D461-H467 IonicContact OD2-NE2 2.67Å; D461-H467 PolarHBondContact OD2-NE2 2.99Å
462	T	65.6	Low	74.4	Confident	155 Å²	155	72.6 Å²	72.6	95%	0.951	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-3	177.2	50.1	0	0	0	0	114.4
463	T	68	Low	75.9	Confident	113 Å²	113	68 Å²	68	69%	0.693	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	1.6	172.3	73.6	0	0	0	0	112.7	D461 K465	D461-T463 PolarHBondContact O-N 2.82Å; D461-T463 VanDerWaalsContact O-N 3.15Å; D461-T463 VanDerWaalsContact OD1-CA 3.29Å; D461-T463 WeakPolarHBondContact OD1-CA 3.48Å; D461-T463 WeakPolarHBondContact OD1-CB 3.42Å; D461-T463 PolarHBondContact OD1-N 2.59Å; D461-T463 PolarHBondContact OD1-OG1 2.91Å; D461-T463 PolarHBondContact OD2-OG1 2.75Å; T463-K465 VanDerWaalsContact C-N 3.32Å
464	G	63.5	Low	76.6	Confident	39 Å²	39	69 Å²	69	40%	0.402	41%	0.412	S	S	.	.	S	Bend	trans	83.7	2.4	-178.1	0	0	0	0	0	114.2	D461	D461-G464 PolarHBondContact O-N 3.38Å; D461-G464 VanDerWaalsContact O-N 3.08Å; D461-G464 PolarHBondContact OD1-N 3.16Å
465	K	70.7	Confident	77.3	Confident	133 Å²	133	72 Å²	72	58%	0.578	43%	0.426	S	S	*	.			trans	-82.4	126.5	-177.3	-177.3	-177.4	178.4	-177.6	0	111.2	C460 D461 T463 H467	C460-K465 CarbonylContact C-O 3.58Å; C460-K465 VanDerWaalsContact CA-O 3.3Å; C460-K465 WeakPolarHBondContact CA-O 3.31Å; D461-K465 PolarHBondContact N-O 2.86Å; D461-K465 PolarHBondContact OD1-N 2.77Å; D461-K465 VanDerWaalsContact OD1-N 3.17Å; T463-K465 VanDerWaalsContact C-N 3.32Å; K465-H467 PolarHBondContact O-CD2 2.85Å; K465-H467 PolarHBondContact O-N 3.19Å
466	C	76	Confident	78	Confident	15 Å²	15	72.9 Å²	72.9	10%	0.101	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	119.3	172.6	-68.1	0	0	0	0	111.6	C453	C453-C466 VanDerWaalsContact CA-SG 3.57Å; C453-C466 HydrophobicContact CB-CB 3.97Å; C453-C466 WeakPolarHBondContact CB-SG 3.45Å; C453-C466 WeakPolarHBondContact SG-CB 2.99Å; C453-C466 CovalentContact SG-SG 2.04Å; C453-C466 PolarHBondContact SG-SG 3.1Å
467	H	86.1	Confident	78.6	Confident	100 Å²	100	70.5 Å²	70.5	46%	0.463	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	106.8	163.9	-66.5	-99.8	0	0	0	108	G458 K459 D461 K465	G458-H467 CarbonylContact C-O 3.36Å; G458-H467 WeakPolarHBondContact CA-O 2.99Å; K459-H467 PolarHBondContact N-O 3.02Å; K459-H467 PolarHBondContact O-N 3.08Å; D461-H467 IonicContact OD2-CD2 2.66Å; D461-H467 IonicContact OD2-CE1 3.62Å; D461-H467 IonicContact OD2-NE2 2.67Å; D461-H467 PolarHBondContact OD2-NE2 2.99Å; K465-H467 PolarHBondContact O-CD2 2.85Å; K465-H467 PolarHBondContact O-N 3.19Å
468	C	84.2	Confident	78.8	Confident	45 Å²	45	73.2 Å²	73.2	30%	0.304	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	148.1	-176.5	-53.8	0	0	0	0	112.2	N457 Y472 C477	N457-C468 WeakPolarHBondContact O-CA 3.41Å; C468-Y472 WeakPolarHBondContact CB-O 3.45Å; C468-C477 WeakPolarHBondContact CA-SG 3.03Å; C468-C477 HydrophobicContact CB-CB 3.77Å; C468-C477 WeakPolarHBondContact CB-SG 3.39Å; C468-C477 WeakPolarHBondContact SG-CA 3.49Å; C468-C477 WeakPolarHBondContact SG-CB 3.04Å; C468-C477 CovalentContact SG-SG 2.04Å; C468-C477 PolarHBondContact SG-SG 3.28Å
469	L	83.9	Confident	79.1	Confident	73 Å²	73	77.2 Å²	77.2	38%	0.382	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-67.2	150.7	165.8	-61.2	178.4	0	0	0	109	G456 N457 G471 Y472	G456-L469 WeakPolarHBondContact O-CD1 3.11Å; N457-L469 PolarHBondContact O-N 2.72Å; L469-G471 PolarHBondContact O-N 3.28Å; L469-Y472 HydrophobicContact CB-CD2 4.28Å; L469-Y472 PolarHBondContact O-N 3.36Å; L469-Y472 VanDerWaalsContact O-N 3.12Å
470	P	85.1	Confident	79.6	Confident	122 Å²	122	72.6 Å²	72.6	79%	0.792	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	141.1	168.4	-25	34.9	0	0	0	110.7
471	G	85.4	Confident	80.5	Confident	6 Å²	6	72.8 Å²	72.8	6%	0.062	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	-9.4	-170.6	0	0	0	0	0	114.7	L469 I481	L469-G471 PolarHBondContact O-N 3.28Å; G471-I481 WeakPolarHBondContact O-CB 3.29Å; G471-I481 WeakPolarHBondContact O-CG1 3.04Å; G471-I481 PolarHBondContact O-N 3.17Å
472	Y	88.1	Confident	81.1	Confident	37 Å²	37	72.9 Å²	72.9	15%	0.145	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.4	-179.4	-63.1	-75.6	0	0	0	114.7	N457 C468 L469 L479 P499 G500	N457-Y472 HydrophobicContact CB-CD1 4.08Å; N457-Y472 HydrophobicContact CB-CD2 3.78Å; N457-Y472 HydrophobicContact CB-CE1 4.28Å; N457-Y472 HydrophobicContact CB-CE2 3.99Å; N457-Y472 HydrophobicContact CB-CG 3.8Å; N457-Y472 VanDerWaalsContact CG-CZ 3.45Å; N457-Y472 WeakPolarHBondContact ND2-CD1 3.41Å; N457-Y472 WeakPolarHBondContact ND2-CE1 3.4Å; C468-Y472 WeakPolarHBondContact CB-O 3.45Å; L469-Y472 HydrophobicContact CB-CD2 4.28Å; L469-Y472 PolarHBondContact O-N 3.36Å; L469-Y472 VanDerWaalsContact O-N 3.12Å; Y472-L479 WeakPolarHBondContact CA-O 3.45Å; Y472-P499 HydrophobicContact CE1-CB 4.48Å; Y472-P499 PolarHBondContact OH-O 2.81Å; Y472-G500 PolarHBondContact OH-N 2.8Å
473	V	86.4	Confident	82.3	Confident	69 Å²	69	66.9 Å²	66.9	42%	0.418	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-176	175.9	-70.3	0	0	0	0	111.4	C477 N478 L479 I481	V473-C477 CarbonylContact O-C 3.38Å; V473-C477 WeakPolarHBondContact O-CA 3.45Å; V473-N478 PolarHBondContact O-N 2.94Å; V473-L479 HydrophobicContact CG2-CB 3.91Å; V473-L479 PolarHBondContact N-O 2.94Å; V473-L479 WeakPolarHBondContact O-CB 3.44Å; V473-L479 PolarHBondContact O-N 3.09Å; V473-I481 HydrophobicContact CB-CG1 4.45Å; V473-I481 HydrophobicContact CG1-CD1 3.84Å; V473-I481 HydrophobicContact CG1-CG1 3.81Å; V473-I481 HydrophobicContact CG2-CG1 4.04Å
474	G	81.2	Confident	83.4	Confident	31 Å²	31	63 Å²	63	32%	0.32	34%	0.341	S	S	.	.	S	Bend	trans	87.6	155.1	-170.5	0	0	0	0	0	112.1	W476 C477	G474-W476 PolarHBondContact O-N 2.85Å; G474-W476 VanDerWaalsContact O-N 3.14Å; G474-C477 PolarHBondContact O-N 3.26Å; G474-C477 VanDerWaalsContact O-N 3.13Å
475	E	79.6	Confident	84.6	Confident	153 Å²	153	71.2 Å²	71.2	72%	0.715	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-29	-177.1	-176.8	177	-129.5	0	0	113
476	W	79.4	Confident	85.4	Confident	121 Å²	121	70.1 Å²	70.1	46%	0.458	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	11.9	-177.2	-52.7	89.8	0	0	0	112.8	H454 G474 N478	H454-W476 WeakPolarHBondContact CB-O 3.25Å; H454-W476 PolarHBondContact N-O 3.28Å; G474-W476 PolarHBondContact O-N 2.85Å; G474-W476 VanDerWaalsContact O-N 3.14Å; W476-N478 HydrophobicContact CB-CB 4.41Å; W476-N478 PolarHBondContact O-N 2.69Å
477	C	83.5	Confident	85.8	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.382	C	S	.	.	S	Bend	trans	57.5	30.4	-174.7	-46.4	0	0	0	0	113.9	N457 C468 V473 G474	N457-C477 HydrophobicContact CB-CB 3.86Å; N457-C477 VanDerWaalsContact CB-O 3.31Å; N457-C477 WeakPolarHBondContact CB-O 3.35Å; N457-C477 PolarHBondContact ND2-O 3.15Å; N457-C477 WeakPolarHBondContact O-CB 3.2Å; C468-C477 WeakPolarHBondContact CA-SG 3.03Å; C468-C477 HydrophobicContact CB-CB 3.77Å; C468-C477 WeakPolarHBondContact CB-SG 3.39Å; C468-C477 WeakPolarHBondContact SG-CA 3.49Å; C468-C477 WeakPolarHBondContact SG-CB 3.04Å; C468-C477 CovalentContact SG-SG 2.04Å; C468-C477 PolarHBondContact SG-SG 3.28Å; V473-C477 CarbonylContact O-C 3.38Å; V473-C477 WeakPolarHBondContact O-CA 3.45Å; G474-C477 PolarHBondContact O-N 3.26Å; G474-C477 VanDerWaalsContact O-N 3.13Å
478	N	84.3	Confident	85.9	Confident	77 Å²	77	71.8 Å²	71.8	41%	0.412	38%	0.383	S	S	.	.			trans	-95.6	1.1	-173.3	68.1	-69.9	0	0	0	113.6	H454 V473 W476	H454-N478 HydrophobicContact CB-CB 3.95Å; V473-N478 PolarHBondContact O-N 2.94Å; W476-N478 HydrophobicContact CB-CB 4.41Å; W476-N478 PolarHBondContact O-N 2.69Å
479	L	85.5	Confident	86	Confident	95 Å²	95	72.5 Å²	72.5	50%	0.497	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.7	176.3	-62.4	174.4	0	0	0	109.2	Y472 V473	Y472-L479 WeakPolarHBondContact CA-O 3.45Å; V473-L479 HydrophobicContact CG2-CB 3.91Å; V473-L479 PolarHBondContact N-O 2.94Å; V473-L479 WeakPolarHBondContact O-CB 3.44Å; V473-L479 PolarHBondContact O-N 3.09Å
480	D	89.6	Confident	86.2	Confident	55 Å²	55	74.1 Å²	74.1	29%	0.294	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	147	174.8	-171	35.7	0	0	0	111	D482 N497 P499 G500	D480-D482 PolarHBondContact O-N 3.38Å; D480-N497 PolarHBondContact OD2-ND2 3.44Å; D480-P499 WeakPolarHBondContact OD1-CA 3.46Å; D480-G500 PolarHBondContact OD1-N 2.68Å
481	I	87.3	Confident	86.3	Confident	39 Å²	39	69 Å²	69	20%	0.2	36%	0.358	C	S	.	.			trans	-91.6	97.8	171.3	-56.1	174.9	0	0	0	107.7	G471 V473 E483 L486 I488	G471-I481 WeakPolarHBondContact O-CB 3.29Å; G471-I481 WeakPolarHBondContact O-CG1 3.04Å; G471-I481 PolarHBondContact O-N 3.17Å; V473-I481 HydrophobicContact CB-CG1 4.45Å; V473-I481 HydrophobicContact CG1-CD1 3.84Å; V473-I481 HydrophobicContact CG1-CG1 3.81Å; V473-I481 HydrophobicContact CG2-CG1 4.04Å; I481-E483 VanDerWaalsContact C-N 3.3Å; I481-E483 HydrophobicContact CG2-CG 4.08Å; I481-E483 WeakPolarHBondContact O-CG 3.33Å; I481-E483 PolarHBondContact O-N 3.45Å; I481-L486 HydrophobicContact CG2-CD1 3.61Å; I481-I488 HydrophobicContact CG2-CD1 4.29Å
482	D	88.6	Confident	86.5	Confident	53 Å²	53	73.5 Å²	73.5	28%	0.283	38%	0.378	S	S	.	.			trans	-67.9	86.4	175.9	-175.7	-11.3	0	0	0	111.1	D480 C484 R485 L486 N497	D480-D482 PolarHBondContact O-N 3.38Å; D482-C484 PolarHBondContact O-N 3.19Å; D482-C484 PolarHBondContact OD1-N 2.99Å; D482-R485 HydrophobicContact CB-CB 4.02Å; D482-R485 PolarHBondContact O-N 2.87Å; D482-R485 WeakPolarHBondContact OD1-CB 3.48Å; D482-R485 PolarHBondContact OD1-N 2.79Å; D482-R485 WeakPolarHBondContact OD2-CB 3.46Å; D482-L486 WeakPolarHBondContact O-CB 3.48Å; D482-L486 VanDerWaalsContact O-CG 3.32Å; D482-L486 WeakPolarHBondContact O-CG 3.46Å; D482-L486 PolarHBondContact O-N 2.84Å; D482-N497 WeakPolarHBondContact CA-OD1 3.31Å
483	E	91.9	Very high	86.5	Confident	29 Å²	29	73.8 Å²	73.8	14%	0.136	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.9	-174.5	-71.5	144.4	151.2	0	0	112.1	I481 G487 I488 H489 N497 S501 Y502	I481-E483 VanDerWaalsContact C-N 3.3Å; I481-E483 HydrophobicContact CG2-CG 4.08Å; I481-E483 WeakPolarHBondContact O-CG 3.33Å; I481-E483 PolarHBondContact O-N 3.45Å; E483-G487 PolarHBondContact O-N 3.5Å; E483-G487 VanDerWaalsContact O-N 3.16Å; E483-I488 HydrophobicContact CB-CD1 4.39Å; E483-I488 HydrophobicContact CB-CG1 3.84Å; E483-I488 HydrophobicContact CG-CD1 3.85Å; E483-I488 HydrophobicContact CG-CG1 3.84Å; E483-I488 PolarHBondContact O-N 2.78Å; E483-H489 PolarHBondContact O-N 3.03Å; E483-N497 PolarHBondContact N-OD1 3.36Å; E483-S501 VanDerWaalsContact OE2-CA 3.25Å; E483-S501 WeakPolarHBondContact OE2-CA 3.41Å; E483-Y502 HydrophobicContact CB-CD1 3.59Å; E483-Y502 HydrophobicContact CB-CE1 4.33Å; E483-Y502 HydrophobicContact CB-CG 4.38Å; E483-Y502 HydrophobicContact CG-CD1 4.11Å; E483-Y502 VanDerWaalsContact OE2-CD1 3.32Å; E483-Y502 WeakPolarHBondContact OE2-CD1 3.19Å; E483-Y502 PolarHBondContact OE2-N 3.47Å
484	C	91.5	Very high	86.6	Confident	30 Å²	30	72.6 Å²	72.6	20%	0.203	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-49.1	172.7	-57.5	0	0	0	0	110.9	D482 L486 G487 C495 I496 N497	D482-C484 PolarHBondContact O-N 3.19Å; D482-C484 PolarHBondContact OD1-N 2.99Å; C484-L486 PolarHBondContact O-N 3.14Å; C484-G487 PolarHBondContact O-N 3.1Å; C484-C495 WeakPolarHBondContact CA-SG 3.22Å; C484-C495 HydrophobicContact CB-CB 3.84Å; C484-C495 WeakPolarHBondContact CB-SG 3.14Å; C484-C495 WeakPolarHBondContact SG-CB 3.3Å; C484-C495 CovalentContact SG-SG 2.04Å; C484-C495 PolarHBondContact SG-SG 3.16Å; C484-I496 PolarHBondContact SG-N 3.08Å; C484-N497 HydrophobicContact CB-CB 4.43Å; C484-N497 PolarHBondContact SG-N 3.47Å
485	R	88.5	Confident	87.2	Confident	213 Å²	213	72.4 Å²	72.4	80%	0.804	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-30.2	177.3	-179.3	179	175.3	-176.8	-0.7	113.6	D482 G487	D482-R485 HydrophobicContact CB-CB 4.02Å; D482-R485 PolarHBondContact O-N 2.87Å; D482-R485 WeakPolarHBondContact OD1-CB 3.48Å; D482-R485 PolarHBondContact OD1-N 2.79Å; D482-R485 WeakPolarHBondContact OD2-CB 3.46Å; R485-G487 VanDerWaalsContact C-N 3.31Å
486	L	87.3	Confident	87.7	Confident	109 Å²	109	68 Å²	68	57%	0.571	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-10	175.2	-70	173.7	0	0	0	113.3	I481 D482 C484 I488	I481-L486 HydrophobicContact CG2-CD1 3.61Å; D482-L486 WeakPolarHBondContact O-CB 3.48Å; D482-L486 VanDerWaalsContact O-CG 3.32Å; D482-L486 WeakPolarHBondContact O-CG 3.46Å; D482-L486 PolarHBondContact O-N 2.84Å; C484-L486 PolarHBondContact O-N 3.14Å; L486-I488 VanDerWaalsContact C-N 3.26Å; L486-I488 HydrophobicContact CB-CD1 4.12Å; L486-I488 HydrophobicContact CB-CG1 3.98Å; L486-I488 HydrophobicContact CB-CG2 4.42Å; L486-I488 HydrophobicContact CD1-CD1 4.1Å; L486-I488 PolarHBondContact O-N 3.27Å
487	G	84	Confident	88.1	Confident	55 Å²	55	64.6 Å²	64.6	57%	0.567	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	24.8	-179.4	0	0	0	0	0	114	E483 C484 R485	E483-G487 PolarHBondContact O-N 3.5Å; E483-G487 VanDerWaalsContact O-N 3.16Å; C484-G487 PolarHBondContact O-N 3.1Å; R485-G487 VanDerWaalsContact C-N 3.31Å
488	I	87.6	Confident	88.2	Confident	95 Å²	95	66.8 Å²	66.8	49%	0.487	35%	0.351	S	S	.	.			trans	-104.2	13.5	-178.9	61.8	178	0	0	0	112.6	I481 E483 L486	I481-I488 HydrophobicContact CG2-CD1 4.29Å; E483-I488 HydrophobicContact CB-CD1 4.39Å; E483-I488 HydrophobicContact CB-CG1 3.84Å; E483-I488 HydrophobicContact CG-CD1 3.85Å; E483-I488 HydrophobicContact CG-CG1 3.84Å; E483-I488 PolarHBondContact O-N 2.78Å; L486-I488 VanDerWaalsContact C-N 3.26Å; L486-I488 HydrophobicContact CB-CD1 4.12Å; L486-I488 HydrophobicContact CB-CG1 3.98Å; L486-I488 HydrophobicContact CB-CG2 4.42Å; L486-I488 HydrophobicContact CD1-CD1 4.1Å; L486-I488 PolarHBondContact O-N 3.27Å
489	H	86.3	Confident	88.3	Confident	60 Å²	60	68 Å²	68	28%	0.278	36%	0.363	S	S	.	.			trans	-81.5	146.3	172.8	63.2	92.1	0	0	0	112.1	E483 C495 Y502	E483-H489 PolarHBondContact O-N 3.03Å; H489-C495 HydrophobicContact CB-CB 4.28Å; H489-C495 WeakPolarHBondContact CB-SG 3.42Å; H489-Y502 HydrophobicContact CB-CD1 4.07Å; H489-Y502 HydrophobicContact CB-CD2 3.93Å; H489-Y502 HydrophobicContact CB-CE1 4.12Å; H489-Y502 HydrophobicContact CB-CE2 3.98Å; H489-Y502 HydrophobicContact CB-CG 3.98Å
490	N	87.9	Confident	88.2	Confident	108 Å²	108	64.3 Å²	64.3	58%	0.578	35%	0.348	S	S	*	.			trans	-104	24.3	175.9	-63.8	40.4	0	0	0	112.2	Y502 K518	N490-Y502 PolarHBondContact N-OH 2.76Å; N490-K518 HydrophobicContact CB-CD 3.79Å; N490-K518 WeakPolarHBondContact O-CB 3.43Å
491	C	88.7	Confident	88.1	Confident	15 Å²	15	64.4 Å²	64.4	10%	0.101	35%	0.354	C	S	.	.			trans	-72.4	137.5	172.8	-52.6	0	0	0	0	110.7	V494 C495 Y502 C504	C491-V494 WeakPolarHBondContact CB-O 3.48Å; C491-C495 HydrophobicContact CB-CB 4.49Å; C491-Y502 WeakPolarHBondContact SG-CD2 3.39Å; C491-C504 WeakPolarHBondContact CA-SG 3.25Å; C491-C504 HydrophobicContact CB-CB 3.63Å; C491-C504 WeakPolarHBondContact CB-SG 3.38Å; C491-C504 WeakPolarHBondContact SG-CA 3.45Å; C491-C504 WeakPolarHBondContact SG-CB 3.38Å; C491-C504 CovalentContact SG-SG 2.04Å; C491-C504 PolarHBondContact SG-SG 3.37Å
492	E	89.3	Confident	88.3	Confident	99 Å²	99	64.5 Å²	64.5	46%	0.463	35%	0.352	S	S	.	.	S	Bend	trans	-69.2	-34.9	175.9	-173.4	-163.1	114.8	0	0	112.5	K518 S519 C520	E492-K518 WeakPolarHBondContact CB-O 3.34Å; E492-K518 PolarHBondContact N-O 2.03Å; E492-S519 WeakPolarHBondContact OE2-CA 3.28Å; E492-S519 WeakPolarHBondContact OE2-CB 3.49Å; E492-C520 WeakPolarHBondContact OE1-CB 3.31Å; E492-C520 PolarHBondContact OE2-N 3.06Å
493	Q	88.9	Confident	88.4	Confident	44 Å²	44	66.3 Å²	66.3	21%	0.206	36%	0.359	C	S	.	.	S	Bend	trans	-127.9	-78.3	-167.1	-63.7	-164.7	17	0	0	113.3	H507 C520	Q493-H507 PolarHBondContact OE1-ND1 2.79Å; Q493-C520 HydrophobicContact CG-CB 4.15Å
494	V	88.4	Confident	88.4	Confident	44 Å²	44	65.5 Å²	65.5	27%	0.267	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.6	-178.4	-174.6	0	0	0	0	109.7	C491 I496 C504 E505	C491-V494 WeakPolarHBondContact CB-O 3.48Å; V494-I496 HydrophobicContact CG1-CG1 4.28Å; V494-C504 WeakPolarHBondContact O-CA 2.99Å; V494-E505 HydrophobicContact CB-CB 4.03Å; V494-E505 WeakPolarHBondContact CB-O 3.38Å; V494-E505 HydrophobicContact CG1-CB 4.37Å; V494-E505 PolarHBondContact N-O 2.93Å; V494-E505 PolarHBondContact O-N 3Å
495	C	93.2	Very high	88.2	Confident	27 Å²	27	68.5 Å²	68.5	18%	0.182	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.8	170.9	-173.9	0	0	0	0	109.1	C484 H489 C491	C484-C495 WeakPolarHBondContact CA-SG 3.22Å; C484-C495 HydrophobicContact CB-CB 3.84Å; C484-C495 WeakPolarHBondContact CB-SG 3.14Å; C484-C495 WeakPolarHBondContact SG-CB 3.3Å; C484-C495 CovalentContact SG-SG 2.04Å; C484-C495 PolarHBondContact SG-SG 3.16Å; H489-C495 HydrophobicContact CB-CB 4.28Å; H489-C495 WeakPolarHBondContact CB-SG 3.42Å; C491-C495 HydrophobicContact CB-CB 4.49Å
496	I	90.2	Very high	88.1	Confident	59 Å²	59	59.8 Å²	59.8	30%	0.303	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122	172	-64.6	174	0	0	0	107.8	C484 V494 Y502 Q503 E505	C484-I496 PolarHBondContact SG-N 3.08Å; V494-I496 HydrophobicContact CG1-CG1 4.28Å; I496-Y502 CarbonylContact O-C 3.51Å; I496-Y502 WeakPolarHBondContact O-CA 3.41Å; I496-Q503 HydrophobicContact CB-CG 3.79Å; I496-Q503 HydrophobicContact CG2-CG 4.15Å; I496-Q503 PolarHBondContact N-O 2.8Å; I496-Q503 PolarHBondContact O-N 3.46Å; I496-E505 HydrophobicContact CD1-CG 4.02Å; I496-E505 VanDerWaalsContact CD1-OE1 3.26Å; I496-E505 WeakPolarHBondContact CD1-OE1 3.28Å
497	N	88.4	Confident	87.8	Confident	51 Å²	51	59.9 Å²	59.9	27%	0.273	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	139	180	-170.3	59.3	0	0	0	110.7	D480 D482 E483 C484	D480-N497 PolarHBondContact OD2-ND2 3.44Å; D482-N497 WeakPolarHBondContact CA-OD1 3.31Å; E483-N497 PolarHBondContact N-OD1 3.36Å; C484-N497 HydrophobicContact CB-CB 4.43Å; C484-N497 PolarHBondContact SG-N 3.47Å
498	T	85.6	Confident	87.1	Confident	45 Å²	45	63.3 Å²	63.3	28%	0.276	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	153.3	174.3	79.1	0	0	0	0	109.3	G500 S501 Q503	T498-G500 PolarHBondContact O-N 2.63Å; T498-S501 CarbonylContact C-O 3.5Å; T498-S501 WeakPolarHBondContact CA-O 3.19Å; T498-S501 WeakPolarHBondContact CB-O 3.36Å; T498-S501 PolarHBondContact N-O 3.38Å; T498-S501 CarbonylContact O-C 3.56Å; T498-S501 PolarHBondContact O-N 3.5Å; T498-S501 PolarHBondContact OG1-O 2.88Å; T498-Q503 HydrophobicContact CG2-CG 4.3Å
499	P	84.7	Confident	86.1	Confident	102 Å²	102	60.5 Å²	60.5	66%	0.662	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	108.4	-177.8	-28.8	37	0	0	0	113.2	Y472 D480	Y472-P499 HydrophobicContact CE1-CB 4.48Å; Y472-P499 PolarHBondContact OH-O 2.81Å; D480-P499 WeakPolarHBondContact OD1-CA 3.46Å
500	G	83.6	Confident	85.9	Confident	18 Å²	18	62.4 Å²	62.4	19%	0.186	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	5.7	-179.6	0	0	0	0	0	116.8	Y472 D480 T498	Y472-G500 PolarHBondContact OH-N 2.8Å; D480-G500 PolarHBondContact OD1-N 2.68Å; T498-G500 PolarHBondContact O-N 2.63Å
501	S	89.2	Confident	85.3	Confident	58 Å²	58	61.4 Å²	61.4	41%	0.406	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	150.9	177.2	-175.9	0	0	0	0	112.7	E483 T498	E483-S501 VanDerWaalsContact OE2-CA 3.25Å; E483-S501 WeakPolarHBondContact OE2-CA 3.41Å; T498-S501 CarbonylContact C-O 3.5Å; T498-S501 WeakPolarHBondContact CA-O 3.19Å; T498-S501 WeakPolarHBondContact CB-O 3.36Å; T498-S501 PolarHBondContact N-O 3.38Å; T498-S501 CarbonylContact O-C 3.56Å; T498-S501 PolarHBondContact O-N 3.5Å; T498-S501 PolarHBondContact OG1-O 2.88Å
502	Y	90.3	Very high	85	Confident	40 Å²	40	63.2 Å²	63.2	16%	0.157	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	156.6	161.1	64	-87.5	0	0	0	113.4	E483 H489 N490 C491 I496 K518	E483-Y502 HydrophobicContact CB-CD1 3.59Å; E483-Y502 HydrophobicContact CB-CE1 4.33Å; E483-Y502 HydrophobicContact CB-CG 4.38Å; E483-Y502 HydrophobicContact CG-CD1 4.11Å; E483-Y502 VanDerWaalsContact OE2-CD1 3.32Å; E483-Y502 WeakPolarHBondContact OE2-CD1 3.19Å; E483-Y502 PolarHBondContact OE2-N 3.47Å; H489-Y502 HydrophobicContact CB-CD1 4.07Å; H489-Y502 HydrophobicContact CB-CD2 3.93Å; H489-Y502 HydrophobicContact CB-CE1 4.12Å; H489-Y502 HydrophobicContact CB-CE2 3.98Å; H489-Y502 HydrophobicContact CB-CG 3.98Å; N490-Y502 PolarHBondContact N-OH 2.76Å; C491-Y502 WeakPolarHBondContact SG-CD2 3.39Å; I496-Y502 CarbonylContact O-C 3.51Å; I496-Y502 WeakPolarHBondContact O-CA 3.41Å; Y502-K518 PolarHBondContact OH-NZ 3.11Å
503	Q	90.8	Very high	84.7	Confident	92 Å²	92	59.9 Å²	59.9	43%	0.43	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	155.4	159.9	72.9	177.3	28.4	0	0	110.5	I496 T498 E505	I496-Q503 HydrophobicContact CB-CG 3.79Å; I496-Q503 HydrophobicContact CG2-CG 4.15Å; I496-Q503 PolarHBondContact N-O 2.8Å; I496-Q503 PolarHBondContact O-N 3.46Å; T498-Q503 HydrophobicContact CG2-CG 4.3Å; Q503-E505 PolarHBondContact NE2-OE1 2.86Å
504	C	91.8	Very high	84.2	Confident	12 Å²	12	65.5 Å²	65.5	8%	0.081	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.1	-179.6	-57.1	0	0	0	0	111.5	C491 V494 L512 R517	C491-C504 WeakPolarHBondContact CA-SG 3.25Å; C491-C504 HydrophobicContact CB-CB 3.63Å; C491-C504 WeakPolarHBondContact CB-SG 3.38Å; C491-C504 WeakPolarHBondContact SG-CA 3.45Å; C491-C504 WeakPolarHBondContact SG-CB 3.38Å; C491-C504 CovalentContact SG-SG 2.04Å; C491-C504 PolarHBondContact SG-SG 3.37Å; V494-C504 WeakPolarHBondContact O-CA 2.99Å; C504-L512 HydrophobicContact CB-CD1 4.03Å; C504-L512 WeakPolarHBondContact O-CD2 3.45Å; C504-R517 WeakPolarHBondContact CB-O 3.03Å
505	E	87.4	Confident	83.8	Confident	93 Å²	93	69.5 Å²	69.5	44%	0.435	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	168	172.2	-74.4	-175.8	-163.2	0	0	110.7	V494 I496 Q503	V494-E505 HydrophobicContact CB-CB 4.03Å; V494-E505 WeakPolarHBondContact CB-O 3.38Å; V494-E505 HydrophobicContact CG1-CB 4.37Å; V494-E505 PolarHBondContact N-O 2.93Å; V494-E505 PolarHBondContact O-N 3Å; I496-E505 HydrophobicContact CD1-CG 4.02Å; I496-E505 VanDerWaalsContact CD1-OE1 3.26Å; I496-E505 WeakPolarHBondContact CD1-OE1 3.28Å; Q503-E505 PolarHBondContact NE2-OE1 2.86Å
506	C	85.9	Confident	83.4	Confident	29 Å²	29	71.3 Å²	71.3	20%	0.196	40%	0.398	C	S	.	.			trans	-119.7	151.6	-177.6	-55	0	0	0	0	110.4	L512 C520	C506-L512 VanDerWaalsContact SG-CA 3.53Å; C506-L512 PolarHBondContact SG-N 2.8Å; C506-L512 VanDerWaalsContact SG-N 3.43Å; C506-C520 VanDerWaalsContact CA-SG 3.59Å; C506-C520 HydrophobicContact CB-CB 3.8Å; C506-C520 WeakPolarHBondContact CB-SG 3.14Å; C506-C520 WeakPolarHBondContact SG-CB 3.44Å; C506-C520 CovalentContact SG-SG 2.03Å; C506-C520 PolarHBondContact SG-SG 2.69Å
507	H	82.1	Confident	83	Confident	111 Å²	111	77 Å²	77	51%	0.514	42%	0.416	S	S	.	.			trans	-67.9	157.6	172.3	-60.6	92.5	0	0	0	111.1	Q493 G509 Y510	Q493-H507 PolarHBondContact OE1-ND1 2.79Å; H507-G509 PolarHBondContact O-N 2.89Å; H507-Y510 PolarHBondContact O-N 3.05Å; H507-Y510 VanDerWaalsContact O-N 3.08Å
508	S	69.9	Low	83	Confident	127 Å²	127	78.1 Å²	78.1	89%	0.888	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	129.5	179.3	-50.5	0	0	0	0	112
509	G	66.1	Low	82.9	Confident	36 Å²	36	78.2 Å²	78.2	37%	0.371	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.5	-3.4	-173.3	0	0	0	0	0	114.6	H507 V523	H507-G509 PolarHBondContact O-N 2.89Å; G509-V523 PolarHBondContact O-N 3.32Å
510	Y	81.8	Confident	82.9	Confident	100 Å²	100	73.9 Å²	73.9	39%	0.392	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	150.4	175.2	-67	-98.9	0	0	0	112.3	H507 C520 H521 E522	H507-Y510 PolarHBondContact O-N 3.05Å; H507-Y510 VanDerWaalsContact O-N 3.08Å; Y510-C520 HydrophobicContact CD1-CB 4.17Å; Y510-C520 HydrophobicContact CG-CB 4.38Å; Y510-H521 CarbonylContact C-O 3.54Å; Y510-H521 VanDerWaalsContact CA-O 3.25Å; Y510-H521 WeakPolarHBondContact CA-O 3.36Å; Y510-E522 HydrophobicContact CD1-CB 4.26Å; Y510-E522 HydrophobicContact CE1-CB 4Å
511	K	75.6	Confident	82.8	Confident	87 Å²	87	78.1 Å²	78.1	38%	0.378	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.1	173.8	-88.5	179.9	169.3	-174	0	111.8	N513 C520 H521 V523 D538	K511-N513 PolarHBondContact O-N 2.85Å; K511-C520 CarbonylContact O-C 3.45Å; K511-C520 WeakPolarHBondContact O-CA 3.23Å; K511-H521 PolarHBondContact N-O 3.31Å; K511-H521 PolarHBondContact O-N 2.62Å; K511-V523 HydrophobicContact CB-CG2 4.07Å; K511-V523 HydrophobicContact CD-CG2 3.92Å; K511-V523 HydrophobicContact CG-CG2 3.68Å; K511-D538 WeakPolarHBondContact CE-O 3.2Å; K511-D538 WeakPolarHBondContact CE-OD1 3.38Å; K511-D538 PolarHBondContact NZ-O 2.97Å; K511-D538 IonicContact NZ-OD1 2.97Å; K511-D538 PolarHBondContact NZ-OD1 3.12Å
512	L	81.3	Confident	81.8	Confident	53 Å²	53	82 Å²	82	28%	0.277	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	129.2	176.1	-167	75.7	0	0	0	110.5	C504 C506 L514 R517	C504-L512 HydrophobicContact CB-CD1 4.03Å; C504-L512 WeakPolarHBondContact O-CD2 3.45Å; C506-L512 VanDerWaalsContact SG-CA 3.53Å; C506-L512 PolarHBondContact SG-N 2.8Å; C506-L512 VanDerWaalsContact SG-N 3.43Å; L512-L514 PolarHBondContact O-N 2.79Å; L512-L514 VanDerWaalsContact O-N 3.1Å; L512-R517 HydrophobicContact CD2-CB 4.02Å; L512-R517 HydrophobicContact CD2-CG 4.37Å
513	N	83.5	Confident	80.6	Confident	30 Å²	30	81.6 Å²	81.6	16%	0.16	42%	0.421	C	S	.	.			trans	-64.7	111.4	178.1	-173.7	-3.5	0	0	0	110	K511 T515 D516 R517 S519 H521	K511-N513 PolarHBondContact O-N 2.85Å; N513-T515 PolarHBondContact O-N 3.03Å; N513-T515 VanDerWaalsContact OD1-CB 3.26Å; N513-T515 WeakPolarHBondContact OD1-CB 3.3Å; N513-T515 PolarHBondContact OD1-N 3.16Å; N513-T515 PolarHBondContact OD1-OG1 2.77Å; N513-D516 PolarHBondContact ND2-OD2 3.4Å; N513-D516 PolarHBondContact O-N 3Å; N513-R517 VanDerWaalsContact O-CA 3.31Å; N513-R517 WeakPolarHBondContact O-CA 3.01Å; N513-R517 PolarHBondContact O-N 3.16Å; N513-S519 WeakPolarHBondContact CB-O 2.99Å; N513-S519 PolarHBondContact N-O 3.18Å; N513-H521 WeakPolarHBondContact CB-NE2 3.19Å; N513-H521 VanDerWaalsContact CG-NE2 3.27Å; N513-H521 PolarHBondContact ND2-NE2 3.25Å; N513-H521 VanDerWaalsContact ND2-NE2 3.17Å
514	L	77.9	Confident	79.4	Confident	161 Å²	161	82.4 Å²	82.4	84%	0.843	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.6	178.9	-61	177.5	0	0	0	113.4	L512	L512-L514 PolarHBondContact O-N 2.79Å; L512-L514 VanDerWaalsContact O-N 3.1Å
515	T	80.6	Confident	78.3	Confident	128 Å²	128	82.7 Å²	82.7	79%	0.785	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-38.1	-178.5	-34.5	0	0	0	0	113.5	N513	N513-T515 PolarHBondContact O-N 3.03Å; N513-T515 VanDerWaalsContact OD1-CB 3.26Å; N513-T515 WeakPolarHBondContact OD1-CB 3.3Å; N513-T515 PolarHBondContact OD1-N 3.16Å; N513-T515 PolarHBondContact OD1-OG1 2.77Å
516	D	85.3	Confident	77.6	Confident	65 Å²	65	85.1 Å²	85.1	35%	0.348	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-21.1	-176.4	58.2	51.7	0	0	0	113.8	N513 K518 S519	N513-D516 PolarHBondContact ND2-OD2 3.4Å; N513-D516 PolarHBondContact O-N 3Å; D516-K518 PolarHBondContact O-N 3.23Å; D516-K518 PolarHBondContact OD1-N 3.35Å; D516-S519 PolarHBondContact OD1-N 2.75Å
517	R	81.9	Confident	77.1	Confident	180 Å²	180	86.5 Å²	86.5	68%	0.679	46%	0.459	S	S	*	.	S	Bend	trans	53.2	35.6	-175	-61.9	-178.2	-66.6	172.8	1.8	113.9	C504 L512 N513	C504-R517 WeakPolarHBondContact CB-O 3.03Å; L512-R517 HydrophobicContact CD2-CB 4.02Å; L512-R517 HydrophobicContact CD2-CG 4.37Å; N513-R517 VanDerWaalsContact O-CA 3.31Å; N513-R517 WeakPolarHBondContact O-CA 3.01Å; N513-R517 PolarHBondContact O-N 3.16Å
518	K	86.7	Confident	76.9	Confident	74 Å²	74	91.6 Å²	91.6	32%	0.322	47%	0.474	S	S	.	.	S	Bend	trans	-139.5	-37.3	-175.8	-76.1	179.1	174.2	-173.8	0	113.5	N490 E492 Y502 D516	N490-K518 HydrophobicContact CB-CD 3.79Å; N490-K518 WeakPolarHBondContact O-CB 3.43Å; E492-K518 WeakPolarHBondContact CB-O 3.34Å; E492-K518 PolarHBondContact N-O 2.03Å; Y502-K518 PolarHBondContact OH-NZ 3.11Å; D516-K518 PolarHBondContact O-N 3.23Å; D516-K518 PolarHBondContact OD1-N 3.35Å
519	S	85.4	Confident	77.5	Confident	47 Å²	47	87.1 Å²	87.1	33%	0.329	44%	0.442	S	S	.	.			trans	-93.3	159.7	177.6	-73	0	0	0	0	112.7	E492 N513 D516	E492-S519 WeakPolarHBondContact OE2-CA 3.28Å; E492-S519 WeakPolarHBondContact OE2-CB 3.49Å; N513-S519 WeakPolarHBondContact CB-O 2.99Å; N513-S519 PolarHBondContact N-O 3.18Å; D516-S519 PolarHBondContact OD1-N 2.75Å
520	C	84.4	Confident	78.3	Confident	11 Å²	11	87.8 Å²	87.8	7%	0.074	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.1	-171.1	-67.7	0	0	0	0	111.1	E492 Q493 C506 Y510 K511	E492-C520 WeakPolarHBondContact OE1-CB 3.31Å; E492-C520 PolarHBondContact OE2-N 3.06Å; Q493-C520 HydrophobicContact CG-CB 4.15Å; C506-C520 VanDerWaalsContact CA-SG 3.59Å; C506-C520 HydrophobicContact CB-CB 3.8Å; C506-C520 WeakPolarHBondContact CB-SG 3.14Å; C506-C520 WeakPolarHBondContact SG-CB 3.44Å; C506-C520 CovalentContact SG-SG 2.03Å; C506-C520 PolarHBondContact SG-SG 2.69Å; Y510-C520 HydrophobicContact CD1-CB 4.17Å; Y510-C520 HydrophobicContact CG-CB 4.38Å; K511-C520 CarbonylContact O-C 3.45Å; K511-C520 WeakPolarHBondContact O-CA 3.23Å
521	H	81.4	Confident	78	Confident	107 Å²	107	89.9 Å²	89.9	50%	0.495	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134.7	179	-68.6	-79	0	0	0	111.4	Y510 K511 N513	Y510-H521 CarbonylContact C-O 3.54Å; Y510-H521 VanDerWaalsContact CA-O 3.25Å; Y510-H521 WeakPolarHBondContact CA-O 3.36Å; K511-H521 PolarHBondContact N-O 3.31Å; K511-H521 PolarHBondContact O-N 2.62Å; N513-H521 WeakPolarHBondContact CB-NE2 3.19Å; N513-H521 VanDerWaalsContact CG-NE2 3.27Å; N513-H521 PolarHBondContact ND2-NE2 3.25Å; N513-H521 VanDerWaalsContact ND2-NE2 3.17Å
522	E	66.6	Low	78	Confident	138 Å²	138	92.2 Å²	92.2	65%	0.645	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	132.6	178	-172.1	-175.3	167.6	0	0	111.7	Y510 T524	Y510-E522 HydrophobicContact CD1-CB 4.26Å; Y510-E522 HydrophobicContact CE1-CB 4Å; E522-T524 PolarHBondContact O-N 2.91Å
523	V	65.3	Low	78.1	Confident	32 Å²	32	90.5 Å²	90.5	19%	0.194	46%	0.463	C	S	.	.			trans	-93.7	92.5	177	-174.5	0	0	0	0	109.6	G509 K511 C525	G509-V523 PolarHBondContact O-N 3.32Å; K511-V523 HydrophobicContact CB-CG2 4.07Å; K511-V523 HydrophobicContact CD-CG2 3.92Å; K511-V523 HydrophobicContact CG-CG2 3.68Å; V523-C525 PolarHBondContact O-N 3.36Å; V523-C525 VanDerWaalsContact O-N 3.11Å
524	T	66.5	Low	78	Confident	110 Å²	110	89.7 Å²	89.7	68%	0.675	46%	0.461	S	S	*	.			trans	-71.7	103.7	177.2	53.6	0	0	0	0	111.8	E522	E522-T524 PolarHBondContact O-N 2.91Å
525	C	68	Low	78.3	Confident	18 Å²	18	87.4 Å²	87.4	12%	0.122	45%	0.445	C	S	.	.			trans	-65.5	143.1	172.1	-110.9	0	0	0	0	113	V523 P527 C536 G540 I541	V523-C525 PolarHBondContact O-N 3.36Å; V523-C525 VanDerWaalsContact O-N 3.11Å; C525-P527 CarbonylContact C-O 3.29Å; C525-P527 CarbonylContact O-C 3.48Å; C525-C536 VanDerWaalsContact CA-SG 3.54Å; C525-C536 HydrophobicContact CB-CB 3.96Å; C525-C536 WeakPolarHBondContact CB-SG 3.42Å; C525-C536 WeakPolarHBondContact SG-CA 3.35Å; C525-C536 WeakPolarHBondContact SG-CB 3.29Å; C525-C536 CovalentContact SG-SG 2.03Å; C525-C536 PolarHBondContact SG-SG 2.03Å; C525-G540 WeakPolarHBondContact CA-O 3.18Å; C525-G540 VanDerWaalsContact SG-C 3.55Å; C525-G540 PolarHBondContact SG-O 3.29Å; C525-I541 VanDerWaalsContact SG-C 3.52Å
526	N	72.9	Confident	78.3	Confident	144 Å²	144	83.1 Å²	83.1	77%	0.77	42%	0.419	S	S	*	.	S	Bend	trans	-137.6	110.8	174.4	-173.3	22.4	0	0	0	111.7	G540	N526-G540 PolarHBondContact N-O 3.01Å
527	P	76.6	Confident	77.7	Confident	58 Å²	58	81.5 Å²	81.5	38%	0.377	41%	0.413	S	S	.	.	S	Bend	cis	-66.3	165.9	-1.2	31.8	-37.9	0	0	0	112.3	C525 P551 D552	C525-P527 CarbonylContact C-O 3.29Å; C525-P527 CarbonylContact O-C 3.48Å; P527-P551 HydrophobicContact CG-CB 4.31Å; P527-P551 VanDerWaalsContact CG-O 3.23Å; P527-P551 WeakPolarHBondContact CG-O 3.49Å; P527-D552 HydrophobicContact CG-CB 4.44Å
528	R	78	Confident	77	Confident	217 Å²	217	78.2 Å²	78.2	82%	0.819	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-68.6	131.7	172.2	-71.8	178.1	171.7	163.1	-4.3	109.3
529	C	81	Confident	76.3	Confident	33 Å²	33	81 Å²	81	22%	0.223	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-57.9	140.3	169.9	-65.8	0	0	0	0	111.4	C542	C529-C542 WeakPolarHBondContact CA-SG 3.01Å; C529-C542 HydrophobicContact CB-CB 4.26Å; C529-C542 WeakPolarHBondContact CB-SG 3.18Å; C529-C542 VanDerWaalsContact SG-CA 3.54Å; C529-C542 WeakPolarHBondContact SG-CB 3.29Å; C529-C542 CovalentContact SG-SG 2.03Å; C529-C542 PolarHBondContact SG-SG 3.43Å
530	T	83	Confident	75.7	Confident	50 Å²	50	79.7 Å²	79.7	31%	0.307	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-65.6	138.7	166.5	-53.2	0	0	0	0	109.5	N532 Q533 D552	T530-N532 PolarHBondContact O-N 3.36Å; T530-Q533 PolarHBondContact O-N 2.04Å; T530-D552 WeakPolarHBondContact CB-O 3.47Å; T530-D552 PolarHBondContact N-O 3.23Å; T530-D552 PolarHBondContact OG1-O 2.82Å
531	I	76.4	Confident	75.4	Confident	145 Å²	145	84.3 Å²	84.3	74%	0.744	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	124.9	-166.9	-62.2	173.5	0	0	0	110.3	Q533	I531-Q533 PolarHBondContact O-N 3.49Å
532	N	75	Confident	75.4	Confident	135 Å²	135	79.9 Å²	79.9	72%	0.722	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	3.7	-178	-55.5	-27.9	0	0	0	116.9	T530 R545	T530-N532 PolarHBondContact O-N 3.36Å; N532-R545 VanDerWaalsContact O-CD 3.31Å; N532-R545 WeakPolarHBondContact O-CD 3.17Å; N532-R545 PolarHBondContact O-NE 2.05Å
533	Q	83.7	Confident	76.3	Confident	18 Å²	18	75.7 Å²	75.7	8%	0.084	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-22	-176.2	-64.1	177	-14.9	0	0	113.8	T530 I531 R545 F548 C553 Y575	T530-Q533 PolarHBondContact O-N 2.04Å; I531-Q533 PolarHBondContact O-N 3.49Å; Q533-R545 WeakPolarHBondContact O-CB 3.02Å; Q533-R545 PolarHBondContact O-N 2.83Å; Q533-F548 HydrophobicContact CB-CD1 3.95Å; Q533-F548 HydrophobicContact CB-CD2 4.22Å; Q533-F548 HydrophobicContact CB-CE1 4.24Å; Q533-F548 HydrophobicContact CB-CE2 4.47Å; Q533-F548 HydrophobicContact CB-CG 3.94Å; Q533-F548 HydrophobicContact CB-CZ 4.49Å; Q533-F548 HydrophobicContact CG-CD1 3.83Å; Q533-F548 HydrophobicContact CG-CD2 4.41Å; Q533-F548 HydrophobicContact CG-CE1 3.62Å; Q533-F548 HydrophobicContact CG-CE2 4.21Å; Q533-F548 HydrophobicContact CG-CG 4.23Å; Q533-F548 HydrophobicContact CG-CZ 3.82Å; Q533-C553 HydrophobicContact CB-CB 4.14Å; Q533-C553 PolarHBondContact OE1-O 3.31Å; Q533-C553 VanDerWaalsContact OE1-O 3.08Å; Q533-Y575 VanDerWaalsContact NE2-CZ 3.27Å; Q533-Y575 PolarHBondContact NE2-OH 3.32Å
534	G	81.7	Confident	77.2	Confident	12 Å²	12	76.2 Å²	76.2	12%	0.124	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	174.1	169.6	0	0	0	0	0	112	T543	G534-T543 CarbonylContact C-O 3.55Å; G534-T543 WeakPolarHBondContact CA-O 3.47Å
535	F	84.1	Confident	78.2	Confident	114 Å²	114	76.1 Å²	76.1	50%	0.5	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144	167.5	62.8	-84.8	0	0	0	109.1	S537 T543	F535-S537 PolarHBondContact O-N 2.83Å; F535-T543 WeakPolarHBondContact CD1-O 3.37Å; F535-T543 WeakPolarHBondContact CD2-OG1 3.06Å; F535-T543 VanDerWaalsContact CE2-OG1 3.23Å; F535-T543 WeakPolarHBondContact CE2-OG1 3.02Å; F535-T543 HydrophobicContact CZ-CG2 4.25Å; F535-T543 PolarHBondContact N-O 3.41Å; F535-T543 PolarHBondContact O-N 2.9Å; F535-T543 PolarHBondContact O-OG1 2.83Å
536	C	79.8	Confident	79	Confident	37 Å²	37	81.4 Å²	81.4	25%	0.25	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.1	176.6	-159.8	0	0	0	0	109.6	C525	C525-C536 VanDerWaalsContact CA-SG 3.54Å; C525-C536 HydrophobicContact CB-CB 3.96Å; C525-C536 WeakPolarHBondContact CB-SG 3.42Å; C525-C536 WeakPolarHBondContact SG-CA 3.35Å; C525-C536 WeakPolarHBondContact SG-CB 3.29Å; C525-C536 CovalentContact SG-SG 2.03Å; C525-C536 PolarHBondContact SG-SG 2.03Å
537	S	73.4	Confident	79.5	Confident	32 Å²	32	74.8 Å²	74.8	22%	0.224	40%	0.401	C	S	.	.			trans	-68.1	159.8	170.2	-177.8	0	0	0	0	110.4	F535 D539 G540 I541	F535-S537 PolarHBondContact O-N 2.83Å; S537-D539 PolarHBondContact O-N 2.04Å; S537-D539 VanDerWaalsContact O-N 3.09Å; S537-G540 PolarHBondContact O-N 2.98Å; S537-I541 WeakPolarHBondContact CB-O 3.29Å; S537-I541 PolarHBondContact N-O 3.1Å
538	D	66.5	Low	80.2	Confident	110 Å²	110	73.5 Å²	73.5	59%	0.588	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-32.4	170.6	-83.9	-56.6	0	0	0	112.8	K511 G540	K511-D538 WeakPolarHBondContact CE-O 3.2Å; K511-D538 WeakPolarHBondContact CE-OD1 3.38Å; K511-D538 PolarHBondContact NZ-O 2.97Å; K511-D538 IonicContact NZ-OD1 2.97Å; K511-D538 PolarHBondContact NZ-OD1 3.12Å; D538-G540 PolarHBondContact O-N 3.5Å
539	D	72	Confident	80.6	Confident	134 Å²	134	65.7 Å²	65.7	72%	0.717	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	3.1	180	-61.2	-47.6	0	0	0	114.1	S537 I541	S537-D539 PolarHBondContact O-N 2.04Å; S537-D539 VanDerWaalsContact O-N 3.09Å; D539-I541 HydrophobicContact CB-CD1 4.13Å; D539-I541 HydrophobicContact CB-CG1 4.25Å; D539-I541 PolarHBondContact O-N 3.05Å
540	G	72.9	Confident	80.8	Confident	19 Å²	19	65.1 Å²	65.1	20%	0.196	37%	0.365	C	S	.	.	S	Bend	trans	75.9	10.6	-177.4	0	0	0	0	0	114.3	C525 N526 S537 D538	C525-G540 WeakPolarHBondContact CA-O 3.18Å; C525-G540 VanDerWaalsContact SG-C 3.55Å; C525-G540 PolarHBondContact SG-O 3.29Å; N526-G540 PolarHBondContact N-O 3.01Å; S537-G540 PolarHBondContact O-N 2.98Å; D538-G540 PolarHBondContact O-N 3.5Å
541	I	79	Confident	80.8	Confident	107 Å²	107	67.4 Å²	67.4	55%	0.549	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-93.4	138.1	178.6	-59.5	173.4	0	0	0	108.9	C525 S537 D539 T543	C525-I541 VanDerWaalsContact SG-C 3.52Å; S537-I541 WeakPolarHBondContact CB-O 3.29Å; S537-I541 PolarHBondContact N-O 3.1Å; D539-I541 HydrophobicContact CB-CD1 4.13Å; D539-I541 HydrophobicContact CB-CG1 4.25Å; D539-I541 PolarHBondContact O-N 3.05Å; I541-T543 PolarHBondContact O-N 3.34Å
542	C	80.7	Confident	81.3	Confident	14 Å²	14	63.4 Å²	63.4	10%	0.095	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	119.4	172.1	-167.8	0	0	0	0	110.7	C529 C553	C529-C542 WeakPolarHBondContact CA-SG 3.01Å; C529-C542 HydrophobicContact CB-CB 4.26Å; C529-C542 WeakPolarHBondContact CB-SG 3.18Å; C529-C542 VanDerWaalsContact SG-CA 3.54Å; C529-C542 WeakPolarHBondContact SG-CB 3.29Å; C529-C542 CovalentContact SG-SG 2.03Å; C529-C542 PolarHBondContact SG-SG 3.43Å; C542-C553 PolarHBondContact SG-SG 2.76Å
543	T	84.9	Confident	81.8	Confident	50 Å²	50	57 Å²	57	31%	0.307	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116	175.7	6.5	0	0	0	0	109.3	G534 F535 I541	G534-T543 CarbonylContact C-O 3.55Å; G534-T543 WeakPolarHBondContact CA-O 3.47Å; F535-T543 WeakPolarHBondContact CD1-O 3.37Å; F535-T543 WeakPolarHBondContact CD2-OG1 3.06Å; F535-T543 VanDerWaalsContact CE2-OG1 3.23Å; F535-T543 WeakPolarHBondContact CE2-OG1 3.02Å; F535-T543 HydrophobicContact CZ-CG2 4.25Å; F535-T543 PolarHBondContact N-O 3.41Å; F535-T543 PolarHBondContact O-N 2.9Å; F535-T543 PolarHBondContact O-OG1 2.83Å; I541-T543 PolarHBondContact O-N 3.34Å
544	C	85.4	Confident	81.9	Confident	43 Å²	43	57.3 Å²	57.3	29%	0.291	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	144.9	-175.8	-52.2	0	0	0	0	112.4	F548 G550 C553	C544-F548 HydrophobicContact CB-CB 4.2Å; C544-F548 WeakPolarHBondContact CB-O 3.02Å; C544-G550 PolarHBondContact SG-O 3.33Å; C544-C553 WeakPolarHBondContact CA-SG 3.43Å; C544-C553 HydrophobicContact CB-CB 3.76Å; C544-C553 WeakPolarHBondContact CB-SG 3.4Å; C544-C553 PolarHBondContact N-SG 3.39Å; C544-C553 VanDerWaalsContact N-SG 3.4Å; C544-C553 WeakPolarHBondContact SG-CA 3.36Å; C544-C553 WeakPolarHBondContact SG-CB 3.46Å; C544-C553 CovalentContact SG-SG 2.04Å; C544-C553 PolarHBondContact SG-SG 2.87Å
545	R	86.5	Confident	82.2	Confident	108 Å²	108	62.2 Å²	62.2	41%	0.408	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-69.6	154.7	167	-68.2	-176.7	175.2	-120.4	-2.7	109.5	N532 Q533 G547 F548 E907	N532-R545 VanDerWaalsContact O-CD 3.31Å; N532-R545 WeakPolarHBondContact O-CD 3.17Å; N532-R545 PolarHBondContact O-NE 2.05Å; Q533-R545 WeakPolarHBondContact O-CB 3.02Å; Q533-R545 PolarHBondContact O-N 2.83Å; R545-G547 PolarHBondContact O-N 2.8Å; R545-F548 HydrophobicContact CB-CD2 4.25Å; R545-F548 PolarHBondContact O-N 2.75Å; R545-F548 VanDerWaalsContact O-N 3.09Å; R545-E907 IonicContact NH1-OE1 2.67Å; R545-E907 PolarHBondContact NH1-OE1 3.38Å
546	P	84.6	Confident	82.4	Confident	129 Å²	129	59.2 Å²	59.2	84%	0.838	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	137.8	168.6	-25.9	35.2	0	0	0	111.1
547	G	83.7	Confident	82.8	Confident	6 Å²	6	59 Å²	59	6%	0.062	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	-13.3	-172.9	0	0	0	0	0	115.4	R545 I557	R545-G547 PolarHBondContact O-N 2.8Å; G547-I557 WeakPolarHBondContact O-CB 3.48Å; G547-I557 PolarHBondContact O-N 3.4Å
548	F	91	Very high	83.5	Confident	31 Å²	31	59 Å²	59	14%	0.136	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.1	-177.9	-63.7	-80.1	0	0	0	113.7	Q533 C544 R545 C553 E555 I557 Y575	Q533-F548 HydrophobicContact CB-CD1 3.95Å; Q533-F548 HydrophobicContact CB-CD2 4.22Å; Q533-F548 HydrophobicContact CB-CE1 4.24Å; Q533-F548 HydrophobicContact CB-CE2 4.47Å; Q533-F548 HydrophobicContact CB-CG 3.94Å; Q533-F548 HydrophobicContact CB-CZ 4.49Å; Q533-F548 HydrophobicContact CG-CD1 3.83Å; Q533-F548 HydrophobicContact CG-CD2 4.41Å; Q533-F548 HydrophobicContact CG-CE1 3.62Å; Q533-F548 HydrophobicContact CG-CE2 4.21Å; Q533-F548 HydrophobicContact CG-CG 4.23Å; Q533-F548 HydrophobicContact CG-CZ 3.82Å; C544-F548 HydrophobicContact CB-CB 4.2Å; C544-F548 WeakPolarHBondContact CB-O 3.02Å; R545-F548 HydrophobicContact CB-CD2 4.25Å; R545-F548 PolarHBondContact O-N 2.75Å; R545-F548 VanDerWaalsContact O-N 3.09Å; F548-C553 HydrophobicContact CB-CB 4.33Å; F548-E555 CarbonylContact C-O 3.2Å; F548-E555 WeakPolarHBondContact CA-O 3.4Å; F548-I557 WeakPolarHBondContact O-CD1 3.39Å; F548-Y575 HydrophobicContact CE1-CD1 4.46Å; F548-Y575 HydrophobicContact CE1-CE1 4.19Å; F548-Y575 HydrophobicContact CE1-CE2 4.26Å
549	T	87.6	Confident	84.5	Confident	53 Å²	53	54.8 Å²	54.8	33%	0.325	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	175	-179.6	-178.4	0	0	0	0	111.1	C553 G554 E555 I557	T549-C553 CarbonylContact O-C 3.51Å; T549-C553 WeakPolarHBondContact O-CA 3.39Å; T549-G554 PolarHBondContact O-N 2.98Å; T549-E555 HydrophobicContact CG2-CB 3.64Å; T549-E555 PolarHBondContact N-O 3.4Å; T549-E555 WeakPolarHBondContact O-CB 3.33Å; T549-E555 PolarHBondContact O-N 3.1Å; T549-I557 HydrophobicContact CG2-CG1 3.7Å
550	G	85.7	Confident	85.3	Confident	20 Å²	20	50.2 Å²	50.2	21%	0.206	29%	0.292	C	S	.	.	S	Bend	trans	93.3	163.2	-175.1	0	0	0	0	0	112.9	C544 D552 C553	C544-G550 PolarHBondContact SG-O 3.33Å; G550-D552 VanDerWaalsContact C-N 3.3Å; G550-D552 PolarHBondContact O-N 2.79Å; G550-C553 PolarHBondContact O-N 2.86Å; G550-C553 VanDerWaalsContact O-N 3.14Å
551	P	83	Confident	86.1	Confident	98 Å²	98	57.7 Å²	57.7	64%	0.636	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.4	-172.1	30.2	-36.2	0	0	0	113.8	P527	P527-P551 HydrophobicContact CG-CB 4.31Å; P527-P551 VanDerWaalsContact CG-O 3.23Å; P527-P551 WeakPolarHBondContact CG-O 3.49Å
552	D	86.5	Confident	86.4	Confident	62 Å²	62	58.5 Å²	58.5	33%	0.332	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	6.8	172.9	58.7	4.5	0	0	0	112.3	P527 T530 G550 G554	P527-D552 HydrophobicContact CG-CB 4.44Å; T530-D552 WeakPolarHBondContact CB-O 3.47Å; T530-D552 PolarHBondContact N-O 3.23Å; T530-D552 PolarHBondContact OG1-O 2.82Å; G550-D552 VanDerWaalsContact C-N 3.3Å; G550-D552 PolarHBondContact O-N 2.79Å; D552-G554 PolarHBondContact O-N 2.86Å; D552-G554 PolarHBondContact OD1-N 3.06Å
553	C	86.1	Confident	86.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.34	C	S	.	.	S	Bend	trans	59.6	18	-173.6	-51.4	0	0	0	0	115.8	Q533 C542 C544 F548 T549 G550 E555	Q533-C553 HydrophobicContact CB-CB 4.14Å; Q533-C553 PolarHBondContact OE1-O 3.31Å; Q533-C553 VanDerWaalsContact OE1-O 3.08Å; C542-C553 PolarHBondContact SG-SG 2.76Å; C544-C553 WeakPolarHBondContact CA-SG 3.43Å; C544-C553 HydrophobicContact CB-CB 3.76Å; C544-C553 WeakPolarHBondContact CB-SG 3.4Å; C544-C553 PolarHBondContact N-SG 3.39Å; C544-C553 VanDerWaalsContact N-SG 3.4Å; C544-C553 WeakPolarHBondContact SG-CA 3.36Å; C544-C553 WeakPolarHBondContact SG-CB 3.46Å; C544-C553 CovalentContact SG-SG 2.04Å; C544-C553 PolarHBondContact SG-SG 2.87Å; F548-C553 HydrophobicContact CB-CB 4.33Å; T549-C553 CarbonylContact O-C 3.51Å; T549-C553 WeakPolarHBondContact O-CA 3.39Å; G550-C553 PolarHBondContact O-N 2.86Å; G550-C553 VanDerWaalsContact O-N 3.14Å; C553-E555 VanDerWaalsContact C-N 3.3Å; C553-E555 PolarHBondContact O-N 3.46Å
554	G	85.8	Confident	86.4	Confident	24 Å²	24	61.7 Å²	61.7	25%	0.247	35%	0.348	C	S	.	.			trans	-73.1	-14.9	-178.1	0	0	0	0	0	115.6	T549 D552 Y575	T549-G554 PolarHBondContact O-N 2.98Å; D552-G554 PolarHBondContact O-N 2.86Å; D552-G554 PolarHBondContact OD1-N 3.06Å; G554-Y575 PolarHBondContact O-OH 2.03Å
555	E	88.1	Confident	86.2	Confident	115 Å²	115	61.6 Å²	61.6	54%	0.537	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	140.1	-175.5	-57.7	-179.9	153.8	0	0	112.2	F548 T549 C553	F548-E555 CarbonylContact C-O 3.2Å; F548-E555 WeakPolarHBondContact CA-O 3.4Å; T549-E555 HydrophobicContact CG2-CB 3.64Å; T549-E555 PolarHBondContact N-O 3.4Å; T549-E555 WeakPolarHBondContact O-CB 3.33Å; T549-E555 PolarHBondContact O-N 3.1Å; C553-E555 VanDerWaalsContact C-N 3.3Å; C553-E555 PolarHBondContact O-N 3.46Å
556	D	88.3	Confident	85.9	Confident	52 Å²	52	62.8 Å²	62.8	28%	0.278	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	137.2	177.7	-170.3	49.3	0	0	0	112	D558 N573 Y575 G576	D556-D558 PolarHBondContact O-N 2.93Å; D556-N573 PolarHBondContact OD2-ND2 2.89Å; D556-Y575 HydrophobicContact CB-CD2 3.79Å; D556-Y575 HydrophobicContact CB-CE2 3.9Å; D556-Y575 WeakPolarHBondContact OD1-CA 3.22Å; D556-G576 PolarHBondContact OD1-N 2.92Å
557	I	87	Confident	85.7	Confident	33 Å²	33	57.3 Å²	57.3	17%	0.169	32%	0.322	C	S	.	.			trans	-87.4	102.6	169.8	-66.4	177.9	0	0	0	109.2	G547 F548 T549 E559 K562	G547-I557 WeakPolarHBondContact O-CB 3.48Å; G547-I557 PolarHBondContact O-N 3.4Å; F548-I557 WeakPolarHBondContact O-CD1 3.39Å; T549-I557 HydrophobicContact CG2-CG1 3.7Å; I557-E559 HydrophobicContact CG2-CG 4.04Å; I557-E559 VanDerWaalsContact O-CD 3.25Å; I557-E559 PolarHBondContact O-N 3.04Å; I557-K562 HydrophobicContact CG2-CD 3.85Å; I557-K562 VanDerWaalsContact CG2-NZ 3.32Å
558	D	87.8	Confident	85.6	Confident	31 Å²	31	60 Å²	60	17%	0.166	34%	0.341	C	S	.	.			trans	-73.2	88.4	173.8	-167.3	-39.4	0	0	0	111.5	D556 C560 K561 K562 N573	D556-D558 PolarHBondContact O-N 2.93Å; D558-C560 PolarHBondContact O-N 2.87Å; D558-C560 WeakPolarHBondContact OD1-CB 3.44Å; D558-C560 PolarHBondContact OD1-N 3.38Å; D558-K561 HydrophobicContact CB-CB 4.13Å; D558-K561 HydrophobicContact CB-CD 4.41Å; D558-K561 HydrophobicContact CB-CG 4.35Å; D558-K561 PolarHBondContact O-N 2.91Å; D558-K561 PolarHBondContact OD1-N 2.78Å; D558-K561 WeakPolarHBondContact OD2-CG 3.47Å; D558-K561 IonicContact OD2-NZ 2.68Å; D558-K561 PolarHBondContact OD2-NZ 2.78Å; D558-K562 WeakPolarHBondContact O-CG 3.32Å; D558-K562 PolarHBondContact O-N 3.33Å; D558-N573 VanDerWaalsContact CA-OD1 3.28Å; D558-N573 WeakPolarHBondContact CA-OD1 3.35Å
559	E	88.4	Confident	85.2	Confident	22 Å²	22	60.8 Å²	60.8	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-27.2	179.8	-70.4	97.7	-173	0	0	112.7	I557 K562 G563 T564 H565 N573 F578	I557-E559 HydrophobicContact CG2-CG 4.04Å; I557-E559 VanDerWaalsContact O-CD 3.25Å; I557-E559 PolarHBondContact O-N 3.04Å; E559-K562 PolarHBondContact O-N 2.71Å; E559-G563 PolarHBondContact O-N 2.95Å; E559-T564 WeakPolarHBondContact CB-OG1 3.46Å; E559-T564 WeakPolarHBondContact CG-OG1 3.34Å; E559-T564 PolarHBondContact O-N 3.3Å; E559-H565 HydrophobicContact CB-CB 4.22Å; E559-N573 PolarHBondContact N-OD1 2.67Å; E559-F578 HydrophobicContact CB-CB 4.28Å; E559-F578 HydrophobicContact CB-CD1 3.6Å; E559-F578 HydrophobicContact CB-CE1 4.34Å; E559-F578 HydrophobicContact CB-CG 4.21Å; E559-F578 HydrophobicContact CG-CD1 3.74Å; E559-F578 HydrophobicContact CG-CE1 4.25Å; E559-F578 WeakPolarHBondContact OE2-CD1 3.27Å; E559-F578 PolarHBondContact OE2-N 3.34Å
560	C	88.7	Confident	85.2	Confident	38 Å²	38	62.4 Å²	62.4	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-68	-37.3	175.6	-58.4	0	0	0	0	111.8	D558 C571 N573	D558-C560 PolarHBondContact O-N 2.87Å; D558-C560 WeakPolarHBondContact OD1-CB 3.44Å; D558-C560 PolarHBondContact OD1-N 3.38Å; C560-C571 WeakPolarHBondContact CA-SG 3.29Å; C560-C571 HydrophobicContact CB-CB 3.88Å; C560-C571 WeakPolarHBondContact CB-SG 3.4Å; C560-C571 VanDerWaalsContact SG-C 3.55Å; C560-C571 WeakPolarHBondContact SG-CB 3.43Å; C560-C571 CovalentContact SG-SG 2.04Å; C560-C571 PolarHBondContact SG-SG 2.97Å; C560-N573 HydrophobicContact CB-CB 4.44Å; C560-N573 PolarHBondContact SG-N 2.68Å
561	K	88.8	Confident	85.3	Confident	175 Å²	175	63 Å²	63	76%	0.761	35%	0.348	S	S	*	.	H	α-helix	trans	-75.9	-33.8	171.7	-73.4	-172.4	-172.1	87.5	0	112.9	D558 G563	D558-K561 HydrophobicContact CB-CB 4.13Å; D558-K561 HydrophobicContact CB-CD 4.41Å; D558-K561 HydrophobicContact CB-CG 4.35Å; D558-K561 PolarHBondContact O-N 2.91Å; D558-K561 PolarHBondContact OD1-N 2.78Å; D558-K561 WeakPolarHBondContact OD2-CG 3.47Å; D558-K561 IonicContact OD2-NZ 2.68Å; D558-K561 PolarHBondContact OD2-NZ 2.78Å; K561-G563 VanDerWaalsContact C-N 3.32Å
562	K	87.1	Confident	85.5	Confident	124 Å²	124	61 Å²	61	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-76.9	-16.2	177.4	-69.8	-177.4	-173.6	178.1	0	113.6	I557 D558 E559 T564	I557-K562 HydrophobicContact CG2-CD 3.85Å; I557-K562 VanDerWaalsContact CG2-NZ 3.32Å; D558-K562 WeakPolarHBondContact O-CG 3.32Å; D558-K562 PolarHBondContact O-N 3.33Å; E559-K562 PolarHBondContact O-N 2.71Å; K562-T564 VanDerWaalsContact C-N 3.29Å; K562-T564 HydrophobicContact CB-CG2 4.16Å; K562-T564 PolarHBondContact O-N 3.11Å
563	G	82.3	Confident	85.4	Confident	52 Å²	52	60.1 Å²	60.1	54%	0.536	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	15.7	-177.6	0	0	0	0	0	114.2	E559 K561	E559-G563 PolarHBondContact O-N 2.95Å; K561-G563 VanDerWaalsContact C-N 3.32Å
564	T	82.8	Confident	85.3	Confident	80 Å²	80	62.9 Å²	62.9	49%	0.491	34%	0.343	S	S	.	.			trans	-94	9.2	-173.6	49.9	0	0	0	0	113.8	E559 K562	E559-T564 WeakPolarHBondContact CB-OG1 3.46Å; E559-T564 WeakPolarHBondContact CG-OG1 3.34Å; E559-T564 PolarHBondContact O-N 3.3Å; K562-T564 VanDerWaalsContact C-N 3.29Å; K562-T564 HydrophobicContact CB-CG2 4.16Å; K562-T564 PolarHBondContact O-N 3.11Å
565	H	79.7	Confident	85.3	Confident	40 Å²	40	68.6 Å²	68.6	19%	0.185	36%	0.359	C	S	.	.			trans	-87.3	-12.5	-166.3	61.3	82.5	0	0	0	115.6	E559 C567 C571 F578	E559-H565 HydrophobicContact CB-CB 4.22Å; H565-C567 WeakPolarHBondContact ND1-CB 3.3Å; H565-C567 PolarHBondContact ND1-N 3.23Å; H565-C567 PolarHBondContact O-N 3.04Å; H565-C571 WeakPolarHBondContact CB-SG 3.44Å; H565-F578 HydrophobicContact CB-CB 4.5Å; H565-F578 HydrophobicContact CB-CD1 4.08Å; H565-F578 HydrophobicContact CB-CD2 3.73Å; H565-F578 HydrophobicContact CB-CE1 4.25Å; H565-F578 HydrophobicContact CB-CE2 3.94Å; H565-F578 HydrophobicContact CB-CG 3.81Å; H565-F578 HydrophobicContact CB-CZ 4.19Å; H565-F578 WeakPolarHBondContact O-CE2 3.02Å; H565-F578 WeakPolarHBondContact O-CZ 3.45Å
566	N	80.9	Confident	84.9	Confident	133 Å²	133	63.8 Å²	63.8	71%	0.711	34%	0.34	S	S	*	.			trans	53.3	-2.4	-179.2	-67.5	-10.3	0	0	0	118.1	S568 V594	N566-S568 PolarHBondContact O-N 2.8Å; N566-V594 HydrophobicContact CB-CG1 4.33Å
567	C	81.1	Confident	84.8	Confident	14 Å²	14	64.1 Å²	64.1	10%	0.095	35%	0.346	C	S	.	.			trans	-54.4	126.6	176.5	-52.5	0	0	0	0	112.5	H565 Q569 C580	H565-C567 WeakPolarHBondContact ND1-CB 3.3Å; H565-C567 PolarHBondContact ND1-N 3.23Å; H565-C567 PolarHBondContact O-N 3.04Å; C567-Q569 VanDerWaalsContact C-N 3.26Å; C567-Q569 PolarHBondContact O-N 2.78Å; C567-C580 WeakPolarHBondContact CA-SG 3.03Å; C567-C580 HydrophobicContact CB-CB 3.68Å; C567-C580 WeakPolarHBondContact CB-SG 3Å; C567-C580 WeakPolarHBondContact SG-CA 3.47Å; C567-C580 WeakPolarHBondContact SG-CB 3.03Å; C567-C580 CovalentContact SG-SG 2.03Å; C567-C580 PolarHBondContact SG-SG 3.38Å
568	S	80.3	Confident	84.8	Confident	64 Å²	64	65.3 Å²	65.3	45%	0.448	35%	0.35	S	S	.	.	S	Bend	trans	-68.5	-15.6	177.7	54.8	0	0	0	0	115.3	N566 V594 N595 C596	N566-S568 PolarHBondContact O-N 2.8Å; S568-V594 WeakPolarHBondContact CB-O 3.09Å; S568-V594 PolarHBondContact N-O 2.88Å; S568-V594 PolarHBondContact OG-O 2.97Å; S568-N595 WeakPolarHBondContact OG-CA 3.39Å; S568-C596 PolarHBondContact OG-N 2.68Å
569	Q	83.9	Confident	84.6	Confident	47 Å²	47	68.9 Å²	68.9	22%	0.22	36%	0.364	C	S	.	.	S	Bend	trans	-135.1	-92.3	-178.8	-66.6	-173.5	-2.3	0	0	112.5	C567 C582 F583 Y586 C596	C567-Q569 VanDerWaalsContact C-N 3.26Å; C567-Q569 PolarHBondContact O-N 2.78Å; Q569-C582 VanDerWaalsContact OE1-CA 3.28Å; Q569-F583 HydrophobicContact CB-CD2 3.92Å; Q569-F583 HydrophobicContact CB-CE2 3.74Å; Q569-F583 HydrophobicContact CB-CZ 4.3Å; Q569-F583 HydrophobicContact CG-CD2 3.94Å; Q569-F583 HydrophobicContact CG-CE2 4.01Å; Q569-Y586 VanDerWaalsContact NE2-CD1 3.27Å; Q569-C596 HydrophobicContact CG-CB 3.85Å
570	K	86.5	Confident	84.4	Confident	87 Å²	87	68.3 Å²	68.3	38%	0.378	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.1	-174.2	179.2	-175.9	169.6	-157	0	111	C580 E581 F583	K570-C580 CarbonylContact O-C 3.49Å; K570-C580 WeakPolarHBondContact O-CA 3.47Å; K570-E581 HydrophobicContact CB-CB 4.21Å; K570-E581 WeakPolarHBondContact CB-O 3.33Å; K570-E581 HydrophobicContact CD-CB 4.08Å; K570-E581 WeakPolarHBondContact CE-OE2 3.11Å; K570-E581 HydrophobicContact CG-CB 4.39Å; K570-E581 PolarHBondContact N-O 3.49Å; K570-E581 IonicContact NZ-OE2 2.65Å; K570-E581 PolarHBondContact NZ-OE2 3.29Å; K570-E581 PolarHBondContact O-N 3.31Å; K570-F583 HydrophobicContact CB-CE1 4.23Å
571	C	88.3	Confident	84	Confident	32 Å²	32	69 Å²	69	22%	0.216	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.3	169.9	-168	0	0	0	0	110	C560 H565	C560-C571 WeakPolarHBondContact CA-SG 3.29Å; C560-C571 HydrophobicContact CB-CB 3.88Å; C560-C571 WeakPolarHBondContact CB-SG 3.4Å; C560-C571 VanDerWaalsContact SG-C 3.55Å; C560-C571 WeakPolarHBondContact SG-CB 3.43Å; C560-C571 CovalentContact SG-SG 2.04Å; C560-C571 PolarHBondContact SG-SG 2.97Å; H565-C571 WeakPolarHBondContact CB-SG 3.44Å
572	I	87.8	Confident	83.6	Confident	56 Å²	56	62.1 Å²	62.1	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.3	167	-63.4	-173.5	0	0	0	107.8	F578 K579 E581	I572-F578 WeakPolarHBondContact O-CA 3.37Å; I572-K579 PolarHBondContact N-O 2.82Å; I572-K579 PolarHBondContact O-N 2.03Å; I572-E581 HydrophobicContact CD1-CG 4.1Å; I572-E581 VanDerWaalsContact CD1-OE2 3.29Å; I572-E581 WeakPolarHBondContact CD1-OE2 3.44Å
573	N	84.2	Confident	83.2	Confident	44 Å²	44	61.8 Å²	61.8	24%	0.235	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	140.4	176.6	-159	66.1	0	0	0	110.5	D556 D558 E559 C560	D556-N573 PolarHBondContact OD2-ND2 2.89Å; D558-N573 VanDerWaalsContact CA-OD1 3.28Å; D558-N573 WeakPolarHBondContact CA-OD1 3.35Å; E559-N573 PolarHBondContact N-OD1 2.67Å; C560-N573 HydrophobicContact CB-CB 4.44Å; C560-N573 PolarHBondContact SG-N 2.68Å
574	T	83.6	Confident	82.6	Confident	57 Å²	57	68.9 Å²	68.9	35%	0.35	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	161.9	176.5	58.3	0	0	0	0	109.4	G576 S577 K579	T574-G576 PolarHBondContact O-N 2.91Å; T574-G576 VanDerWaalsContact O-N 3.09Å; T574-S577 CarbonylContact C-O 3.56Å; T574-S577 VanDerWaalsContact C-O 3.28Å; T574-S577 VanDerWaalsContact CA-O 3.31Å; T574-S577 WeakPolarHBondContact CA-O 3.37Å; T574-S577 PolarHBondContact N-O 2.75Å; T574-S577 PolarHBondContact O-N 2.86Å; T574-S577 PolarHBondContact OG1-O 2.88Å; T574-K579 HydrophobicContact CG2-CB 4.26Å
575	Y	85.5	Confident	81.5	Confident	145 Å²	145	67.3 Å²	67.3	57%	0.569	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	110.3	-175.3	-168.2	-126.9	0	0	0	110.7	Q533 F548 G554 D556	Q533-Y575 VanDerWaalsContact NE2-CZ 3.27Å; Q533-Y575 PolarHBondContact NE2-OH 3.32Å; F548-Y575 HydrophobicContact CE1-CD1 4.46Å; F548-Y575 HydrophobicContact CE1-CE1 4.19Å; F548-Y575 HydrophobicContact CE1-CE2 4.26Å; G554-Y575 PolarHBondContact O-OH 2.03Å; D556-Y575 HydrophobicContact CB-CD2 3.79Å; D556-Y575 HydrophobicContact CB-CE2 3.9Å; D556-Y575 WeakPolarHBondContact OD1-CA 3.22Å
576	G	80.9	Confident	81	Confident	14 Å²	14	70.6 Å²	70.6	14%	0.144	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	9.8	-174.6	0	0	0	0	0	115.9	D556 T574	D556-G576 PolarHBondContact OD1-N 2.92Å; T574-G576 PolarHBondContact O-N 2.91Å; T574-G576 VanDerWaalsContact O-N 3.09Å
577	S	84.4	Confident	80.4	Confident	58 Å²	58	67.6 Å²	67.6	41%	0.406	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	-179.8	178.5	-151.4	0	0	0	0	112.7	T574	T574-S577 CarbonylContact C-O 3.56Å; T574-S577 VanDerWaalsContact C-O 3.28Å; T574-S577 VanDerWaalsContact CA-O 3.31Å; T574-S577 WeakPolarHBondContact CA-O 3.37Å; T574-S577 PolarHBondContact N-O 2.75Å; T574-S577 PolarHBondContact O-N 2.86Å; T574-S577 PolarHBondContact OG1-O 2.88Å
578	F	87.1	Confident	79.6	Confident	59 Å²	59	70.3 Å²	70.3	26%	0.259	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.7	164.6	63.6	-86.6	0	0	0	111.6	E559 H565 I572	E559-F578 HydrophobicContact CB-CB 4.28Å; E559-F578 HydrophobicContact CB-CD1 3.6Å; E559-F578 HydrophobicContact CB-CE1 4.34Å; E559-F578 HydrophobicContact CB-CG 4.21Å; E559-F578 HydrophobicContact CG-CD1 3.74Å; E559-F578 HydrophobicContact CG-CE1 4.25Å; E559-F578 WeakPolarHBondContact OE2-CD1 3.27Å; E559-F578 PolarHBondContact OE2-N 3.34Å; H565-F578 HydrophobicContact CB-CB 4.5Å; H565-F578 HydrophobicContact CB-CD1 4.08Å; H565-F578 HydrophobicContact CB-CD2 3.73Å; H565-F578 HydrophobicContact CB-CE1 4.25Å; H565-F578 HydrophobicContact CB-CE2 3.94Å; H565-F578 HydrophobicContact CB-CG 3.81Å; H565-F578 HydrophobicContact CB-CZ 4.19Å; H565-F578 WeakPolarHBondContact O-CE2 3.02Å; H565-F578 WeakPolarHBondContact O-CZ 3.45Å; I572-F578 WeakPolarHBondContact O-CA 3.37Å
579	K	83.9	Confident	78.7	Confident	106 Å²	106	73.4 Å²	73.4	46%	0.461	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.8	168.9	-177	-164.9	173.3	-162.6	0	109.4	I572 T574 E581	I572-K579 PolarHBondContact N-O 2.82Å; I572-K579 PolarHBondContact O-N 2.03Å; T574-K579 HydrophobicContact CG2-CB 4.26Å; K579-E581 HydrophobicContact CD-CG 4.27Å; K579-E581 IonicContact NZ-OE1 2.71Å; K579-E581 PolarHBondContact NZ-OE1 3.36Å
580	C	84.8	Confident	77.3	Confident	9 Å²	9	75 Å²	75	6%	0.061	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	140.6	166.8	-56	0	0	0	0	111.1	C567 K570 G593	C567-C580 WeakPolarHBondContact CA-SG 3.03Å; C567-C580 HydrophobicContact CB-CB 3.68Å; C567-C580 WeakPolarHBondContact CB-SG 3Å; C567-C580 WeakPolarHBondContact SG-CA 3.47Å; C567-C580 WeakPolarHBondContact SG-CB 3.03Å; C567-C580 CovalentContact SG-SG 2.03Å; C567-C580 PolarHBondContact SG-SG 3.38Å; K570-C580 CarbonylContact O-C 3.49Å; K570-C580 WeakPolarHBondContact O-CA 3.47Å; C580-G593 WeakPolarHBondContact CB-O 3.45Å
581	E	80.5	Confident	75.9	Confident	52 Å²	52	74.5 Å²	74.5	24%	0.243	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.9	170.1	-71.3	-168.8	164.5	0	0	110.9	K570 I572 K579	K570-E581 HydrophobicContact CB-CB 4.21Å; K570-E581 WeakPolarHBondContact CB-O 3.33Å; K570-E581 HydrophobicContact CD-CB 4.08Å; K570-E581 WeakPolarHBondContact CE-OE2 3.11Å; K570-E581 HydrophobicContact CG-CB 4.39Å; K570-E581 PolarHBondContact N-O 3.49Å; K570-E581 IonicContact NZ-OE2 2.65Å; K570-E581 PolarHBondContact NZ-OE2 3.29Å; K570-E581 PolarHBondContact O-N 3.31Å; I572-E581 HydrophobicContact CD1-CG 4.1Å; I572-E581 VanDerWaalsContact CD1-OE2 3.29Å; I572-E581 WeakPolarHBondContact CD1-OE2 3.44Å; K579-E581 HydrophobicContact CD-CG 4.27Å; K579-E581 IonicContact NZ-OE1 2.71Å; K579-E581 PolarHBondContact NZ-OE1 3.36Å
582	C	79.4	Confident	74.5	Confident	31 Å²	31	79.2 Å²	79.2	21%	0.209	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-97.4	151.5	172.9	-53	0	0	0	0	110.6	Q569 C596	Q569-C582 VanDerWaalsContact OE1-CA 3.28Å; C582-C596 WeakPolarHBondContact CA-SG 3.22Å; C582-C596 HydrophobicContact CB-CB 3.76Å; C582-C596 WeakPolarHBondContact CB-SG 3.34Å; C582-C596 VanDerWaalsContact SG-CA 3.6Å; C582-C596 WeakPolarHBondContact SG-CB 3.02Å; C582-C596 CovalentContact SG-SG 2.04Å; C582-C596 PolarHBondContact SG-SG 2.04Å
583	F	79.5	Confident	73.2	Confident	118 Å²	118	76.7 Å²	76.7	52%	0.518	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-69.4	163.9	169.5	-58	-54.8	0	0	0	111.1	Q569 K570 G585 Y586	Q569-F583 HydrophobicContact CB-CD2 3.92Å; Q569-F583 HydrophobicContact CB-CE2 3.74Å; Q569-F583 HydrophobicContact CB-CZ 4.3Å; Q569-F583 HydrophobicContact CG-CD2 3.94Å; Q569-F583 HydrophobicContact CG-CE2 4.01Å; K570-F583 HydrophobicContact CB-CE1 4.23Å; F583-G585 PolarHBondContact O-N 3.38Å; F583-Y586 HydrophobicContact CB-CD2 4.45Å; F583-Y586 PolarHBondContact O-N 3.4Å
584	E	70	Confident	72.5	Confident	200 Å²	200	77 Å²	77	94%	0.935	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	131.5	179.4	-166	168.1	-160.3	0	0	111
585	G	59.1	Low	71.8	Confident	48 Å²	48	78.3 Å²	78.3	50%	0.495	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	6.8	-173.2	0	0	0	0	0	116	F583 K599	F583-G585 PolarHBondContact O-N 3.38Å; G585-K599 WeakPolarHBondContact O-CB 3.14Å; G585-K599 PolarHBondContact O-N 2.91Å
586	Y	69.8	Low	71.1	Confident	109 Å²	109	72.4 Å²	72.4	43%	0.427	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153.6	178.5	-67.5	-102.5	0	0	0	113	Q569 F583 C596 K597	Q569-Y586 VanDerWaalsContact NE2-CD1 3.27Å; F583-Y586 HydrophobicContact CB-CD2 4.45Å; F583-Y586 PolarHBondContact O-N 3.4Å; Y586-C596 HydrophobicContact CD1-CB 4.48Å; Y586-K597 CarbonylContact C-O 3.58Å; Y586-K597 WeakPolarHBondContact CA-O 3.36Å; Y586-K597 WeakPolarHBondContact CB-O 3.34Å; Y586-K597 WeakPolarHBondContact CD1-O 3.45Å
587	E	67	Low	70.4	Confident	70 Å²	70	76.5 Å²	76.5	33%	0.327	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.7	-178	66.4	-176.5	-171.6	0	0	111.8	C596 K597	E587-C596 CarbonylContact O-C 3.58Å; E587-C596 WeakPolarHBondContact O-CA 3.32Å; E587-K597 HydrophobicContact CG-CB 4.25Å; E587-K597 PolarHBondContact N-O 2.86Å; E587-K597 PolarHBondContact O-N 2.82Å; E587-K597 IonicContact OE1-NZ 2.63Å; E587-K597 PolarHBondContact OE1-NZ 2.99Å
588	T	65.1	Low	69.3	Low	70 Å²	70	75.7 Å²	75.7	43%	0.429	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.1	-175.7	58.5	0	0	0	0	111.9	S590	T588-S590 VanDerWaalsContact C-N 3.3Å; T588-S590 PolarHBondContact O-N 3.04Å
589	Q	61.1	Low	67.9	Low	129 Å²	129	77.9 Å²	77.9	60%	0.603	42%	0.423	S	S	*	.	S	Bend	trans	-68.1	-27.5	-174.5	-169	177.8	7.4	0	0	113.9	N595	Q589-N595 HydrophobicContact CB-CB 4.02Å; Q589-N595 PolarHBondContact N-O 3.38Å
590	S	55.4	Low	66.6	Low	80 Å²	80	73.7 Å²	73.7	56%	0.559	41%	0.407	S	S	*	.	S	Bend	trans	-133.2	152.5	161.7	-65.5	0	0	0	0	107.5	T588 N592 G593	T588-S590 VanDerWaalsContact C-N 3.3Å; T588-S590 PolarHBondContact O-N 3.04Å; S590-N592 PolarHBondContact O-N 2.62Å; S590-G593 PolarHBondContact O-N 2.7Å; S590-G593 VanDerWaalsContact O-N 3.08Å
591	G	55.9	Low	65.2	Low	78 Å²	78	76.1 Å²	76.1	80%	0.804	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-6.3	-173.4	0	0	0	0	0	116.5	G593	G591-G593 VanDerWaalsContact C-N 3.28Å
592	N	58.6	Low	64	Low	130 Å²	130	81.4 Å²	81.4	70%	0.695	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-6.5	177.3	-49.8	19.4	0	0	0	112.6	S590 V594	S590-N592 PolarHBondContact O-N 2.62Å; N592-V594 HydrophobicContact CB-CG2 4.15Å; N592-V594 PolarHBondContact O-N 2.66Å
593	G	60.7	Low	63	Low	4 Å²	4	89.2 Å²	89.2	4%	0.041	47%	0.474	C	S	.	.			trans	71.1	-3.9	175.9	0	0	0	0	0	116.8	C580 S590 G591 N595	C580-G593 WeakPolarHBondContact CB-O 3.45Å; S590-G593 PolarHBondContact O-N 2.7Å; S590-G593 VanDerWaalsContact O-N 3.08Å; G591-G593 VanDerWaalsContact C-N 3.28Å; G593-N595 VanDerWaalsContact C-N 3.35Å; G593-N595 PolarHBondContact O-N 3.03Å
594	V	69.3	Low	62.4	Low	50 Å²	50	84.4 Å²	84.4	30%	0.303	45%	0.454	S	S	.	.	S	Bend	trans	-54.6	-47.6	-176.8	-176.8	0	0	0	0	111.8	N566 S568 N592	N566-V594 HydrophobicContact CB-CG1 4.33Å; S568-V594 WeakPolarHBondContact CB-O 3.09Å; S568-V594 PolarHBondContact N-O 2.88Å; S568-V594 PolarHBondContact OG-O 2.97Å; N592-V594 HydrophobicContact CB-CG2 4.15Å; N592-V594 PolarHBondContact O-N 2.66Å
595	N	70.4	Confident	62.1	Low	84 Å²	84	78.4 Å²	78.4	45%	0.449	43%	0.427	S	S	.	.	S	Bend	trans	-107.2	119	179.6	-73.4	4.5	0	0	0	111.8	S568 Q589 G593	S568-N595 WeakPolarHBondContact OG-CA 3.39Å; Q589-N595 HydrophobicContact CB-CB 4.02Å; Q589-N595 PolarHBondContact N-O 3.38Å; G593-N595 VanDerWaalsContact C-N 3.35Å; G593-N595 PolarHBondContact O-N 3.03Å
596	C	70.2	Confident	61.8	Low	21 Å²	21	80.8 Å²	80.8	14%	0.142	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.8	174.7	-66.1	0	0	0	0	110.9	S568 Q569 C582 Y586 E587	S568-C596 PolarHBondContact OG-N 2.68Å; Q569-C596 HydrophobicContact CG-CB 3.85Å; C582-C596 WeakPolarHBondContact CA-SG 3.22Å; C582-C596 HydrophobicContact CB-CB 3.76Å; C582-C596 WeakPolarHBondContact CB-SG 3.34Å; C582-C596 VanDerWaalsContact SG-CA 3.6Å; C582-C596 WeakPolarHBondContact SG-CB 3.02Å; C582-C596 CovalentContact SG-SG 2.04Å; C582-C596 PolarHBondContact SG-SG 2.04Å; Y586-C596 HydrophobicContact CD1-CB 4.48Å; E587-C596 CarbonylContact O-C 3.58Å; E587-C596 WeakPolarHBondContact O-CA 3.32Å
597	K	66.5	Low	61.4	Low	100 Å²	100	76.8 Å²	76.8	44%	0.435	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.5	178.2	177.6	-177.2	157.7	-123.4	0	109.7	Y586 E587 K599	Y586-K597 CarbonylContact C-O 3.58Å; Y586-K597 WeakPolarHBondContact CA-O 3.36Å; Y586-K597 WeakPolarHBondContact CB-O 3.34Å; Y586-K597 WeakPolarHBondContact CD1-O 3.45Å; E587-K597 HydrophobicContact CG-CB 4.25Å; E587-K597 PolarHBondContact N-O 2.86Å; E587-K597 PolarHBondContact O-N 2.82Å; E587-K597 IonicContact OE1-NZ 2.63Å; E587-K597 PolarHBondContact OE1-NZ 2.99Å; K597-K599 PolarHBondContact O-N 3.23Å
598	S	60.2	Low	61.4	Low	41 Å²	41	73.9 Å²	73.9	29%	0.287	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	131.2	175.1	45.2	0	0	0	0	110.9	C600	S598-C600 PolarHBondContact O-N 3.09Å
599	K	57.6	Low	61.7	Low	105 Å²	105	71.1 Å²	71.1	46%	0.457	40%	0.395	S	S	.	.			trans	-75.1	97.2	-178.1	-167.1	177.9	-175.5	-170.3	0	109.4	G585 K597 E602	G585-K599 WeakPolarHBondContact O-CB 3.14Å; G585-K599 PolarHBondContact O-N 2.91Å; K597-K599 PolarHBondContact O-N 3.23Å; K599-E602 WeakPolarHBondContact CE-OE1 3.28Å; K599-E602 IonicContact NZ-OE1 3.41Å; K599-E602 PolarHBondContact NZ-OE1 3.11Å
600	C	57	Low	62.1	Low	18 Å²	18	72.5 Å²	72.5	12%	0.122	40%	0.398	C	S	.	.			trans	-64.8	149.4	174.8	-170.9	0	0	0	0	110.3	S598 E602 C611	S598-C600 PolarHBondContact O-N 3.09Å; C600-E602 PolarHBondContact O-N 2.7Å; C600-C611 HydrophobicContact CB-CB 3.74Å; C600-C611 WeakPolarHBondContact CB-SG 3.45Å; C600-C611 WeakPolarHBondContact SG-CB 3.2Å; C600-C611 CovalentContact SG-SG 2.03Å; C600-C611 PolarHBondContact SG-SG 3.29Å
601	S	54.9	Low	62.8	Low	61 Å²	61	71.6 Å²	71.6	43%	0.427	39%	0.392	S	S	.	.			trans	-59.8	131	178.4	79.3	0	0	0	0	110.5	R603 C604	S601-R603 PolarHBondContact O-N 3.43Å; S601-C604 PolarHBondContact O-N 3.27Å; S601-C604 VanDerWaalsContact O-N 3.12Å
602	E	55.3	Low	63.4	Low	162 Å²	162	70 Å²	70	76%	0.757	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	13.3	-172.1	-63.9	170.2	-174.6	0	0	114.4	K599 C600	K599-E602 WeakPolarHBondContact CE-OE1 3.28Å; K599-E602 IonicContact NZ-OE1 3.41Å; K599-E602 PolarHBondContact NZ-OE1 3.11Å; C600-E602 PolarHBondContact O-N 2.7Å
603	R	59.9	Low	63.6	Low	196 Å²	196	68.6 Å²	68.6	74%	0.74	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-14.3	178.4	-60.1	-176.8	-173.6	164.6	3.9	113.6	S601 M605 N627	S601-R603 PolarHBondContact O-N 3.43Å; R603-M605 PolarHBondContact O-N 2.81Å; R603-N627 HydrophobicContact CB-CB 3.79Å; R603-N627 WeakPolarHBondContact O-CB 3.31Å
604	C	65.3	Low	63.9	Low	16 Å²	16	74 Å²	74	11%	0.108	40%	0.404	C	S	.	.	S	Bend	trans	-59.8	99.9	177.9	-136.3	0	0	0	0	108.5	S601 S606 C617	S601-C604 PolarHBondContact O-N 3.27Å; S601-C604 VanDerWaalsContact O-N 3.12Å; C604-S606 PolarHBondContact O-N 2.85Å; C604-C617 VanDerWaalsContact CA-SG 3.53Å; C604-C617 WeakPolarHBondContact CB-SG 3.36Å; C604-C617 WeakPolarHBondContact SG-CB 3.03Å; C604-C617 CovalentContact SG-SG 2.04Å; C604-C617 PolarHBondContact SG-SG 2.9Å
605	M	63.8	Low	63.6	Low	74 Å²	74	72.4 Å²	72.4	37%	0.365	40%	0.397	S	S	.	.			trans	-59.6	117.5	-170.3	-68.4	-164.5	78.9	0	0	108.5	R603 N607 K608 N627	R603-M605 PolarHBondContact O-N 2.81Å; M605-N607 CarbonylContact O-C 3.57Å; M605-N607 WeakPolarHBondContact O-CA 3.49Å; M605-N607 PolarHBondContact O-N 2.04Å; M605-K608 HydrophobicContact CB-CB 4.3Å; M605-K608 HydrophobicContact CB-CD 4.22Å; M605-K608 HydrophobicContact CB-CG 4.16Å; M605-K608 PolarHBondContact O-N 3.04Å; M605-K608 HydrophobicContact SD-CD 3.86Å; M605-N627 PolarHBondContact N-O 3.48Å
606	S	53.7	Low	63.4	Low	98 Å²	98	75.1 Å²	75.1	69%	0.685	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	65.3	-172.3	-57.5	0	0	0	0	112.2	Y231 C604	Y231-S606 WeakPolarHBondContact CE1-O 3.12Å; C604-S606 PolarHBondContact O-N 2.85Å
607	N	61	Low	63.5	Low	26 Å²	26	74.9 Å²	74.9	14%	0.139	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	175.2	-55.6	-161.4	-113.2	-85.3	0	0	0	111.5	Y231 S232 M605 R620	Y231-N607 VanDerWaalsContact CA-OD1 3.23Å; Y231-N607 WeakPolarHBondContact CA-OD1 3.02Å; Y231-N607 WeakPolarHBondContact CB-OD1 3.17Å; Y231-N607 HydrophobicContact CD1-CB 4.14Å; Y231-N607 WeakPolarHBondContact CD1-ND2 3.11Å; Y231-N607 VanDerWaalsContact CD1-OD1 3.3Å; Y231-N607 WeakPolarHBondContact CD1-OD1 3.45Å; Y231-N607 HydrophobicContact CE1-CB 4.49Å; Y231-N607 WeakPolarHBondContact CE1-ND2 3.45Å; Y231-N607 VanDerWaalsContact CG-ND2 3.31Å; Y231-N607 PolarHBondContact O-OD1 3.34Å; S232-N607 VanDerWaalsContact CB-CG 3.43Å; S232-N607 WeakPolarHBondContact CB-OD1 3.02Å; S232-N607 PolarHBondContact N-OD1 2.67Å; S232-N607 WeakPolarHBondContact OG-CB 3.47Å; S232-N607 PolarHBondContact OG-ND2 2.83Å; S232-N607 PolarHBondContact OG-OD1 2.74Å; M605-N607 CarbonylContact O-C 3.57Å; M605-N607 WeakPolarHBondContact O-CA 3.49Å; M605-N607 PolarHBondContact O-N 2.04Å; N607-R620 WeakPolarHBondContact O-CD 3.46Å; N607-R620 PolarHBondContact O-NE 2.03Å; N607-R620 PolarHBondContact O-NH2 3.08Å
608	K	67.2	Low	64.1	Low	8 Å²	8	75 Å²	75	4%	0.035	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-9.3	-159.6	-50.7	-175.8	-174.6	174.6	0	113.5	T233 M605 R620 F623 C628 Y650	T233-K608 WeakPolarHBondContact OG1-CE 3.25Å; T233-K608 PolarHBondContact OG1-NZ 2.74Å; T233-K608 VanDerWaalsContact OG1-NZ 3.14Å; M605-K608 HydrophobicContact CB-CB 4.3Å; M605-K608 HydrophobicContact CB-CD 4.22Å; M605-K608 HydrophobicContact CB-CG 4.16Å; M605-K608 PolarHBondContact O-N 3.04Å; M605-K608 HydrophobicContact SD-CD 3.86Å; K608-R620 PolarHBondContact O-N 3.09Å; K608-F623 HydrophobicContact CB-CD1 4.44Å; K608-F623 HydrophobicContact CB-CD2 3.88Å; K608-F623 HydrophobicContact CB-CE2 4.12Å; K608-F623 HydrophobicContact CB-CG 4.04Å; K608-F623 HydrophobicContact CD-CD1 4.35Å; K608-F623 HydrophobicContact CD-CE1 4.07Å; K608-F623 HydrophobicContact CD-CZ 4.2Å; K608-F623 HydrophobicContact CG-CD2 4.46Å; K608-F623 HydrophobicContact CG-CE1 4.5Å; K608-F623 HydrophobicContact CG-CE2 4.22Å; K608-F623 HydrophobicContact CG-CZ 4.23Å; K608-C628 HydrophobicContact CB-CB 3.91Å; K608-C628 WeakPolarHBondContact CB-O 3.06Å; K608-C628 WeakPolarHBondContact CD-O 3.38Å; K608-Y650 HydrophobicContact CD-CE1 3.84Å; K608-Y650 WeakPolarHBondContact CD-OH 3.03Å; K608-Y650 VanDerWaalsContact NZ-CZ 3.32Å; K608-Y650 PolarHBondContact NZ-OH 3.44Å
609	G	70.8	Confident	65.1	Low	13 Å²	13	74.7 Å²	74.7	13%	0.134	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	178.8	171.9	0	0	0	0	0	113.3	I618	G609-I618 CarbonylContact C-O 3.45Å; G609-I618 WeakPolarHBondContact CA-O 3.43Å
610	K	70.9	Confident	66.1	Low	157 Å²	157	75.5 Å²	75.5	68%	0.683	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.6	167.2	-70.4	-173.6	176.3	-175	0	108.7	I618	K610-I618 PolarHBondContact N-O 2.86Å; K610-I618 PolarHBondContact O-N 2.89Å
611	C	68.7	Low	67.2	Low	62 Å²	62	86.1 Å²	86.1	42%	0.419	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136	173.9	-48	0	0	0	0	110	C600 K616	C600-C611 HydrophobicContact CB-CB 3.74Å; C600-C611 WeakPolarHBondContact CB-SG 3.45Å; C600-C611 WeakPolarHBondContact SG-CB 3.2Å; C600-C611 CovalentContact SG-SG 2.03Å; C600-C611 PolarHBondContact SG-SG 3.29Å; C611-K616 WeakPolarHBondContact CA-O 3.4Å
612	D	69.8	Low	68.2	Low	44 Å²	44	83.3 Å²	83.3	24%	0.235	42%	0.423	C	S	.	.			trans	-85.3	178.5	171.7	73.4	18.1	0	0	0	112.7	T614 G615 K616 I618	D612-T614 PolarHBondContact O-N 3.32Å; D612-T614 VanDerWaalsContact O-N 3.08Å; D612-T614 VanDerWaalsContact OD1-CA 3.28Å; D612-T614 WeakPolarHBondContact OD1-CA 3.37Å; D612-T614 WeakPolarHBondContact OD1-CB 3.29Å; D612-T614 PolarHBondContact OD1-N 2.95Å; D612-T614 PolarHBondContact OD1-OG1 2.93Å; D612-T614 PolarHBondContact OD2-OG1 2.77Å; D612-G615 PolarHBondContact O-N 3.38Å; D612-G615 PolarHBondContact OD1-N 3.48Å; D612-G615 VanDerWaalsContact OD1-N 3.16Å; D612-K616 PolarHBondContact N-O 3.19Å; D612-K616 PolarHBondContact OD1-N 3.03Å; D612-I618 HydrophobicContact CB-CD1 3.72Å; D612-I618 HydrophobicContact CB-CG1 4.05Å
613	A	61.6	Low	69.7	Low	101 Å²	101	76.7 Å²	76.7	84%	0.835	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.3	179.2	0	0	0	0	0	114.2
614	T	66.8	Low	70.8	Confident	118 Å²	118	70.3 Å²	70.3	72%	0.724	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	0.1	175.4	73.4	0	0	0	0	113.2	D612 K616	D612-T614 PolarHBondContact O-N 3.32Å; D612-T614 VanDerWaalsContact O-N 3.08Å; D612-T614 VanDerWaalsContact OD1-CA 3.28Å; D612-T614 WeakPolarHBondContact OD1-CA 3.37Å; D612-T614 WeakPolarHBondContact OD1-CB 3.29Å; D612-T614 PolarHBondContact OD1-N 2.95Å; D612-T614 PolarHBondContact OD1-OG1 2.93Å; D612-T614 PolarHBondContact OD2-OG1 2.77Å; T614-K616 VanDerWaalsContact C-N 3.33Å
615	G	63	Low	71.5	Confident	16 Å²	16	70.6 Å²	70.6	17%	0.165	38%	0.381	C	S	.	.	S	Bend	trans	82.5	6.1	-177.2	0	0	0	0	0	114.4	D612	D612-G615 PolarHBondContact O-N 3.38Å; D612-G615 PolarHBondContact OD1-N 3.48Å; D612-G615 VanDerWaalsContact OD1-N 3.16Å
616	K	68.3	Low	72	Confident	140 Å²	140	75 Å²	75	61%	0.609	41%	0.405	S	S	*	.			trans	-83.6	143.4	178.6	178.3	-174	176.5	-173.9	0	110.7	C611 D612 T614 I618	C611-K616 WeakPolarHBondContact CA-O 3.4Å; D612-K616 PolarHBondContact N-O 3.19Å; D612-K616 PolarHBondContact OD1-N 3.03Å; T614-K616 VanDerWaalsContact C-N 3.33Å; K616-I618 PolarHBondContact O-N 3Å
617	C	71.1	Confident	73	Confident	17 Å²	17	72 Å²	72	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	118.5	173	-66	0	0	0	0	111.6	C604	C604-C617 VanDerWaalsContact CA-SG 3.53Å; C604-C617 WeakPolarHBondContact CB-SG 3.36Å; C604-C617 WeakPolarHBondContact SG-CB 3.03Å; C604-C617 CovalentContact SG-SG 2.04Å; C604-C617 PolarHBondContact SG-SG 2.9Å
618	I	79.6	Confident	73.9	Confident	101 Å²	101	70.8 Å²	70.8	52%	0.518	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.3	158.6	-60.5	177	0	0	0	106.9	G609 K610 D612 K616	G609-I618 CarbonylContact C-O 3.45Å; G609-I618 WeakPolarHBondContact CA-O 3.43Å; K610-I618 PolarHBondContact N-O 2.86Å; K610-I618 PolarHBondContact O-N 2.89Å; D612-I618 HydrophobicContact CB-CD1 3.72Å; D612-I618 HydrophobicContact CB-CG1 4.05Å; K616-I618 PolarHBondContact O-N 3Å
619	C	80.6	Confident	74.5	Confident	35 Å²	35	72.5 Å²	72.5	24%	0.236	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	149.4	177	-55.7	0	0	0	0	111.8	F623 C628	C619-F623 HydrophobicContact CB-CB 4.01Å; C619-F623 WeakPolarHBondContact CB-O 3.49Å; C619-C628 WeakPolarHBondContact CA-SG 3.33Å; C619-C628 HydrophobicContact CB-CB 3.79Å; C619-C628 WeakPolarHBondContact CB-SG 3.45Å; C619-C628 WeakPolarHBondContact SG-CA 3.31Å; C619-C628 WeakPolarHBondContact SG-CB 3.1Å; C619-C628 CovalentContact SG-SG 2.04Å; C619-C628 PolarHBondContact SG-SG 3.18Å
620	R	78.8	Confident	75.1	Confident	122 Å²	122	76.9 Å²	76.9	46%	0.46	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-67	160.7	166.9	-63.9	-177.8	-179.7	-168.4	4.9	108.6	N607 K608 F623	N607-R620 WeakPolarHBondContact O-CD 3.46Å; N607-R620 PolarHBondContact O-NE 2.03Å; N607-R620 PolarHBondContact O-NH2 3.08Å; K608-R620 PolarHBondContact O-N 3.09Å; R620-F623 HydrophobicContact CB-CD2 4.2Å; R620-F623 PolarHBondContact O-N 2.95Å; R620-F623 VanDerWaalsContact O-N 3.11Å
621	R	80	Confident	75.7	Confident	242 Å²	242	71.6 Å²	71.6	91%	0.913	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	144.8	167.7	-68.5	179.6	176.9	161.1	-1.9	109.2
622	G	76.8	Confident	76.5	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.01	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-12.8	-168.7	0	0	0	0	0	115.4	I632	G622-I632 PolarHBondContact O-N 3.06Å
623	F	85.4	Confident	77.2	Confident	23 Å²	23	71.6 Å²	71.6	10%	0.101	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147	-175.1	-60.9	-64.5	0	0	0	115.1	K608 C619 R620 C628 E630 Y650	K608-F623 HydrophobicContact CB-CD1 4.44Å; K608-F623 HydrophobicContact CB-CD2 3.88Å; K608-F623 HydrophobicContact CB-CE2 4.12Å; K608-F623 HydrophobicContact CB-CG 4.04Å; K608-F623 HydrophobicContact CD-CD1 4.35Å; K608-F623 HydrophobicContact CD-CE1 4.07Å; K608-F623 HydrophobicContact CD-CZ 4.2Å; K608-F623 HydrophobicContact CG-CD2 4.46Å; K608-F623 HydrophobicContact CG-CE1 4.5Å; K608-F623 HydrophobicContact CG-CE2 4.22Å; K608-F623 HydrophobicContact CG-CZ 4.23Å; C619-F623 HydrophobicContact CB-CB 4.01Å; C619-F623 WeakPolarHBondContact CB-O 3.49Å; R620-F623 HydrophobicContact CB-CD2 4.2Å; R620-F623 PolarHBondContact O-N 2.95Å; R620-F623 VanDerWaalsContact O-N 3.11Å; F623-C628 HydrophobicContact CB-CB 4.31Å; F623-E630 CarbonylContact C-O 3.59Å; F623-E630 WeakPolarHBondContact CA-O 3.3Å; F623-Y650 HydrophobicContact CD1-CE1 4.37Å; F623-Y650 AromaticContact CE1-CD1 3.79Å; F623-Y650 HydrophobicContact CE1-CD1 3.79Å; F623-Y650 AromaticContact CE1-CE1 3.29Å; F623-Y650 HydrophobicContact CE1-CE1 3.29Å; F623-Y650 HydrophobicContact CE1-CE2 4.38Å; F623-Y650 HydrophobicContact CE1-CG 4.49Å; F623-Y650 AromaticContact CE1-CZ 3.64Å; F623-Y650 HydrophobicContact CZ-CD1 4.03Å; F623-Y650 AromaticContact CZ-CE1 3.75Å; F623-Y650 HydrophobicContact CZ-CE1 3.75Å
624	T	83.3	Confident	78.4	Confident	63 Å²	63	68.3 Å²	68.3	39%	0.387	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	-172.8	179.7	-170.4	0	0	0	0	111.5	C628 E630 I632	T624-C628 VanDerWaalsContact O-CA 3.23Å; T624-C628 WeakPolarHBondContact O-CA 3.35Å; T624-E630 HydrophobicContact CG2-CB 3.57Å; T624-E630 PolarHBondContact N-O 3.45Å; T624-E630 PolarHBondContact O-N 2.04Å; T624-I632 HydrophobicContact CG2-CG1 3.86Å
625	G	80	Confident	79.3	Confident	22 Å²	22	63.5 Å²	63.5	23%	0.227	32%	0.317	C	S	.	.	S	Bend	trans	84.6	166.4	-175.2	0	0	0	0	0	113.4	N627 C628 E630	G625-N627 PolarHBondContact O-N 2.98Å; G625-C628 PolarHBondContact O-N 3.11Å; G625-E630 WeakPolarHBondContact CA-OE2 3.35Å; G625-E630 PolarHBondContact N-OE2 2.76Å
626	L	74.8	Confident	80.4	Confident	166 Å²	166	69.9 Å²	69.9	87%	0.869	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.1	-175	-70.4	169.4	0	0	0	114.5
627	N	74.6	Confident	81.1	Confident	36 Å²	36	67.5 Å²	67.5	19%	0.193	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	0.9	-166.2	63.3	-26.5	0	0	0	112.9	R603 M605 G625 S629	R603-N627 HydrophobicContact CB-CB 3.79Å; R603-N627 WeakPolarHBondContact O-CB 3.31Å; M605-N627 PolarHBondContact N-O 3.48Å; G625-N627 PolarHBondContact O-N 2.98Å; N627-S629 VanDerWaalsContact C-N 3.33Å; N627-S629 VanDerWaalsContact CG-OG 3.32Å; N627-S629 WeakPolarHBondContact ND2-CB 3.45Å; N627-S629 PolarHBondContact ND2-OG 2.9Å; N627-S629 PolarHBondContact O-N 2.87Å; N627-S629 PolarHBondContact OD1-N 2.95Å; N627-S629 PolarHBondContact OD1-OG 2.94Å; N627-S629 VanDerWaalsContact OD1-OG 3.04Å
628	C	80	Confident	81.6	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	37%	0.372	C	S	.	.	S	Bend	trans	60.6	33.1	-175.1	-44.7	0	0	0	0	114.6	K608 C619 F623 T624 G625	K608-C628 HydrophobicContact CB-CB 3.91Å; K608-C628 WeakPolarHBondContact CB-O 3.06Å; K608-C628 WeakPolarHBondContact CD-O 3.38Å; C619-C628 WeakPolarHBondContact CA-SG 3.33Å; C619-C628 HydrophobicContact CB-CB 3.79Å; C619-C628 WeakPolarHBondContact CB-SG 3.45Å; C619-C628 WeakPolarHBondContact SG-CA 3.31Å; C619-C628 WeakPolarHBondContact SG-CB 3.1Å; C619-C628 CovalentContact SG-SG 2.04Å; C619-C628 PolarHBondContact SG-SG 3.18Å; F623-C628 HydrophobicContact CB-CB 4.31Å; T624-C628 VanDerWaalsContact O-CA 3.23Å; T624-C628 WeakPolarHBondContact O-CA 3.35Å; G625-C628 PolarHBondContact O-N 3.11Å
629	S	80.5	Confident	81.7	Confident	43 Å²	43	77.3 Å²	77.3	30%	0.301	39%	0.386	S	S	.	.			trans	-91.7	-22.2	172.3	63.6	0	0	0	0	113.9	N627 Y650	N627-S629 VanDerWaalsContact C-N 3.33Å; N627-S629 VanDerWaalsContact CG-OG 3.32Å; N627-S629 WeakPolarHBondContact ND2-CB 3.45Å; N627-S629 PolarHBondContact ND2-OG 2.9Å; N627-S629 PolarHBondContact O-N 2.87Å; N627-S629 PolarHBondContact OD1-N 2.95Å; N627-S629 PolarHBondContact OD1-OG 2.94Å; N627-S629 VanDerWaalsContact OD1-OG 3.04Å; S629-Y650 PolarHBondContact O-OH 2.83Å
630	E	82.4	Confident	81.4	Confident	105 Å²	105	82.7 Å²	82.7	49%	0.491	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.2	-179.3	-66.2	161.3	-156.9	0	0	109.8	F623 T624 G625	F623-E630 CarbonylContact C-O 3.59Å; F623-E630 WeakPolarHBondContact CA-O 3.3Å; T624-E630 HydrophobicContact CG2-CB 3.57Å; T624-E630 PolarHBondContact N-O 3.45Å; T624-E630 PolarHBondContact O-N 2.04Å; G625-E630 WeakPolarHBondContact CA-OE2 3.35Å; G625-E630 PolarHBondContact N-OE2 2.76Å
631	D	84.4	Confident	81.2	Confident	46 Å²	46	79.1 Å²	79.1	25%	0.246	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	140.7	176.4	-171.7	49	0	0	0	110	N633 N648 Y650 G651	D631-N633 PolarHBondContact O-N 2.9Å; D631-N648 PolarHBondContact OD2-ND2 2.74Å; D631-Y650 HydrophobicContact CB-CD2 3.98Å; D631-Y650 HydrophobicContact CB-CE2 3.97Å; D631-G651 PolarHBondContact OD1-N 3.43Å
632	I	84.8	Confident	81	Confident	53 Å²	53	68.4 Å²	68.4	27%	0.272	36%	0.36	S	S	.	.			trans	-90	105.6	175.4	-59.4	173.3	0	0	0	107.9	G622 T624 E634 L637	G622-I632 PolarHBondContact O-N 3.06Å; T624-I632 HydrophobicContact CG2-CG1 3.86Å; I632-E634 VanDerWaalsContact C-N 3.32Å; I632-E634 HydrophobicContact CG2-CG 4.04Å; I632-E634 PolarHBondContact O-N 2.85Å; I632-L637 HydrophobicContact CG2-CD1 4.46Å
633	N	84.6	Confident	81	Confident	54 Å²	54	73.6 Å²	73.6	29%	0.289	39%	0.391	S	S	.	.			trans	-68.4	88.3	175.5	-171.8	-7.9	0	0	0	111.6	D631 C635 E636 N648	D631-N633 PolarHBondContact O-N 2.9Å; N633-C635 PolarHBondContact O-N 2.84Å; N633-C635 WeakPolarHBondContact OD1-CB 3.41Å; N633-C635 PolarHBondContact OD1-N 2.03Å; N633-E636 VanDerWaalsContact ND2-CD 3.29Å; N633-E636 WeakPolarHBondContact ND2-CG 3.43Å; N633-E636 PolarHBondContact ND2-OE1 2.83Å; N633-E636 PolarHBondContact O-N 2.93Å; N633-E636 VanDerWaalsContact O-N 3.11Å; N633-N648 VanDerWaalsContact CA-OD1 3.31Å; N633-N648 WeakPolarHBondContact CA-OD1 2.99Å; N633-N648 WeakPolarHBondContact OD1-CB 3.21Å; N633-N648 PolarHBondContact OD1-OD1 2.87Å
634	E	86.3	Confident	80.7	Confident	31 Å²	31	75.6 Å²	75.6	15%	0.145	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-67.2	-21.3	-176	-79.6	131.8	167.3	0	0	112.5	I632 E636 L637 P641 N648 S652 Y653	I632-E634 VanDerWaalsContact C-N 3.32Å; I632-E634 HydrophobicContact CG2-CG 4.04Å; I632-E634 PolarHBondContact O-N 2.85Å; E634-E636 VanDerWaalsContact C-N 3.26Å; E634-E636 PolarHBondContact O-N 2.81Å; E634-L637 HydrophobicContact CB-CD1 4.18Å; E634-L637 HydrophobicContact CG-CD1 3.75Å; E634-L637 WeakPolarHBondContact O-CB 3.44Å; E634-L637 PolarHBondContact O-N 3.28Å; E634-P641 HydrophobicContact CB-CG 4.47Å; E634-P641 WeakPolarHBondContact O-CD 3.48Å; E634-P641 WeakPolarHBondContact O-CG 3.04Å; E634-N648 PolarHBondContact N-OD1 3.29Å; E634-S652 VanDerWaalsContact OE2-C 3.27Å; E634-S652 WeakPolarHBondContact OE2-CA 3.38Å; E634-Y653 HydrophobicContact CB-CD1 3.33Å; E634-Y653 HydrophobicContact CB-CE1 3.98Å; E634-Y653 HydrophobicContact CB-CG 3.86Å; E634-Y653 HydrophobicContact CG-CD1 3.9Å; E634-Y653 HydrophobicContact CG-CE1 4.29Å; E634-Y653 WeakPolarHBondContact OE2-CD1 3.48Å; E634-Y653 PolarHBondContact OE2-N 2.79Å
635	C	85.6	Confident	80.5	Confident	18 Å²	18	73.6 Å²	73.6	12%	0.122	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-70.9	-16.6	174	-60.4	0	0	0	0	114.4	N633 C646 N648	N633-C635 PolarHBondContact O-N 2.84Å; N633-C635 WeakPolarHBondContact OD1-CB 3.41Å; N633-C635 PolarHBondContact OD1-N 2.03Å; C635-C646 WeakPolarHBondContact CA-SG 3.03Å; C635-C646 HydrophobicContact CB-CB 3.75Å; C635-C646 WeakPolarHBondContact CB-SG 3.35Å; C635-C646 WeakPolarHBondContact SG-CB 3.41Å; C635-C646 CovalentContact SG-SG 2.04Å; C635-C646 PolarHBondContact SG-SG 2.88Å; C635-N648 PolarHBondContact SG-N 2.85Å
636	E	86.7	Confident	80.8	Confident	149 Å²	149	74.3 Å²	74.3	70%	0.696	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-94.1	-12	174.8	-75	179.6	-150.3	0	0	113.7	N633 E634	N633-E636 VanDerWaalsContact ND2-CD 3.29Å; N633-E636 WeakPolarHBondContact ND2-CG 3.43Å; N633-E636 PolarHBondContact ND2-OE1 2.83Å; N633-E636 PolarHBondContact O-N 2.93Å; N633-E636 VanDerWaalsContact O-N 3.11Å; E634-E636 VanDerWaalsContact C-N 3.26Å; E634-E636 PolarHBondContact O-N 2.81Å
637	L	83	Confident	81.2	Confident	90 Å²	90	69 Å²	69	47%	0.471	37%	0.368	S	S	.	.	S	Bend	trans	-63.9	155.6	178.5	-65.2	177.3	0	0	0	112.4	I632 E634 P639 K640	I632-L637 HydrophobicContact CG2-CD1 4.46Å; E634-L637 HydrophobicContact CB-CD1 4.18Å; E634-L637 HydrophobicContact CG-CD1 3.75Å; E634-L637 WeakPolarHBondContact O-CB 3.44Å; E634-L637 PolarHBondContact O-N 3.28Å; L637-P639 CarbonylContact C-O 3.52Å; L637-P639 CarbonylContact O-C 3.4Å; L637-K640 WeakPolarHBondContact O-CA 3.04Å; L637-K640 PolarHBondContact O-N 2.74Å
638	K	81.1	Confident	81.5	Confident	200 Å²	200	69.4 Å²	69.4	87%	0.87	37%	0.37	S	S	*	.	S	Bend	trans	-127.8	118.1	177.8	-68.2	-179.5	-177	173.4	0	109.2
639	P	81.6	Confident	81.4	Confident	124 Å²	124	72 Å²	72	81%	0.805	39%	0.386	S	S	*	.	S	Bend	cis	-63.1	151.2	-1.4	29.5	-36.5	0	0	0	112.7	L637	L637-P639 CarbonylContact C-O 3.52Å; L637-P639 CarbonylContact O-C 3.4Å
640	K	74.4	Confident	81.3	Confident	149 Å²	149	74.1 Å²	74.1	65%	0.648	39%	0.388	S	S	*	.			trans	-65.3	142.5	172.2	-76.3	-169.4	169.4	-166.8	0	109.5	L637 C642	L637-K640 WeakPolarHBondContact O-CA 3.04Å; L637-K640 PolarHBondContact O-N 2.74Å; K640-C642 VanDerWaalsContact C-N 3.31Å; K640-C642 PolarHBondContact O-N 3.36Å
641	P	75.1	Confident	81	Confident	47 Å²	47	70.1 Å²	70.1	31%	0.305	38%	0.375	S	S	.	.	S	Bend	trans	-79.8	-13.1	-177.9	33.1	-37.5	0	0	0	113.8	E634 Y653	E634-P641 HydrophobicContact CB-CG 4.47Å; E634-P641 WeakPolarHBondContact O-CD 3.48Å; E634-P641 WeakPolarHBondContact O-CG 3.04Å; P641-Y653 HydrophobicContact CB-CD2 4.23Å; P641-Y653 HydrophobicContact CB-CE1 4.22Å; P641-Y653 HydrophobicContact CB-CE2 3.49Å; P641-Y653 VanDerWaalsContact CB-CE2 3.49Å; P641-Y653 VanDerWaalsContact CB-CZ 3.49Å; P641-Y653 HydrophobicContact CG-CD2 3.82Å; P641-Y653 HydrophobicContact CG-CE1 4.34Å; P641-Y653 HydrophobicContact CG-CE2 3.61Å; P641-Y653 HydrophobicContact CG-CG 4.28Å
642	C	76.9	Confident	80.8	Confident	16 Å²	16	70.6 Å²	70.6	11%	0.108	38%	0.382	C	S	.	.			trans	-119.5	147.1	-174.9	-62.8	0	0	0	0	112.6	K640 G645 C646 C655	K640-C642 VanDerWaalsContact C-N 3.31Å; K640-C642 PolarHBondContact O-N 3.36Å; C642-G645 VanDerWaalsContact CB-O 3.23Å; C642-G645 WeakPolarHBondContact CB-O 3.4Å; C642-C646 HydrophobicContact CB-CB 3.83Å; C642-C655 WeakPolarHBondContact CA-SG 3.44Å; C642-C655 HydrophobicContact CB-CB 3.58Å; C642-C655 WeakPolarHBondContact CB-SG 3.02Å; C642-C655 WeakPolarHBondContact SG-CA 3.48Å; C642-C655 WeakPolarHBondContact SG-CB 3.32Å; C642-C655 CovalentContact SG-SG 2.03Å; C642-C655 PolarHBondContact SG-SG 2.94Å
643	V	75.5	Confident	80.8	Confident	110 Å²	110	72.1 Å²	72.1	67%	0.667	39%	0.385	S	S	*	.	S	Bend	trans	-87.4	-40.7	-174.4	-175.7	0	0	0	0	113.1
644	Q	78.5	Confident	80.6	Confident	65 Å²	65	74.9 Å²	74.9	30%	0.304	39%	0.392	S	S	.	.	S	Bend	trans	-104.9	-95.5	178.9	-73.2	177.1	-15.4	0	0	110.1	C657 D658 C669	Q644-C657 VanDerWaalsContact OE1-CA 3.28Å; Q644-D658 WeakPolarHBondContact CG-OD2 3.42Å; Q644-C669 HydrophobicContact CG-CB 4.29Å; Q644-C669 PolarHBondContact OE1-SG 3.16Å
645	G	80.3	Confident	80.3	Confident	21 Å²	21	73.6 Å²	73.6	22%	0.216	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	159.9	174.1	0	0	0	0	0	113.1	C642 C655 T656	C642-G645 VanDerWaalsContact CB-O 3.23Å; C642-G645 WeakPolarHBondContact CB-O 3.4Å; G645-C655 VanDerWaalsContact O-CA 3.29Å; G645-C655 WeakPolarHBondContact O-CA 3.5Å; G645-C655 WeakPolarHBondContact O-CB 3.48Å; G645-T656 WeakPolarHBondContact CA-O 3.45Å; G645-T656 WeakPolarHBondContact CA-OG1 3.24Å; G645-T656 PolarHBondContact N-O 2.86Å; G645-T656 PolarHBondContact O-N 2.91Å
646	C	85.1	Confident	79.8	Confident	38 Å²	38	75.2 Å²	75.2	26%	0.257	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	130.5	174.2	-170.1	0	0	0	0	108.6	C635 C642	C635-C646 WeakPolarHBondContact CA-SG 3.03Å; C635-C646 HydrophobicContact CB-CB 3.75Å; C635-C646 WeakPolarHBondContact CB-SG 3.35Å; C635-C646 WeakPolarHBondContact SG-CB 3.41Å; C635-C646 CovalentContact SG-SG 2.04Å; C635-C646 PolarHBondContact SG-SG 2.88Å; C642-C646 HydrophobicContact CB-CB 3.83Å
647	V	83.9	Confident	79.2	Confident	53 Å²	53	69.9 Å²	69.9	32%	0.321	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	121.3	173.7	179.7	0	0	0	0	107.9	Y653 Y654 T656	V647-Y653 WeakPolarHBondContact O-CA 3.36Å; V647-Y654 HydrophobicContact CB-CD1 4.02Å; V647-Y654 HydrophobicContact CB-CE1 3.54Å; V647-Y654 HydrophobicContact CB-CE2 4.18Å; V647-Y654 HydrophobicContact CG1-CD1 4.28Å; V647-Y654 HydrophobicContact CG1-CE1 3.46Å; V647-Y654 VanDerWaalsContact CG1-CE1 3.46Å; V647-Y654 HydrophobicContact CG2-CE1 4.45Å; V647-Y654 HydrophobicContact CG2-CE2 4.36Å; V647-Y654 PolarHBondContact N-O 2.03Å; V647-Y654 PolarHBondContact O-N 2.88Å; V647-T656 HydrophobicContact CG2-CG2 3.74Å
648	N	81.6	Confident	78.8	Confident	46 Å²	46	70.2 Å²	70.2	25%	0.246	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.8	177.4	-164.6	70.5	0	0	0	110.2	D631 N633 E634 C635 S652	D631-N648 PolarHBondContact OD2-ND2 2.74Å; N633-N648 VanDerWaalsContact CA-OD1 3.31Å; N633-N648 WeakPolarHBondContact CA-OD1 2.99Å; N633-N648 WeakPolarHBondContact OD1-CB 3.21Å; N633-N648 PolarHBondContact OD1-OD1 2.87Å; E634-N648 PolarHBondContact N-OD1 3.29Å; C635-N648 PolarHBondContact SG-N 2.85Å; N648-S652 PolarHBondContact OD1-O 2.04Å
649	T	77.4	Confident	77.7	Confident	55 Å²	55	71.3 Å²	71.3	34%	0.337	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.4	178.8	50.5	0	0	0	0	109.9	G651 S652 Y654	T649-G651 PolarHBondContact O-N 3.33Å; T649-S652 CarbonylContact C-O 3.59Å; T649-S652 PolarHBondContact N-O 2.98Å; T649-S652 CarbonylContact O-C 3.35Å; T649-S652 PolarHBondContact O-N 3.44Å; T649-S652 PolarHBondContact OG1-O 2.74Å; T649-Y654 HydrophobicContact CG2-CD1 3.63Å; T649-Y654 HydrophobicContact CG2-CE1 3.6Å
650	Y	78.4	Confident	76.5	Confident	87 Å²	87	66.9 Å²	66.9	34%	0.341	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	104.6	-171.8	-169.3	-89.5	0	0	0	111.5	T233 K608 F623 S629 D631	T233-Y650 VanDerWaalsContact O-CD1 3.23Å; T233-Y650 WeakPolarHBondContact O-CD1 3.4Å; K608-Y650 HydrophobicContact CD-CE1 3.84Å; K608-Y650 WeakPolarHBondContact CD-OH 3.03Å; K608-Y650 VanDerWaalsContact NZ-CZ 3.32Å; K608-Y650 PolarHBondContact NZ-OH 3.44Å; F623-Y650 HydrophobicContact CD1-CE1 4.37Å; F623-Y650 AromaticContact CE1-CD1 3.79Å; F623-Y650 HydrophobicContact CE1-CD1 3.79Å; F623-Y650 AromaticContact CE1-CE1 3.29Å; F623-Y650 HydrophobicContact CE1-CE1 3.29Å; F623-Y650 HydrophobicContact CE1-CE2 4.38Å; F623-Y650 HydrophobicContact CE1-CG 4.49Å; F623-Y650 AromaticContact CE1-CZ 3.64Å; F623-Y650 HydrophobicContact CZ-CD1 4.03Å; F623-Y650 AromaticContact CZ-CE1 3.75Å; F623-Y650 HydrophobicContact CZ-CE1 3.75Å; S629-Y650 PolarHBondContact O-OH 2.83Å; D631-Y650 HydrophobicContact CB-CD2 3.98Å; D631-Y650 HydrophobicContact CB-CE2 3.97Å
651	G	75.6	Confident	76.1	Confident	20 Å²	20	64.5 Å²	64.5	21%	0.206	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	8.3	-172.7	0	0	0	0	0	116.2	D631 T649	D631-G651 PolarHBondContact OD1-N 3.43Å; T649-G651 PolarHBondContact O-N 3.33Å
652	S	80.1	Confident	75.7	Confident	57 Å²	57	66.4 Å²	66.4	40%	0.399	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	-176	-178.8	-168.1	0	0	0	0	112.4	E634 N648 T649	E634-S652 VanDerWaalsContact OE2-C 3.27Å; E634-S652 WeakPolarHBondContact OE2-CA 3.38Å; N648-S652 PolarHBondContact OD1-O 2.04Å; T649-S652 CarbonylContact C-O 3.59Å; T649-S652 PolarHBondContact N-O 2.98Å; T649-S652 CarbonylContact O-C 3.35Å; T649-S652 PolarHBondContact O-N 3.44Å; T649-S652 PolarHBondContact OG1-O 2.74Å
653	Y	84.9	Confident	74.9	Confident	84 Å²	84	69.7 Å²	69.7	33%	0.329	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	166.4	158.5	64.9	-73.9	0	0	0	109.7	E634 P641 V647	E634-Y653 HydrophobicContact CB-CD1 3.33Å; E634-Y653 HydrophobicContact CB-CE1 3.98Å; E634-Y653 HydrophobicContact CB-CG 3.86Å; E634-Y653 HydrophobicContact CG-CD1 3.9Å; E634-Y653 HydrophobicContact CG-CE1 4.29Å; E634-Y653 WeakPolarHBondContact OE2-CD1 3.48Å; E634-Y653 PolarHBondContact OE2-N 2.79Å; P641-Y653 HydrophobicContact CB-CD2 4.23Å; P641-Y653 HydrophobicContact CB-CE1 4.22Å; P641-Y653 HydrophobicContact CB-CE2 3.49Å; P641-Y653 VanDerWaalsContact CB-CE2 3.49Å; P641-Y653 VanDerWaalsContact CB-CZ 3.49Å; P641-Y653 HydrophobicContact CG-CD2 3.82Å; P641-Y653 HydrophobicContact CG-CE1 4.34Å; P641-Y653 HydrophobicContact CG-CE2 3.61Å; P641-Y653 HydrophobicContact CG-CG 4.28Å; V647-Y653 WeakPolarHBondContact O-CA 3.36Å
654	Y	81.8	Confident	74.1	Confident	112 Å²	112	66.3 Å²	66.3	44%	0.439	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.9	159.1	69.8	-80	0	0	0	110.5	V647 T649 T656	V647-Y654 HydrophobicContact CB-CD1 4.02Å; V647-Y654 HydrophobicContact CB-CE1 3.54Å; V647-Y654 HydrophobicContact CB-CE2 4.18Å; V647-Y654 HydrophobicContact CG1-CD1 4.28Å; V647-Y654 HydrophobicContact CG1-CE1 3.46Å; V647-Y654 VanDerWaalsContact CG1-CE1 3.46Å; V647-Y654 HydrophobicContact CG2-CE1 4.45Å; V647-Y654 HydrophobicContact CG2-CE2 4.36Å; V647-Y654 PolarHBondContact N-O 2.03Å; V647-Y654 PolarHBondContact O-N 2.88Å; T649-Y654 HydrophobicContact CG2-CD1 3.63Å; T649-Y654 HydrophobicContact CG2-CE1 3.6Å; Y654-T656 HydrophobicContact CD2-CG2 3.99Å; Y654-T656 HydrophobicContact CE2-CG2 3.5Å
655	C	79.7	Confident	73.4	Confident	4 Å²	4	72.5 Å²	72.5	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	143.4	171.3	-46.4	0	0	0	0	110.2	C642 G645 Q663	C642-C655 WeakPolarHBondContact CA-SG 3.44Å; C642-C655 HydrophobicContact CB-CB 3.58Å; C642-C655 WeakPolarHBondContact CB-SG 3.02Å; C642-C655 WeakPolarHBondContact SG-CA 3.48Å; C642-C655 WeakPolarHBondContact SG-CB 3.32Å; C642-C655 CovalentContact SG-SG 2.03Å; C642-C655 PolarHBondContact SG-SG 2.94Å; G645-C655 VanDerWaalsContact O-CA 3.29Å; G645-C655 WeakPolarHBondContact O-CA 3.5Å; G645-C655 WeakPolarHBondContact O-CB 3.48Å; C655-Q663 PolarHBondContact O-NE2 3.45Å; C655-Q663 PolarHBondContact O-OE1 2.93Å
656	T	73.6	Confident	72.5	Confident	53 Å²	53	79.6 Å²	79.6	33%	0.325	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.4	169.1	46.8	0	0	0	0	109.5	G645 V647 Y654	G645-T656 WeakPolarHBondContact CA-O 3.45Å; G645-T656 WeakPolarHBondContact CA-OG1 3.24Å; G645-T656 PolarHBondContact N-O 2.86Å; G645-T656 PolarHBondContact O-N 2.91Å; V647-T656 HydrophobicContact CG2-CG2 3.74Å; Y654-T656 HydrophobicContact CD2-CG2 3.99Å; Y654-T656 HydrophobicContact CE2-CG2 3.5Å
657	C	74.7	Confident	71.2	Confident	36 Å²	36	78.3 Å²	78.3	24%	0.243	38%	0.379	C	S	.	.			trans	-109	144	-178.2	-62.3	0	0	0	0	110.7	Q644 Y661 C669	Q644-C657 VanDerWaalsContact OE1-CA 3.28Å; C657-Y661 WeakPolarHBondContact CB-O 3.5Å; C657-C669 WeakPolarHBondContact CA-SG 3.02Å; C657-C669 HydrophobicContact CB-CB 3.69Å; C657-C669 WeakPolarHBondContact CB-SG 3.28Å; C657-C669 WeakPolarHBondContact SG-CA 3.34Å; C657-C669 WeakPolarHBondContact SG-CB 3.22Å; C657-C669 CovalentContact SG-SG 2.04Å; C657-C669 PolarHBondContact SG-SG 3.47Å
658	D	74.6	Confident	70.3	Confident	97 Å²	97	79.8 Å²	79.8	52%	0.519	38%	0.382	S	S	.	.			trans	-64.4	157.9	-179.9	-70.6	-53.1	0	0	0	111.5	Q644 G660 Y661	Q644-D658 WeakPolarHBondContact CG-OD2 3.42Å; D658-G660 PolarHBondContact O-N 2.04Å; D658-Y661 HydrophobicContact CB-CD2 4.27Å; D658-Y661 PolarHBondContact O-N 3.45Å
659	K	57.6	Low	69.6	Low	223 Å²	223	78.6 Å²	78.6	97%	0.97	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	93.1	-176.8	-174.1	-178.6	179.3	178.9	0	111.2
660	G	56.7	Low	68.8	Low	32 Å²	32	78.6 Å²	78.6	33%	0.33	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	137.4	0.1	-170.5	0	0	0	0	0	114.5	D658 P671 N672	D658-G660 PolarHBondContact O-N 2.04Å; G660-P671 CarbonylContact O-C 3.47Å; G660-P671 WeakPolarHBondContact O-CA 3Å; G660-N672 WeakPolarHBondContact O-CB 3.32Å; G660-N672 PolarHBondContact O-N 2.86Å
661	Y	66.5	Low	67.9	Low	98 Å²	98	76.8 Å²	76.8	38%	0.384	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.9	-180	-61.8	-101.4	0	0	0	113.2	C657 D658 C669 L670 P671 N672	C657-Y661 WeakPolarHBondContact CB-O 3.5Å; D658-Y661 HydrophobicContact CB-CD2 4.27Å; D658-Y661 PolarHBondContact O-N 3.45Å; Y661-C669 HydrophobicContact CD1-CB 4.38Å; Y661-C669 WeakPolarHBondContact CD1-O 3.2Å; Y661-C669 HydrophobicContact CG-CB 4.37Å; Y661-L670 CarbonylContact C-O 3.6Å; Y661-L670 WeakPolarHBondContact CA-O 3.31Å; Y661-L670 WeakPolarHBondContact CB-O 3.42Å; Y661-P671 HydrophobicContact CD1-CG 4.21Å; Y661-P671 HydrophobicContact CE1-CG 3.92Å; Y661-N672 VanDerWaalsContact C-ND2 3.35Å; Y661-N672 PolarHBondContact N-ND2 2.03Å; Y661-N672 VanDerWaalsContact N-ND2 3.16Å; Y661-N672 PolarHBondContact O-ND2 3.5Å; Y661-N672 VanDerWaalsContact O-ND2 3.09Å; Y661-N672 PolarHBondContact O-OD1 2.79Å
662	H	66.5	Low	66.9	Low	88 Å²	88	80 Å²	80	41%	0.407	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	161.3	170.8	63	-74.8	0	0	0	110.4	C669 L670 P671 N672	H662-C669 CarbonylContact O-C 3.59Å; H662-C669 VanDerWaalsContact O-CA 3.29Å; H662-C669 WeakPolarHBondContact O-CA 3.04Å; H662-L670 PolarHBondContact N-O 3.3Å; H662-L670 PolarHBondContact ND1-O 2.7Å; H662-L670 VanDerWaalsContact ND1-O 3.11Å; H662-L670 PolarHBondContact O-N 2.9Å; H662-P671 PolarHBondContact CE1-O 2.76Å; H662-P671 VanDerWaalsContact CE1-O 3.23Å; H662-P671 PolarHBondContact ND1-O 2.78Å; H662-P671 VanDerWaalsContact ND1-O 3.16Å; H662-N672 WeakPolarHBondContact CA-OD1 3Å; H662-N672 WeakPolarHBondContact CB-OD1 3.39Å; H662-N672 PolarHBondContact N-OD1 3.31Å
663	Q	59.3	Low	65.7	Low	85 Å²	85	82.9 Å²	82.9	40%	0.397	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130	-176.1	-162.4	174.6	18.9	0	0	111.5	C655 H668	C655-Q663 PolarHBondContact O-NE2 3.45Å; C655-Q663 PolarHBondContact O-OE1 2.93Å; Q663-H668 CarbonylContact C-O 3.35Å; Q663-H668 WeakPolarHBondContact CA-O 3.04Å
664	D	60.4	Low	64.7	Low	39 Å²	39	79.2 Å²	79.2	21%	0.209	38%	0.378	C	S	.	.			trans	-76	170.6	167.7	88.5	-18.4	0	0	0	111.5	R666 G667 H668 L670	D664-R666 PolarHBondContact O-N 3.38Å; D664-R666 VanDerWaalsContact OD1-C 3.25Å; D664-R666 VanDerWaalsContact OD1-CA 3.27Å; D664-R666 WeakPolarHBondContact OD1-CA 3.37Å; D664-R666 WeakPolarHBondContact OD1-CB 3.18Å; D664-R666 PolarHBondContact OD1-N 3.12Å; D664-G667 PolarHBondContact O-N 3.25Å; D664-G667 PolarHBondContact OD1-N 3.04Å; D664-H668 PolarHBondContact N-O 3.15Å; D664-H668 IonicContact OD1-CG 2.59Å; D664-H668 PolarHBondContact OD1-N 3.24Å; D664-H668 IonicContact OD1-ND1 3.99Å; D664-H668 PolarHBondContact OD1-ND1 3.08Å; D664-H668 VanDerWaalsContact OD1-ND1 3.16Å; D664-H668 IonicContact OD2-CG 2.64Å; D664-H668 IonicContact OD2-ND1 2.72Å; D664-H668 PolarHBondContact OD2-ND1 2.88Å; D664-L670 HydrophobicContact CB-CD1 4.03Å
665	Y	62.4	Low	63.9	Low	194 Å²	194	79.1 Å²	79.1	76%	0.761	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	1.2	178.5	71.4	-87.9	0	0	0	114.8
666	R	61.4	Low	63.6	Low	170 Å²	170	81.5 Å²	81.5	64%	0.642	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-0.2	177.3	-53.7	-178.1	179.6	-157.9	-0.4	112.9	D664	D664-R666 PolarHBondContact O-N 3.38Å; D664-R666 VanDerWaalsContact OD1-C 3.25Å; D664-R666 VanDerWaalsContact OD1-CA 3.27Å; D664-R666 WeakPolarHBondContact OD1-CA 3.37Å; D664-R666 WeakPolarHBondContact OD1-CB 3.18Å; D664-R666 PolarHBondContact OD1-N 3.12Å
667	G	58	Low	63.6	Low	12 Å²	12	84.9 Å²	84.9	12%	0.124	42%	0.421	C	S	.	.	S	Bend	trans	92.9	4.7	-179.9	0	0	0	0	0	116.2	D664	D664-G667 PolarHBondContact O-N 3.25Å; D664-G667 PolarHBondContact OD1-N 3.04Å
668	H	65.7	Low	63.9	Low	84 Å²	84	84.5 Å²	84.5	39%	0.389	42%	0.419	S	S	.	.			trans	-79.2	142.2	176.6	-53	96.6	0	0	0	111.7	Q663 D664	Q663-H668 CarbonylContact C-O 3.35Å; Q663-H668 WeakPolarHBondContact CA-O 3.04Å; D664-H668 PolarHBondContact N-O 3.15Å; D664-H668 IonicContact OD1-CG 2.59Å; D664-H668 PolarHBondContact OD1-N 3.24Å; D664-H668 IonicContact OD1-ND1 3.99Å; D664-H668 PolarHBondContact OD1-ND1 3.08Å; D664-H668 VanDerWaalsContact OD1-ND1 3.16Å; D664-H668 IonicContact OD2-CG 2.64Å; D664-H668 IonicContact OD2-ND1 2.72Å; D664-H668 PolarHBondContact OD2-ND1 2.88Å
669	C	66.9	Low	64.3	Low	21 Å²	21	82.7 Å²	82.7	14%	0.142	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	107.5	177.9	-62.5	0	0	0	0	110.9	Q644 C657 Y661 H662	Q644-C669 HydrophobicContact CG-CB 4.29Å; Q644-C669 PolarHBondContact OE1-SG 3.16Å; C657-C669 WeakPolarHBondContact CA-SG 3.02Å; C657-C669 HydrophobicContact CB-CB 3.69Å; C657-C669 WeakPolarHBondContact CB-SG 3.28Å; C657-C669 WeakPolarHBondContact SG-CA 3.34Å; C657-C669 WeakPolarHBondContact SG-CB 3.22Å; C657-C669 CovalentContact SG-SG 2.04Å; C657-C669 PolarHBondContact SG-SG 3.47Å; Y661-C669 HydrophobicContact CD1-CB 4.38Å; Y661-C669 WeakPolarHBondContact CD1-O 3.2Å; Y661-C669 HydrophobicContact CG-CB 4.37Å; H662-C669 CarbonylContact O-C 3.59Å; H662-C669 VanDerWaalsContact O-CA 3.29Å; H662-C669 WeakPolarHBondContact O-CA 3.04Å
670	L	59.3	Low	65.3	Low	55 Å²	55	81.3 Å²	81.3	29%	0.288	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.2	176.9	-62.3	177.1	0	0	0	110.4	Y661 H662 D664 N672	Y661-L670 CarbonylContact C-O 3.6Å; Y661-L670 WeakPolarHBondContact CA-O 3.31Å; Y661-L670 WeakPolarHBondContact CB-O 3.42Å; H662-L670 PolarHBondContact N-O 3.3Å; H662-L670 PolarHBondContact ND1-O 2.7Å; H662-L670 VanDerWaalsContact ND1-O 3.11Å; H662-L670 PolarHBondContact O-N 2.9Å; D664-L670 HydrophobicContact CB-CD1 4.03Å; L670-N672 PolarHBondContact O-N 2.92Å
671	P	59.4	Low	66.2	Low	48 Å²	48	82.7 Å²	82.7	31%	0.312	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	134.4	-178.5	-27.8	35.6	0	0	0	114	G660 Y661 H662 K673	G660-P671 CarbonylContact O-C 3.47Å; G660-P671 WeakPolarHBondContact O-CA 3Å; Y661-P671 HydrophobicContact CD1-CG 4.21Å; Y661-P671 HydrophobicContact CE1-CG 3.92Å; H662-P671 PolarHBondContact CE1-O 2.76Å; H662-P671 VanDerWaalsContact CE1-O 3.23Å; H662-P671 PolarHBondContact ND1-O 2.78Å; H662-P671 VanDerWaalsContact ND1-O 3.16Å; P671-K673 VanDerWaalsContact C-N 3.27Å; P671-K673 PolarHBondContact O-N 3.4Å
672	N	56	Low	67.1	Low	87 Å²	87	80.2 Å²	80.2	47%	0.465	41%	0.413	S	S	.	.	S	Bend	trans	-68.8	-20.1	-177.5	-93.4	-23.8	0	0	0	114.6	G660 Y661 H662 L670	G660-N672 WeakPolarHBondContact O-CB 3.32Å; G660-N672 PolarHBondContact O-N 2.86Å; Y661-N672 VanDerWaalsContact C-ND2 3.35Å; Y661-N672 PolarHBondContact N-ND2 2.03Å; Y661-N672 VanDerWaalsContact N-ND2 3.16Å; Y661-N672 PolarHBondContact O-ND2 3.5Å; Y661-N672 VanDerWaalsContact O-ND2 3.09Å; Y661-N672 PolarHBondContact O-OD1 2.79Å; H662-N672 WeakPolarHBondContact CA-OD1 3Å; H662-N672 WeakPolarHBondContact CB-OD1 3.39Å; H662-N672 PolarHBondContact N-OD1 3.31Å; L670-N672 PolarHBondContact O-N 2.92Å
673	K	54.4	Low	67.8	Low	118 Å²	118	76.7 Å²	76.7	51%	0.513	40%	0.401	S	S	.	.	S	Bend	trans	-141.3	140.7	-177.4	-75	-174.4	174.9	-95.6	0	109	P671 E677	P671-K673 VanDerWaalsContact C-N 3.27Å; P671-K673 PolarHBondContact O-N 3.4Å; K673-E677 IonicContact NZ-OE1 3.86Å; K673-E677 PolarHBondContact NZ-OE1 3.21Å; K673-E677 IonicContact NZ-OE2 3.07Å; K673-E677 PolarHBondContact NZ-OE2 3.28Å
674	C	63.4	Low	69	Low	7 Å²	7	78.7 Å²	78.7	5%	0.047	41%	0.41	C	S	.	.			trans	-61.6	143.2	153.3	-85.5	0	0	0	0	109.1	P676 E677 C678 C685 G689 K690	C674-P676 VanDerWaalsContact C-C 3.43Å; C674-P676 CarbonylContact C-O 3.47Å; C674-P676 WeakPolarHBondContact CB-O 3.31Å; C674-P676 CarbonylContact O-C 3.41Å; C674-P676 VanDerWaalsContact O-O 3.12Å; C674-E677 WeakPolarHBondContact O-CA 3.41Å; C674-E677 PolarHBondContact O-N 2.77Å; C674-C678 VanDerWaalsContact CB-SG 3.59Å; C674-C685 HydrophobicContact CB-CB 4.1Å; C674-C685 WeakPolarHBondContact CB-SG 3.5Å; C674-C685 PolarHBondContact N-SG 3.23Å; C674-C685 VanDerWaalsContact N-SG 3.38Å; C674-C685 WeakPolarHBondContact SG-CA 3.45Å; C674-C685 WeakPolarHBondContact SG-CB 3.18Å; C674-C685 CovalentContact SG-SG 2.04Å; C674-C685 PolarHBondContact SG-SG 2.76Å; C674-G689 WeakPolarHBondContact CA-O 3.41Å; C674-K690 PolarHBondContact SG-O 3.37Å; C674-K690 VanDerWaalsContact SG-O 3.4Å
675	S	65.3	Low	69.8	Low	110 Å²	110	80.2 Å²	80.2	77%	0.769	42%	0.424	S	S	*	.	S	Bend	trans	-128.8	96.3	-176.1	175.2	0	0	0	0	109.7	G689	S675-G689 PolarHBondContact N-O 2.97Å
676	P	74	Confident	70.5	Confident	55 Å²	55	72.9 Å²	72.9	36%	0.357	40%	0.399	S	S	.	.	S	Bend	cis	-74.4	167.5	6.9	32.7	-37.3	0	0	0	114.6	C674 L700	C674-P676 VanDerWaalsContact C-C 3.43Å; C674-P676 CarbonylContact C-O 3.47Å; C674-P676 WeakPolarHBondContact CB-O 3.31Å; C674-P676 CarbonylContact O-C 3.41Å; C674-P676 VanDerWaalsContact O-O 3.12Å; P676-L700 HydrophobicContact CG-CB 3.56Å
677	E	72.9	Confident	70.6	Confident	123 Å²	123	69.6 Å²	69.6	58%	0.575	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-76.5	129	-176.6	-176.3	153.4	-150	0	0	111.1	K673 C674 S701	K673-E677 IonicContact NZ-OE1 3.86Å; K673-E677 PolarHBondContact NZ-OE1 3.21Å; K673-E677 IonicContact NZ-OE2 3.07Å; K673-E677 PolarHBondContact NZ-OE2 3.28Å; C674-E677 WeakPolarHBondContact O-CA 3.41Å; C674-E677 PolarHBondContact O-N 2.77Å; E677-S701 WeakPolarHBondContact O-CB 3.45Å
678	C	81.3	Confident	71.3	Confident	29 Å²	29	74 Å²	74	20%	0.196	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-68.7	138	-170.9	-42	0	0	0	0	112	C674 H680 C691 S701	C674-C678 VanDerWaalsContact CB-SG 3.59Å; C678-H680 PolarHBondContact O-N 3.09Å; C678-C691 WeakPolarHBondContact CA-SG 3.28Å; C678-C691 HydrophobicContact CB-CB 3.95Å; C678-C691 WeakPolarHBondContact CB-SG 3.49Å; C678-C691 VanDerWaalsContact SG-CA 3.6Å; C678-C691 WeakPolarHBondContact SG-CB 3.43Å; C678-C691 CovalentContact SG-SG 2.03Å; C678-C691 PolarHBondContact SG-SG 2.9Å; C678-S701 CarbonylContact C-O 3.55Å; C678-S701 WeakPolarHBondContact CA-O 3.01Å
679	V	82.8	Confident	71.5	Confident	58 Å²	58	70.6 Å²	70.6	35%	0.352	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-66	133.1	175.7	-177	0	0	0	0	109.9	G681 Q682 S701 E703	V679-G681 PolarHBondContact O-N 3.35Å; V679-G681 VanDerWaalsContact O-N 3.09Å; V679-Q682 HydrophobicContact CB-CB 4.22Å; V679-Q682 HydrophobicContact CB-CG 4.42Å; V679-Q682 VanDerWaalsContact CB-OE1 3.24Å; V679-Q682 HydrophobicContact CG1-CG 4.24Å; V679-Q682 PolarHBondContact O-N 2.59Å; V679-S701 PolarHBondContact N-O 3.16Å; V679-E703 HydrophobicContact CG2-CB 4.13Å
680	H	78.2	Confident	72	Confident	195 Å²	195	76.5 Å²	76.5	90%	0.903	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	110.7	-165.3	-157.8	-104.8	0	0	0	111.9	C678	C678-H680 PolarHBondContact O-N 3.09Å
681	G	76.3	Confident	73.1	Confident	60 Å²	60	74.8 Å²	74.8	62%	0.619	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-1.6	-176.7	0	0	0	0	0	116	V679 N694	V679-G681 PolarHBondContact O-N 3.35Å; V679-G681 VanDerWaalsContact O-N 3.09Å; G681-N694 PolarHBondContact O-ND2 3.18Å
682	Q	85.7	Confident	74.4	Confident	46 Å²	46	77.2 Å²	77.2	22%	0.215	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-5.9	179.5	-64.2	-177.6	-25.7	0	0	113.6	V679 N694 F697 C702	V679-Q682 HydrophobicContact CB-CB 4.22Å; V679-Q682 HydrophobicContact CB-CG 4.42Å; V679-Q682 VanDerWaalsContact CB-OE1 3.24Å; V679-Q682 HydrophobicContact CG1-CG 4.24Å; V679-Q682 PolarHBondContact O-N 2.59Å; Q682-N694 PolarHBondContact O-N 2.9Å; Q682-F697 HydrophobicContact CB-CB 4.48Å; Q682-F697 HydrophobicContact CB-CD1 4.14Å; Q682-F697 HydrophobicContact CB-CD2 4.09Å; Q682-F697 HydrophobicContact CB-CE1 4.45Å; Q682-F697 HydrophobicContact CB-CE2 4.38Å; Q682-F697 HydrophobicContact CB-CG 3.95Å; Q682-F697 HydrophobicContact CG-CD1 3.94Å; Q682-F697 HydrophobicContact CG-CD2 4.22Å; Q682-F697 HydrophobicContact CG-CE1 3.78Å; Q682-F697 HydrophobicContact CG-CE2 4.03Å; Q682-F697 HydrophobicContact CG-CG 4.17Å; Q682-F697 HydrophobicContact CG-CZ 3.81Å; Q682-C702 HydrophobicContact CB-CB 4Å; Q682-C702 WeakPolarHBondContact O-CB 3.45Å; Q682-C702 PolarHBondContact OE1-O 3.41Å
683	G	81.8	Confident	75.9	Confident	15 Å²	15	74.8 Å²	74.8	16%	0.155	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	166.6	171.3	0	0	0	0	0	113.8	M692	G683-M692 CarbonylContact C-O 3.57Å; G683-M692 WeakPolarHBondContact CA-O 3.41Å
684	E	82.8	Confident	77.5	Confident	126 Å²	126	72 Å²	72	59%	0.589	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	143.9	177.5	-64.2	-171.8	157	0	0	111.4	T686 C691 M692	E684-T686 PolarHBondContact O-N 2.79Å; E684-C691 WeakPolarHBondContact O-CA 3.43Å; E684-M692 HydrophobicContact CB-CE 4.18Å; E684-M692 PolarHBondContact N-O 2.82Å; E684-M692 PolarHBondContact O-N 2.74Å
685	C	78.1	Confident	78.5	Confident	72 Å²	72	77.5 Å²	77.5	49%	0.486	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.7	177.9	-171.3	0	0	0	0	110.9	C674	C674-C685 HydrophobicContact CB-CB 4.1Å; C674-C685 WeakPolarHBondContact CB-SG 3.5Å; C674-C685 PolarHBondContact N-SG 3.23Å; C674-C685 VanDerWaalsContact N-SG 3.38Å; C674-C685 WeakPolarHBondContact SG-CA 3.45Å; C674-C685 WeakPolarHBondContact SG-CB 3.18Å; C674-C685 CovalentContact SG-SG 2.04Å; C674-C685 PolarHBondContact SG-SG 2.76Å
686	T	76.9	Confident	79.3	Confident	40 Å²	40	72.8 Å²	72.8	25%	0.245	42%	0.419	C	S	.	.			trans	-83.7	159.9	-178.1	61	0	0	0	0	112.6	E684 N688 G689 K690 M692	E684-T686 PolarHBondContact O-N 2.79Å; T686-N688 PolarHBondContact O-N 3.48Å; T686-N688 PolarHBondContact OG1-ND2 2.86Å; T686-N688 PolarHBondContact OG1-OD1 3.06Å; T686-N688 VanDerWaalsContact OG1-OD1 3.04Å; T686-G689 PolarHBondContact O-N 3.24Å; T686-K690 PolarHBondContact N-O 3.03Å; T686-K690 PolarHBondContact OG1-O 3.47Å; T686-M692 HydrophobicContact CG2-CB 3.51Å; T686-M692 HydrophobicContact CG2-CG 4.46Å; T686-M692 HydrophobicContact CG2-SD 4.27Å
687	S	63.6	Low	80.2	Confident	100 Å²	100	71.8 Å²	71.8	70%	0.699	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-4.8	-175.5	55.5	0	0	0	0	116.2
688	N	73.2	Confident	80.9	Confident	104 Å²	104	70.7 Å²	70.7	56%	0.556	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	2.2	174.1	64.8	41.1	0	0	0	113.9	T686 K690	T686-N688 PolarHBondContact O-N 3.48Å; T686-N688 PolarHBondContact OG1-ND2 2.86Å; T686-N688 PolarHBondContact OG1-OD1 3.06Å; T686-N688 VanDerWaalsContact OG1-OD1 3.04Å; N688-K690 WeakPolarHBondContact OD1-CB 3.11Å; N688-K690 VanDerWaalsContact OD1-CG 3.32Å; N688-K690 WeakPolarHBondContact OD1-CG 2.92Å; N688-K690 PolarHBondContact OD1-N 3.33Å
689	G	70.2	Confident	81.1	Confident	13 Å²	13	71 Å²	71	13%	0.134	41%	0.408	C	S	.	.	S	Bend	trans	83.5	17.7	-179.7	0	0	0	0	0	115.3	C674 S675 T686	C674-G689 WeakPolarHBondContact CA-O 3.41Å; S675-G689 PolarHBondContact N-O 2.97Å; T686-G689 PolarHBondContact O-N 3.24Å
690	K	77.4	Confident	81.2	Confident	145 Å²	145	74.5 Å²	74.5	63%	0.63	42%	0.424	S	S	*	.			trans	-115.4	145.8	175	-58.9	179.4	179	-175.2	0	112.4	C674 T686 N688 M692	C674-K690 PolarHBondContact SG-O 3.37Å; C674-K690 VanDerWaalsContact SG-O 3.4Å; T686-K690 PolarHBondContact N-O 3.03Å; T686-K690 PolarHBondContact OG1-O 3.47Å; N688-K690 WeakPolarHBondContact OD1-CB 3.11Å; N688-K690 VanDerWaalsContact OD1-CG 3.32Å; N688-K690 WeakPolarHBondContact OD1-CG 2.92Å; N688-K690 PolarHBondContact OD1-N 3.33Å; K690-M692 PolarHBondContact O-N 2.03Å
691	C	82.1	Confident	81.5	Confident	19 Å²	19	66.1 Å²	66.1	13%	0.128	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.3	171.8	-54.7	0	0	0	0	110.5	C678 E684 C702	C678-C691 WeakPolarHBondContact CA-SG 3.28Å; C678-C691 HydrophobicContact CB-CB 3.95Å; C678-C691 WeakPolarHBondContact CB-SG 3.49Å; C678-C691 VanDerWaalsContact SG-CA 3.6Å; C678-C691 WeakPolarHBondContact SG-CB 3.43Å; C678-C691 CovalentContact SG-SG 2.03Å; C678-C691 PolarHBondContact SG-SG 2.9Å; E684-C691 WeakPolarHBondContact O-CA 3.43Å; C691-C702 VanDerWaalsContact CB-SG 3.59Å
692	M	87.1	Confident	82	Confident	99 Å²	99	63.2 Å²	63.2	49%	0.488	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	106.7	164.1	173.4	177.9	72.5	0	0	107	G683 E684 T686 K690	G683-M692 CarbonylContact C-O 3.57Å; G683-M692 WeakPolarHBondContact CA-O 3.41Å; E684-M692 HydrophobicContact CB-CE 4.18Å; E684-M692 PolarHBondContact N-O 2.82Å; E684-M692 PolarHBondContact O-N 2.74Å; T686-M692 HydrophobicContact CG2-CB 3.51Å; T686-M692 HydrophobicContact CG2-CG 4.46Å; T686-M692 HydrophobicContact CG2-SD 4.27Å; K690-M692 PolarHBondContact O-N 2.03Å
693	C	87.5	Confident	82.1	Confident	37 Å²	37	65.4 Å²	65.4	25%	0.25	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.7	-174.7	-54.5	0	0	0	0	112.1	F697 C702	C693-F697 HydrophobicContact CB-CB 4.13Å; C693-F697 WeakPolarHBondContact CB-O 3.19Å; C693-C702 WeakPolarHBondContact CA-SG 3.34Å; C693-C702 HydrophobicContact CB-CB 3.74Å; C693-C702 WeakPolarHBondContact CB-SG 3.41Å; C693-C702 WeakPolarHBondContact SG-CA 3.34Å; C693-C702 WeakPolarHBondContact SG-CB 3.41Å; C693-C702 CovalentContact SG-SG 2.04Å; C693-C702 PolarHBondContact SG-SG 3.21Å
694	N	87.5	Confident	82.4	Confident	58 Å²	58	67.6 Å²	67.6	31%	0.31	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-64.3	150	170.4	-70.7	-20.6	0	0	0	109.1	G681 Q682 G696 F697	G681-N694 PolarHBondContact O-ND2 3.18Å; Q682-N694 PolarHBondContact O-N 2.9Å; N694-G696 PolarHBondContact O-N 3Å; N694-F697 HydrophobicContact CB-CD2 4.16Å; N694-F697 PolarHBondContact O-N 3.34Å
695	P	83.3	Confident	82.6	Confident	124 Å²	124	63.6 Å²	63.6	81%	0.805	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	135.4	172.9	-26.4	35.4	0	0	0	111.1
696	G	83.8	Confident	83.1	Confident	10 Å²	10	61.2 Å²	61.2	10%	0.103	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-10.3	-171	0	0	0	0	0	115	N694 V706	N694-G696 PolarHBondContact O-N 3Å; G696-V706 WeakPolarHBondContact O-CB 3.1Å; G696-V706 WeakPolarHBondContact O-CG2 3.48Å; G696-V706 PolarHBondContact O-N 3.38Å
697	F	91.7	Very high	83.6	Confident	34 Å²	34	61.8 Å²	61.8	15%	0.149	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.2	-179.2	-59.5	-76.8	0	0	0	113.8	Q682 C693 N694 C702	Q682-F697 HydrophobicContact CB-CB 4.48Å; Q682-F697 HydrophobicContact CB-CD1 4.14Å; Q682-F697 HydrophobicContact CB-CD2 4.09Å; Q682-F697 HydrophobicContact CB-CE1 4.45Å; Q682-F697 HydrophobicContact CB-CE2 4.38Å; Q682-F697 HydrophobicContact CB-CG 3.95Å; Q682-F697 HydrophobicContact CG-CD1 3.94Å; Q682-F697 HydrophobicContact CG-CD2 4.22Å; Q682-F697 HydrophobicContact CG-CE1 3.78Å; Q682-F697 HydrophobicContact CG-CE2 4.03Å; Q682-F697 HydrophobicContact CG-CG 4.17Å; Q682-F697 HydrophobicContact CG-CZ 3.81Å; C693-F697 HydrophobicContact CB-CB 4.13Å; C693-F697 WeakPolarHBondContact CB-O 3.19Å; N694-F697 HydrophobicContact CB-CD2 4.16Å; N694-F697 PolarHBondContact O-N 3.34Å; F697-C702 HydrophobicContact CB-CB 4.23Å
698	R	87.7	Confident	84.8	Confident	100 Å²	100	58.3 Å²	58.3	38%	0.377	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	176.4	177.7	59.8	174.7	166.7	-165.9	-10.8	110.9	C702 E703 T704 D705 V706 E711	R698-C702 CarbonylContact O-C 3.23Å; R698-C702 VanDerWaalsContact O-CA 3.28Å; R698-C702 WeakPolarHBondContact O-CA 3.04Å; R698-E703 PolarHBondContact O-N 2.88Å; R698-T704 HydrophobicContact CG-CG2 3.85Å; R698-T704 WeakPolarHBondContact CG-O 3.34Å; R698-T704 PolarHBondContact N-O 3.35Å; R698-T704 WeakPolarHBondContact O-CA 3.33Å; R698-T704 WeakPolarHBondContact O-CB 3.33Å; R698-T704 PolarHBondContact O-N 3.47Å; R698-D705 PolarHBondContact NE-O 2.79Å; R698-D705 PolarHBondContact NH2-O 3.19Å; R698-V706 HydrophobicContact CB-CG2 4.06Å; R698-V706 HydrophobicContact CG-CG2 3.78Å; R698-E711 IonicContact CZ-OE1 2.62Å; R698-E711 IonicContact NH1-OE1 3.91Å; R698-E711 PolarHBondContact NH1-OE1 3.31Å; R698-E711 IonicContact NH2-OE1 3.4Å
699	G	86.7	Confident	85.6	Confident	37 Å²	37	54.8 Å²	54.8	38%	0.381	30%	0.301	S	S	.	.	S	Bend	trans	111.3	-176	-173.8	0	0	0	0	0	111.8	E703	G699-E703 WeakPolarHBondContact CA-OE1 3.15Å
700	L	83.4	Confident	86.4	Confident	131 Å²	131	58 Å²	58	69%	0.686	33%	0.327	S	S	*	.	S	Bend	trans	-88.2	-23.8	-179.9	-70.1	174.1	0	0	0	113.1	P676 E703	P676-L700 HydrophobicContact CG-CB 3.56Å; L700-E703 PolarHBondContact N-OE1 2.81Å; L700-E703 VanDerWaalsContact N-OE1 3.12Å; L700-E703 PolarHBondContact N-OE2 3.4Å; L700-E703 VanDerWaalsContact N-OE2 3.15Å
701	S	84.8	Confident	86.8	Confident	18 Å²	18	54.6 Å²	54.6	13%	0.126	31%	0.313	C	S	.	.	S	Bend	trans	-116.7	8.7	175.2	28.4	0	0	0	0	111.7	E677 C678 V679 E703	E677-S701 WeakPolarHBondContact O-CB 3.45Å; C678-S701 CarbonylContact C-O 3.55Å; C678-S701 WeakPolarHBondContact CA-O 3.01Å; V679-S701 PolarHBondContact N-O 3.16Å; S701-E703 VanDerWaalsContact C-OE2 3.23Å; S701-E703 WeakPolarHBondContact CA-OE2 3.4Å; S701-E703 WeakPolarHBondContact CB-OE2 3.22Å; S701-E703 PolarHBondContact N-OE2 3.24Å; S701-E703 PolarHBondContact O-N 3.23Å; S701-E703 PolarHBondContact OG-OE2 2.96Å
702	C	87.4	Confident	86.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	66.3	21	-172.9	-47.3	0	0	0	0	114.5	Q682 C691 C693 F697 R698 T704	Q682-C702 HydrophobicContact CB-CB 4Å; Q682-C702 WeakPolarHBondContact O-CB 3.45Å; Q682-C702 PolarHBondContact OE1-O 3.41Å; C691-C702 VanDerWaalsContact CB-SG 3.59Å; C693-C702 WeakPolarHBondContact CA-SG 3.34Å; C693-C702 HydrophobicContact CB-CB 3.74Å; C693-C702 WeakPolarHBondContact CB-SG 3.41Å; C693-C702 WeakPolarHBondContact SG-CA 3.34Å; C693-C702 WeakPolarHBondContact SG-CB 3.41Å; C693-C702 CovalentContact SG-SG 2.04Å; C693-C702 PolarHBondContact SG-SG 3.21Å; F697-C702 HydrophobicContact CB-CB 4.23Å; R698-C702 CarbonylContact O-C 3.23Å; R698-C702 VanDerWaalsContact O-CA 3.28Å; R698-C702 WeakPolarHBondContact O-CA 3.04Å; C702-T704 VanDerWaalsContact C-N 3.26Å; C702-T704 PolarHBondContact O-N 3.31Å
703	E	87.5	Confident	86.6	Confident	91 Å²	91	57.9 Å²	57.9	43%	0.425	34%	0.339	S	S	.	.			trans	-69.7	-13	-176	70.9	-74.8	173.1	0	0	115.6	V679 R698 G699 L700 S701	V679-E703 HydrophobicContact CG2-CB 4.13Å; R698-E703 PolarHBondContact O-N 2.88Å; G699-E703 WeakPolarHBondContact CA-OE1 3.15Å; L700-E703 PolarHBondContact N-OE1 2.81Å; L700-E703 VanDerWaalsContact N-OE1 3.12Å; L700-E703 PolarHBondContact N-OE2 3.4Å; L700-E703 VanDerWaalsContact N-OE2 3.15Å; S701-E703 VanDerWaalsContact C-OE2 3.23Å; S701-E703 WeakPolarHBondContact CA-OE2 3.4Å; S701-E703 WeakPolarHBondContact CB-OE2 3.22Å; S701-E703 PolarHBondContact N-OE2 3.24Å; S701-E703 PolarHBondContact O-N 3.23Å; S701-E703 PolarHBondContact OG-OE2 2.96Å
704	T	87.5	Confident	86.4	Confident	61 Å²	61	57.9 Å²	57.9	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.6	-172.5	-60.4	0	0	0	0	110.5	R698 C702	R698-T704 HydrophobicContact CG-CG2 3.85Å; R698-T704 WeakPolarHBondContact CG-O 3.34Å; R698-T704 PolarHBondContact N-O 3.35Å; R698-T704 WeakPolarHBondContact O-CA 3.33Å; R698-T704 WeakPolarHBondContact O-CB 3.33Å; R698-T704 PolarHBondContact O-N 3.47Å; C702-T704 VanDerWaalsContact C-N 3.26Å; C702-T704 PolarHBondContact O-N 3.31Å
705	D	88	Confident	86.3	Confident	43 Å²	43	60.5 Å²	60.5	23%	0.23	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	145.8	174.2	-159.2	36.1	0	0	0	111.9	R698 D707 N722 P724 G725	R698-D705 PolarHBondContact NE-O 2.79Å; R698-D705 PolarHBondContact NH2-O 3.19Å; D705-D707 PolarHBondContact O-N 2.76Å; D705-N722 PolarHBondContact OD2-ND2 2.93Å; D705-P724 WeakPolarHBondContact OD1-CA 3.21Å; D705-G725 PolarHBondContact OD1-N 3.28Å
706	V	87.5	Confident	86.5	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.127	32%	0.315	C	S	.	.			trans	-93.8	93.7	171.7	-179.5	0	0	0	0	108.2	G696 R698 E708	G696-V706 WeakPolarHBondContact O-CB 3.1Å; G696-V706 WeakPolarHBondContact O-CG2 3.48Å; G696-V706 PolarHBondContact O-N 3.38Å; R698-V706 HydrophobicContact CB-CG2 4.06Å; R698-V706 HydrophobicContact CG-CG2 3.78Å; V706-E708 VanDerWaalsContact C-N 3.31Å; V706-E708 HydrophobicContact CG1-CG 4.24Å; V706-E708 PolarHBondContact O-N 2.72Å
707	D	87.4	Confident	86.7	Confident	53 Å²	53	59.5 Å²	59.5	28%	0.283	33%	0.332	S	S	.	.			trans	-67.9	88.1	175.9	-170.6	-22.6	0	0	0	110.9	D705 C709 A710 E711	D705-D707 PolarHBondContact O-N 2.76Å; D707-C709 PolarHBondContact O-N 3.22Å; D707-C709 WeakPolarHBondContact OD1-CA 3.17Å; D707-C709 VanDerWaalsContact OD1-CB 3.26Å; D707-C709 WeakPolarHBondContact OD1-CB 3.38Å; D707-C709 PolarHBondContact OD1-N 3.33Å; D707-C709 VanDerWaalsContact OD1-N 3.1Å; D707-A710 HydrophobicContact CB-CB 3.99Å; D707-A710 VanDerWaalsContact CG-CB 3.46Å; D707-A710 PolarHBondContact O-N 3.46Å; D707-A710 PolarHBondContact OD1-N 3.09Å; D707-E711 PolarHBondContact O-N 3.48Å
708	E	89.2	Confident	86.6	Confident	27 Å²	27	60 Å²	60	13%	0.126	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.7	178.9	-73.5	106.4	-173.8	0	0	112.8	V706 G712 K713 H714 F727	V706-E708 VanDerWaalsContact C-N 3.31Å; V706-E708 HydrophobicContact CG1-CG 4.24Å; V706-E708 PolarHBondContact O-N 2.72Å; E708-G712 PolarHBondContact O-N 2.88Å; E708-G712 VanDerWaalsContact O-N 3.16Å; E708-K713 HydrophobicContact CB-CB 4.22Å; E708-K713 HydrophobicContact CG-CB 4.21Å; E708-K713 PolarHBondContact O-N 3.15Å; E708-H714 HydrophobicContact CB-CB 4.24Å; E708-H714 WeakPolarHBondContact O-CB 3.12Å; E708-H714 PolarHBondContact O-CD2 2.88Å; E708-H714 PolarHBondContact O-N 2.88Å; E708-F727 HydrophobicContact CB-CB 4.35Å; E708-F727 HydrophobicContact CB-CD1 3.62Å; E708-F727 HydrophobicContact CB-CE1 4.33Å; E708-F727 HydrophobicContact CB-CG 4.24Å; E708-F727 HydrophobicContact CG-CD1 3.99Å; E708-F727 HydrophobicContact CG-CE1 4.47Å; E708-F727 WeakPolarHBondContact OE2-CD1 3.33Å
709	C	89.3	Confident	86.6	Confident	29 Å²	29	59.6 Å²	59.6	20%	0.196	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-51.3	172.6	-53.6	0	0	0	0	110.3	D707 E711 G712 C720 I721 N722	D707-C709 PolarHBondContact O-N 3.22Å; D707-C709 WeakPolarHBondContact OD1-CA 3.17Å; D707-C709 VanDerWaalsContact OD1-CB 3.26Å; D707-C709 WeakPolarHBondContact OD1-CB 3.38Å; D707-C709 PolarHBondContact OD1-N 3.33Å; D707-C709 VanDerWaalsContact OD1-N 3.1Å; C709-E711 VanDerWaalsContact C-N 3.32Å; C709-E711 PolarHBondContact O-N 3.19Å; C709-G712 PolarHBondContact O-N 2.65Å; C709-C720 WeakPolarHBondContact CA-SG 3.14Å; C709-C720 HydrophobicContact CB-CB 3.68Å; C709-C720 WeakPolarHBondContact CB-SG 3.4Å; C709-C720 WeakPolarHBondContact SG-CB 3.34Å; C709-C720 CovalentContact SG-SG 2.03Å; C709-C720 PolarHBondContact SG-SG 2.82Å; C709-I721 VanDerWaalsContact SG-C 3.55Å; C709-I721 PolarHBondContact SG-N 3.07Å; C709-N722 PolarHBondContact SG-N 3.26Å
710	A	87.5	Confident	86.9	Confident	81 Å²	81	59.1 Å²	59.1	67%	0.669	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-31	177.1	0	0	0	0	0	113	D707	D707-A710 HydrophobicContact CB-CB 3.99Å; D707-A710 VanDerWaalsContact CG-CB 3.46Å; D707-A710 PolarHBondContact O-N 3.46Å; D707-A710 PolarHBondContact OD1-N 3.09Å
711	E	86.5	Confident	87.2	Confident	73 Å²	73	56 Å²	56	34%	0.341	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.8	176	-67.6	-169.1	-172.9	0	0	114.3	R698 D707 C709 K713	R698-E711 IonicContact CZ-OE1 2.62Å; R698-E711 IonicContact NH1-OE1 3.91Å; R698-E711 PolarHBondContact NH1-OE1 3.31Å; R698-E711 IonicContact NH2-OE1 3.4Å; D707-E711 PolarHBondContact O-N 3.48Å; C709-E711 VanDerWaalsContact C-N 3.32Å; C709-E711 PolarHBondContact O-N 3.19Å; E711-K713 HydrophobicContact CB-CD 4.08Å; E711-K713 HydrophobicContact CB-CG 4.23Å; E711-K713 PolarHBondContact O-N 2.92Å; E711-K713 VanDerWaalsContact OE2-CE 3.29Å; E711-K713 WeakPolarHBondContact OE2-CE 3.21Å; E711-K713 IonicContact OE2-NZ 2.91Å; E711-K713 PolarHBondContact OE2-NZ 3.4Å
712	G	82.4	Confident	87.2	Confident	57 Å²	57	57.3 Å²	57.3	59%	0.588	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	18.3	178.3	0	0	0	0	0	114.7	E708 C709	E708-G712 PolarHBondContact O-N 2.88Å; E708-G712 VanDerWaalsContact O-N 3.16Å; C709-G712 PolarHBondContact O-N 2.65Å
713	K	83.2	Confident	87.1	Confident	131 Å²	131	59.4 Å²	59.4	57%	0.57	33%	0.33	S	S	*	.			trans	-89.7	-16.3	-177.9	-69.7	172.4	178.7	170.3	0	113.2	E708 E711 N715	E708-K713 HydrophobicContact CB-CB 4.22Å; E708-K713 HydrophobicContact CG-CB 4.21Å; E708-K713 PolarHBondContact O-N 3.15Å; E711-K713 HydrophobicContact CB-CD 4.08Å; E711-K713 HydrophobicContact CB-CG 4.23Å; E711-K713 PolarHBondContact O-N 2.92Å; E711-K713 VanDerWaalsContact OE2-CE 3.29Å; E711-K713 WeakPolarHBondContact OE2-CE 3.21Å; E711-K713 IonicContact OE2-NZ 2.91Å; E711-K713 PolarHBondContact OE2-NZ 3.4Å; K713-N715 PolarHBondContact O-N 3.14Å
714	H	81.8	Confident	86.9	Confident	37 Å²	37	60.5 Å²	60.5	17%	0.171	35%	0.345	C	S	.	.	S	Bend	trans	-65.1	-3.3	-168.8	66.3	87.1	0	0	0	117.7	E708 C716 C720 F727	E708-H714 HydrophobicContact CB-CB 4.24Å; E708-H714 WeakPolarHBondContact O-CB 3.12Å; E708-H714 PolarHBondContact O-CD2 2.88Å; E708-H714 PolarHBondContact O-N 2.88Å; H714-C716 VanDerWaalsContact ND1-CB 3.31Å; H714-C716 WeakPolarHBondContact ND1-CB 2.99Å; H714-C716 PolarHBondContact ND1-N 3.41Å; H714-C716 PolarHBondContact ND1-SG 3.01Å; H714-C716 VanDerWaalsContact ND1-SG 3.38Å; H714-C716 PolarHBondContact O-N 2.95Å; H714-C716 PolarHBondContact O-SG 3.26Å; H714-C720 HydrophobicContact CB-CB 4.24Å; H714-C720 WeakPolarHBondContact CB-SG 3.5Å; H714-F727 HydrophobicContact CB-CB 4.45Å; H714-F727 HydrophobicContact CB-CD1 4.22Å; H714-F727 HydrophobicContact CB-CD2 3.78Å; H714-F727 HydrophobicContact CB-CE1 4.48Å; H714-F727 HydrophobicContact CB-CE2 4.1Å; H714-F727 HydrophobicContact CB-CG 3.86Å; H714-F727 HydrophobicContact CB-CZ 4.42Å; H714-F727 WeakPolarHBondContact O-CE2 3.17Å; H714-F727 VanDerWaalsContact O-CZ 3.25Å; H714-F727 WeakPolarHBondContact O-CZ 3.45Å
715	N	85.7	Confident	86.6	Confident	112 Å²	112	58.4 Å²	58.4	60%	0.599	34%	0.335	S	S	*	.			trans	50	-5	179.1	81.2	20	0	0	0	120.1	K713 S743	K713-N715 PolarHBondContact O-N 3.14Å; N715-S743 WeakPolarHBondContact OD1-CB 3.24Å
716	C	87.4	Confident	86.6	Confident	14 Å²	14	59.2 Å²	59.2	10%	0.095	34%	0.344	C	S	.	.			trans	-57.7	136.6	179.8	-50	0	0	0	0	112.9	H714 Q718 E719 C729 S743	H714-C716 VanDerWaalsContact ND1-CB 3.31Å; H714-C716 WeakPolarHBondContact ND1-CB 2.99Å; H714-C716 PolarHBondContact ND1-N 3.41Å; H714-C716 PolarHBondContact ND1-SG 3.01Å; H714-C716 VanDerWaalsContact ND1-SG 3.38Å; H714-C716 PolarHBondContact O-N 2.95Å; H714-C716 PolarHBondContact O-SG 3.26Å; C716-Q718 VanDerWaalsContact C-N 3.26Å; C716-Q718 PolarHBondContact O-N 2.81Å; C716-E719 WeakPolarHBondContact CB-O 3.37Å; C716-C729 WeakPolarHBondContact CA-SG 3.11Å; C716-C729 HydrophobicContact CB-CB 3.65Å; C716-C729 WeakPolarHBondContact CB-SG 3.33Å; C716-C729 WeakPolarHBondContact SG-CA 3.42Å; C716-C729 WeakPolarHBondContact SG-CB 3.44Å; C716-C729 CovalentContact SG-SG 2.03Å; C716-C729 PolarHBondContact SG-SG 3.09Å; C716-S743 CarbonylContact C-O 3.58Å; C716-S743 WeakPolarHBondContact CA-O 3.34Å
717	Q	88	Confident	86.7	Confident	100 Å²	100	60.9 Å²	60.9	47%	0.467	35%	0.35	S	S	.	.	S	Bend	trans	-67.8	-21.5	177.9	-172.8	-172.8	-43.4	0	0	113.6	S743 C745	Q717-S743 WeakPolarHBondContact CB-O 3.5Å; Q717-S743 PolarHBondContact N-O 3.48Å; Q717-C745 HydrophobicContact CB-CB 4.5Å; Q717-C745 PolarHBondContact NE2-O 3.1Å; Q717-C745 PolarHBondContact OE1-O 2.97Å
718	Q	89.1	Confident	86.8	Confident	45 Å²	45	63.8 Å²	63.8	21%	0.21	36%	0.36	C	S	.	.	S	Bend	trans	-138.7	-87.7	-171.8	-70.3	-166.1	9.3	0	0	113.3	C716 H732 C745	C716-Q718 VanDerWaalsContact C-N 3.26Å; C716-Q718 PolarHBondContact O-N 2.81Å; Q718-H732 PolarHBondContact OE1-ND1 3.3Å; Q718-H732 VanDerWaalsContact OE1-ND1 3.08Å; Q718-C745 HydrophobicContact CG-CB 3.85Å
719	E	88.7	Confident	86.8	Confident	91 Å²	91	63.3 Å²	63.3	43%	0.425	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	149.4	-177.3	-173.8	-175.4	-137.5	0	0	110	C716 C729 S730	C716-E719 WeakPolarHBondContact CB-O 3.37Å; E719-C729 WeakPolarHBondContact O-CA 3.43Å; E719-S730 WeakPolarHBondContact CB-OG 3.38Å; E719-S730 VanDerWaalsContact CD-OG 3.25Å; E719-S730 VanDerWaalsContact CG-OG 3.29Å; E719-S730 WeakPolarHBondContact CG-OG 3.42Å; E719-S730 PolarHBondContact N-O 3.49Å; E719-S730 PolarHBondContact O-N 3.5Å; E719-S730 VanDerWaalsContact OE2-CB 3.28Å; E719-S730 WeakPolarHBondContact OE2-CB 3.04Å; E719-S730 PolarHBondContact OE2-OG 2.84Å
720	C	92	Very high	86.7	Confident	27 Å²	27	62.9 Å²	62.9	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.9	177.5	-176.7	0	0	0	0	109.2	C709 H714	C709-C720 WeakPolarHBondContact CA-SG 3.14Å; C709-C720 HydrophobicContact CB-CB 3.68Å; C709-C720 WeakPolarHBondContact CB-SG 3.4Å; C709-C720 WeakPolarHBondContact SG-CB 3.34Å; C709-C720 CovalentContact SG-SG 2.03Å; C709-C720 PolarHBondContact SG-SG 2.82Å; H714-C720 HydrophobicContact CB-CB 4.24Å; H714-C720 WeakPolarHBondContact CB-SG 3.5Å
721	I	89.9	Confident	86.7	Confident	65 Å²	65	60.3 Å²	60.3	33%	0.333	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.7	176.2	-56.6	167.3	0	0	0	107.4	C709 K728 S730	C709-I721 VanDerWaalsContact SG-C 3.55Å; C709-I721 PolarHBondContact SG-N 3.07Å; I721-K728 HydrophobicContact CB-CD 4.45Å; I721-K728 HydrophobicContact CB-CG 3.87Å; I721-K728 VanDerWaalsContact CG2-CE 3.43Å; I721-K728 HydrophobicContact CG2-CG 4.44Å; I721-K728 PolarHBondContact N-O 3.42Å; I721-K728 PolarHBondContact O-N 3.16Å; I721-S730 VanDerWaalsContact CD1-OG 3.32Å; I721-S730 WeakPolarHBondContact CD1-OG 3.44Å
722	N	86	Confident	86.5	Confident	46 Å²	46	62.2 Å²	62.2	25%	0.246	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	149.7	179.5	-172.4	42.1	0	0	0	111.4	D705 C709 S726	D705-N722 PolarHBondContact OD2-ND2 2.93Å; C709-N722 PolarHBondContact SG-N 3.26Å; N722-S726 PolarHBondContact OD1-O 2.85Å
723	T	85.1	Confident	86	Confident	44 Å²	44	65.4 Å²	65.4	27%	0.27	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.2	-179.4	55.2	0	0	0	0	110.9	G725 S726 K728	T723-G725 PolarHBondContact O-N 2.88Å; T723-S726 CarbonylContact C-O 3.54Å; T723-S726 WeakPolarHBondContact CA-O 3.36Å; T723-S726 PolarHBondContact N-O 3.42Å; T723-S726 CarbonylContact O-C 3.46Å; T723-S726 PolarHBondContact O-N 3.5Å; T723-S726 PolarHBondContact OG1-O 2.88Å; T723-K728 HydrophobicContact CG2-CD 4.4Å; T723-K728 HydrophobicContact CG2-CG 4.39Å
724	P	82.7	Confident	85.2	Confident	113 Å²	113	61 Å²	61	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	106.3	-176.1	-28.5	36.9	0	0	0	113.8	D705	D705-P724 WeakPolarHBondContact OD1-CA 3.21Å
725	G	82.3	Confident	85.2	Confident	17 Å²	17	64.1 Å²	64.1	18%	0.175	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	9.4	-176.9	0	0	0	0	0	116.6	D705 T723	D705-G725 PolarHBondContact OD1-N 3.28Å; T723-G725 PolarHBondContact O-N 2.88Å
726	S	87.3	Confident	84.9	Confident	60 Å²	60	63.6 Å²	63.6	42%	0.42	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-179	178.4	-144	0	0	0	0	113.8	N722 T723	N722-S726 PolarHBondContact OD1-O 2.85Å; T723-S726 CarbonylContact C-O 3.54Å; T723-S726 WeakPolarHBondContact CA-O 3.36Å; T723-S726 PolarHBondContact N-O 3.42Å; T723-S726 CarbonylContact O-C 3.46Å; T723-S726 PolarHBondContact O-N 3.5Å; T723-S726 PolarHBondContact OG1-O 2.88Å
727	F	89.8	Confident	84.5	Confident	56 Å²	56	66.5 Å²	66.5	25%	0.246	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	158.7	167.1	64.6	-86.5	0	0	0	111.2	E708 H714	E708-F727 HydrophobicContact CB-CB 4.35Å; E708-F727 HydrophobicContact CB-CD1 3.62Å; E708-F727 HydrophobicContact CB-CE1 4.33Å; E708-F727 HydrophobicContact CB-CG 4.24Å; E708-F727 HydrophobicContact CG-CD1 3.99Å; E708-F727 HydrophobicContact CG-CE1 4.47Å; E708-F727 WeakPolarHBondContact OE2-CD1 3.33Å; H714-F727 HydrophobicContact CB-CB 4.45Å; H714-F727 HydrophobicContact CB-CD1 4.22Å; H714-F727 HydrophobicContact CB-CD2 3.78Å; H714-F727 HydrophobicContact CB-CE1 4.48Å; H714-F727 HydrophobicContact CB-CE2 4.1Å; H714-F727 HydrophobicContact CB-CG 3.86Å; H714-F727 HydrophobicContact CB-CZ 4.42Å; H714-F727 WeakPolarHBondContact O-CE2 3.17Å; H714-F727 VanDerWaalsContact O-CZ 3.25Å; H714-F727 WeakPolarHBondContact O-CZ 3.45Å
728	K	89.5	Confident	84.2	Confident	114 Å²	114	62.5 Å²	62.5	50%	0.496	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	143	164.1	66.2	-178.6	178.3	175.2	0	110.1	I721 T723	I721-K728 HydrophobicContact CB-CD 4.45Å; I721-K728 HydrophobicContact CB-CG 3.87Å; I721-K728 VanDerWaalsContact CG2-CE 3.43Å; I721-K728 HydrophobicContact CG2-CG 4.44Å; I721-K728 PolarHBondContact N-O 3.42Å; I721-K728 PolarHBondContact O-N 3.16Å; T723-K728 HydrophobicContact CG2-CD 4.4Å; T723-K728 HydrophobicContact CG2-CG 4.39Å
729	C	89.7	Confident	83.6	Confident	17 Å²	17	66.6 Å²	66.6	12%	0.115	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	154.3	173.3	-56.7	0	0	0	0	111.4	C716 E719 L737 P742	C716-C729 WeakPolarHBondContact CA-SG 3.11Å; C716-C729 HydrophobicContact CB-CB 3.65Å; C716-C729 WeakPolarHBondContact CB-SG 3.33Å; C716-C729 WeakPolarHBondContact SG-CA 3.42Å; C716-C729 WeakPolarHBondContact SG-CB 3.44Å; C716-C729 CovalentContact SG-SG 2.03Å; C716-C729 PolarHBondContact SG-SG 3.09Å; E719-C729 WeakPolarHBondContact O-CA 3.43Å; C729-L737 HydrophobicContact CB-CD2 3.89Å; C729-L737 WeakPolarHBondContact O-CD1 2.93Å; C729-P742 WeakPolarHBondContact CB-O 3.38Å
730	S	87	Confident	83	Confident	20 Å²	20	68.4 Å²	68.4	14%	0.14	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	171	169.4	42.9	0	0	0	0	110.1	E719 I721	E719-S730 WeakPolarHBondContact CB-OG 3.38Å; E719-S730 VanDerWaalsContact CD-OG 3.25Å; E719-S730 VanDerWaalsContact CG-OG 3.29Å; E719-S730 WeakPolarHBondContact CG-OG 3.42Å; E719-S730 PolarHBondContact N-O 3.49Å; E719-S730 PolarHBondContact O-N 3.5Å; E719-S730 VanDerWaalsContact OE2-CB 3.28Å; E719-S730 WeakPolarHBondContact OE2-CB 3.04Å; E719-S730 PolarHBondContact OE2-OG 2.84Å; I721-S730 VanDerWaalsContact CD1-OG 3.32Å; I721-S730 WeakPolarHBondContact CD1-OG 3.44Å
731	C	86.5	Confident	82.4	Confident	27 Å²	27	69.5 Å²	69.5	18%	0.182	40%	0.398	C	S	.	.			trans	-129.8	143.3	-174.7	-53	0	0	0	0	110.3	C745	C731-C745 HydrophobicContact CB-CB 3.89Å; C731-C745 WeakPolarHBondContact CB-SG 3.48Å; C731-C745 VanDerWaalsContact SG-CA 3.6Å; C731-C745 WeakPolarHBondContact SG-CB 3.47Å; C731-C745 CovalentContact SG-SG 2.04Å; C731-C745 PolarHBondContact SG-SG 2.86Å
732	H	83.6	Confident	82	Confident	114 Å²	114	70.9 Å²	70.9	53%	0.528	41%	0.411	S	S	.	.			trans	-64.7	161.5	173.9	-57.7	83.2	0	0	0	111	Q718 G734 Y735	Q718-H732 PolarHBondContact OE1-ND1 3.3Å; Q718-H732 VanDerWaalsContact OE1-ND1 3.08Å; H732-G734 PolarHBondContact O-N 2.99Å; H732-Y735 PolarHBondContact O-N 3.19Å
733	S	71.6	Confident	81.7	Confident	123 Å²	123	69.4 Å²	69.4	86%	0.86	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	130.9	172	-53.3	0	0	0	0	111.8
734	G	65.4	Low	81.7	Confident	40 Å²	40	72.3 Å²	72.3	41%	0.412	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	4.5	-173.5	0	0	0	0	0	115.4	H732 I748	H732-G734 PolarHBondContact O-N 2.99Å; G734-I748 WeakPolarHBondContact O-CB 3.32Å; G734-I748 PolarHBondContact O-N 3.05Å
735	Y	81.6	Confident	81.8	Confident	101 Å²	101	67.1 Å²	67.1	40%	0.396	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.8	176.8	-66.3	-98.3	0	0	0	112.9	H732 C745 E746 P747	H732-Y735 PolarHBondContact O-N 3.19Å; Y735-C745 HydrophobicContact CD1-CB 4.31Å; Y735-E746 CarbonylContact C-O 3.58Å; Y735-E746 VanDerWaalsContact CA-O 3.31Å; Y735-E746 WeakPolarHBondContact CA-O 3.46Å; Y735-P747 VanDerWaalsContact CD1-CA 3.45Å; Y735-P747 HydrophobicContact CD1-CB 4.01Å; Y735-P747 HydrophobicContact CE1-CB 3.71Å; Y735-P747 HydrophobicContact CE1-CG 4.5Å
736	K	78.9	Confident	81.6	Confident	101 Å²	101	69.2 Å²	69.2	44%	0.439	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	155.3	175	59.7	163.1	-176.5	141.8	0	111.1	C745 E746	K736-C745 CarbonylContact O-C 3.02Å; K736-C745 VanDerWaalsContact O-CA 3.26Å; K736-C745 WeakPolarHBondContact O-CA 3.43Å; K736-E746 WeakPolarHBondContact CE-OE2 3.25Å; K736-E746 HydrophobicContact CG-CB 4.12Å; K736-E746 PolarHBondContact N-O 3.39Å; K736-E746 IonicContact NZ-OE2 3.4Å; K736-E746 PolarHBondContact NZ-OE2 3.23Å; K736-E746 PolarHBondContact O-N 3.22Å
737	L	80.6	Confident	80.6	Confident	76 Å²	76	70.2 Å²	70.2	40%	0.398	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	143.5	173.9	-66.7	167.5	0	0	0	111.5	C729 K744	C729-L737 HydrophobicContact CB-CD2 3.89Å; C729-L737 WeakPolarHBondContact O-CD1 2.93Å; L737-K744 CarbonylContact C-O 3.34Å; L737-K744 WeakPolarHBondContact CA-O 2.96Å
738	S	80.3	Confident	79.2	Confident	16 Å²	16	69.7 Å²	69.7	11%	0.112	39%	0.389	C	S	.	.			trans	-76.1	142.3	176.8	-173	0	0	0	0	112.1	V740 D741 K744 E746	S738-V740 VanDerWaalsContact C-N 3.3Å; S738-V740 PolarHBondContact OG-N 3.01Å; S738-D741 WeakPolarHBondContact CB-O 3.42Å; S738-K744 PolarHBondContact N-O 3Å; S738-E746 VanDerWaalsContact CA-OE1 3.27Å; S738-E746 WeakPolarHBondContact CA-OE1 3.46Å; S738-E746 WeakPolarHBondContact CB-OE1 3.42Å; S738-E746 PolarHBondContact OG-OE1 2.87Å
739	T	76.4	Confident	77.4	Confident	130 Å²	130	68.5 Å²	68.5	80%	0.798	40%	0.395	S	S	*	.	S	Bend	trans	-78.9	-13.2	177.6	54.7	0	0	0	0	113.6
740	V	76.7	Confident	75.5	Confident	130 Å²	130	69.5 Å²	69.5	79%	0.788	40%	0.402	S	S	*	.	S	Bend	trans	-99	-31.3	179.1	-176.7	0	0	0	0	111.4	S738	S738-V740 VanDerWaalsContact C-N 3.3Å; S738-V740 PolarHBondContact OG-N 3.01Å
741	D	80.5	Confident	73.9	Confident	49 Å²	49	71.9 Å²	71.9	26%	0.262	42%	0.417	S	S	.	.			trans	-145.8	97	-174.3	-175.7	-13.3	0	0	0	110	S738 S743 K744	S738-D741 WeakPolarHBondContact CB-O 3.42Å; D741-S743 VanDerWaalsContact CG-OG 3.24Å; D741-S743 PolarHBondContact O-N 3.34Å; D741-S743 WeakPolarHBondContact OD1-CB 3.03Å; D741-S743 PolarHBondContact OD1-N 3.39Å; D741-S743 VanDerWaalsContact OD1-N 3.1Å; D741-S743 PolarHBondContact OD1-OG 2.9Å; D741-S743 PolarHBondContact OD2-OG 2.91Å; D741-K744 HydrophobicContact CB-CD 4.48Å; D741-K744 HydrophobicContact CB-CG 4.37Å; D741-K744 PolarHBondContact O-N 2.93Å; D741-K744 IonicContact OD2-NZ 2.65Å; D741-K744 PolarHBondContact OD2-NZ 3.35Å
742	P	80	Confident	72.1	Confident	95 Å²	95	72.1 Å²	72.1	62%	0.617	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-7	-178.3	-26.5	36.3	0	0	0	115.6	C729 K744	C729-P742 WeakPolarHBondContact CB-O 3.38Å; P742-K744 VanDerWaalsContact C-N 3.33Å
743	S	81	Confident	70.8	Confident	15 Å²	15	73.9 Å²	73.9	11%	0.105	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-17.7	170	72.4	0	0	0	0	113.5	N715 C716 Q717 D741	N715-S743 WeakPolarHBondContact OD1-CB 3.24Å; C716-S743 CarbonylContact C-O 3.58Å; C716-S743 WeakPolarHBondContact CA-O 3.34Å; Q717-S743 WeakPolarHBondContact CB-O 3.5Å; Q717-S743 PolarHBondContact N-O 3.48Å; D741-S743 VanDerWaalsContact CG-OG 3.24Å; D741-S743 PolarHBondContact O-N 3.34Å; D741-S743 WeakPolarHBondContact OD1-CB 3.03Å; D741-S743 PolarHBondContact OD1-N 3.39Å; D741-S743 VanDerWaalsContact OD1-N 3.1Å; D741-S743 PolarHBondContact OD1-OG 2.9Å; D741-S743 PolarHBondContact OD2-OG 2.91Å
744	K	85.1	Confident	70.3	Confident	104 Å²	104	70.4 Å²	70.4	45%	0.452	40%	0.402	S	S	.	.			trans	-104.7	150.2	-169	-67.7	-167.2	175	92.7	0	114	L737 S738 D741 P742	L737-K744 CarbonylContact C-O 3.34Å; L737-K744 WeakPolarHBondContact CA-O 2.96Å; S738-K744 PolarHBondContact N-O 3Å; D741-K744 HydrophobicContact CB-CD 4.48Å; D741-K744 HydrophobicContact CB-CG 4.37Å; D741-K744 PolarHBondContact O-N 2.93Å; D741-K744 IonicContact OD2-NZ 2.65Å; D741-K744 PolarHBondContact OD2-NZ 3.35Å; P742-K744 VanDerWaalsContact C-N 3.33Å
745	C	83.8	Confident	70	Confident	4 Å²	4	72.1 Å²	72.1	3%	0.027	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	109.3	179.5	-70.5	0	0	0	0	110.4	Q717 Q718 C731 Y735 K736	Q717-C745 HydrophobicContact CB-CB 4.5Å; Q717-C745 PolarHBondContact NE2-O 3.1Å; Q717-C745 PolarHBondContact OE1-O 2.97Å; Q718-C745 HydrophobicContact CG-CB 3.85Å; C731-C745 HydrophobicContact CB-CB 3.89Å; C731-C745 WeakPolarHBondContact CB-SG 3.48Å; C731-C745 VanDerWaalsContact SG-CA 3.6Å; C731-C745 WeakPolarHBondContact SG-CB 3.47Å; C731-C745 CovalentContact SG-SG 2.04Å; C731-C745 PolarHBondContact SG-SG 2.86Å; Y735-C745 HydrophobicContact CD1-CB 4.31Å; K736-C745 CarbonylContact O-C 3.02Å; K736-C745 VanDerWaalsContact O-CA 3.26Å; K736-C745 WeakPolarHBondContact O-CA 3.43Å
746	E	78.4	Confident	68.7	Low	61 Å²	61	73.6 Å²	73.6	29%	0.285	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	133.4	174.3	-66.3	172.5	-162.8	0	0	109.7	Y735 K736 S738	Y735-E746 CarbonylContact C-O 3.58Å; Y735-E746 VanDerWaalsContact CA-O 3.31Å; Y735-E746 WeakPolarHBondContact CA-O 3.46Å; K736-E746 WeakPolarHBondContact CE-OE2 3.25Å; K736-E746 HydrophobicContact CG-CB 4.12Å; K736-E746 PolarHBondContact N-O 3.39Å; K736-E746 IonicContact NZ-OE2 3.4Å; K736-E746 PolarHBondContact NZ-OE2 3.23Å; K736-E746 PolarHBondContact O-N 3.22Å; S738-E746 VanDerWaalsContact CA-OE1 3.27Å; S738-E746 WeakPolarHBondContact CA-OE1 3.46Å; S738-E746 WeakPolarHBondContact CB-OE1 3.42Å; S738-E746 PolarHBondContact OG-OE1 2.87Å
747	P	66.1	Low	67.6	Low	82 Å²	82	74 Å²	74	53%	0.532	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	141.6	175.4	26.6	-33.6	0	0	0	111	Y735 S749	Y735-P747 VanDerWaalsContact CD1-CA 3.45Å; Y735-P747 HydrophobicContact CD1-CB 4.01Å; Y735-P747 HydrophobicContact CE1-CB 3.71Å; Y735-P747 HydrophobicContact CE1-CG 4.5Å; P747-S749 PolarHBondContact O-N 3.43Å
748	I	59.9	Low	66.4	Low	45 Å²	45	78.9 Å²	78.9	23%	0.231	45%	0.449	C	S	.	.			trans	-74.4	98	173.2	-67	170	0	0	0	108.2	G734 C750 N773	G734-I748 WeakPolarHBondContact O-CB 3.32Å; G734-I748 PolarHBondContact O-N 3.05Å; I748-C750 PolarHBondContact O-N 2.03Å; I748-N773 HydrophobicContact CG2-CB 3.58Å; I748-N773 VanDerWaalsContact CG2-OD1 3.31Å; I748-N773 WeakPolarHBondContact CG2-OD1 3.44Å
749	S	52.2	Low	65.3	Low	89 Å²	89	81.4 Å²	81.4	62%	0.622	48%	0.477	S	S	*	.			trans	-80.8	91.9	-175.6	57.5	0	0	0	0	112.3	P747	P747-S749 PolarHBondContact O-N 3.43Å
750	C	49.8	Very low	64.2	Low	38 Å²	38	81.4 Å²	81.4	26%	0.257	47%	0.468	S	S	.	.			trans	-62.9	135.4	169.3	-76	0	0	0	0	111.4	I748 S752 C763	I748-C750 PolarHBondContact O-N 2.03Å; C750-S752 PolarHBondContact O-N 2.86Å; C750-C763 HydrophobicContact CB-CB 3.79Å; C750-C763 WeakPolarHBondContact CB-SG 3.26Å; C750-C763 WeakPolarHBondContact SG-CB 3.36Å; C750-C763 CovalentContact SG-SG 2.04Å; C750-C763 PolarHBondContact SG-SG 3.38Å
751	P	53.1	Low	63.2	Low	70 Å²	70	77.8 Å²	77.8	46%	0.455	45%	0.448	S	S	.	.	S	Bend	trans	-71.5	-20.6	-173.8	-21.6	34.3	0	0	0	116.1	C774	P751-C774 HydrophobicContact CG-CB 4.05Å
752	S	49.1	Very low	62.3	Low	31 Å²	31	79.5 Å²	79.5	22%	0.217	46%	0.457	C	S	.	.	S	Bend	trans	-164.7	109	-177.8	36	0	0	0	0	111.4	C750 E764	C750-S752 PolarHBondContact O-N 2.86Å; S752-E764 PolarHBondContact OG-O 2.88Å
753	Q	56.7	Low	61.4	Low	151 Å²	151	75.4 Å²	75.4	71%	0.706	43%	0.43	S	S	*	.			trans	54.5	124.1	172.4	-65.2	179.1	-75	0	0	116.9	C763 E764	Q753-C763 WeakPolarHBondContact O-CA 3.41Å; Q753-E764 PolarHBondContact O-N 3.13Å
754	C	60.1	Low	60.2	Low	50 Å²	50	80.5 Å²	80.5	34%	0.338	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.3	163	150.3	0	0	0	0	109.2	C761 D762	C754-C761 HydrophobicContact CB-CB 3.91Å; C754-C761 WeakPolarHBondContact CB-SG 3.44Å; C754-C761 WeakPolarHBondContact SG-CA 3.36Å; C754-C761 WeakPolarHBondContact SG-CB 3.48Å; C754-C761 CovalentContact SG-SG 2.04Å; C754-C761 PolarHBondContact SG-SG 3.39Å; C754-D762 CarbonylContact C-O 3.21Å; C754-D762 WeakPolarHBondContact CA-O 3.38Å
755	N	60.7	Low	59	Low	77 Å²	77	78 Å²	78	41%	0.412	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.7	162.9	-65.7	-49.7	0	0	0	108.5	D762	N755-D762 PolarHBondContact N-O 3.03Å; N755-D762 PolarHBondContact O-N 2.77Å
756	L	54	Low	57.6	Low	132 Å²	132	84.4 Å²	84.4	69%	0.691	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.6	179.7	-81.2	161.3	0	0	0	110.9	E760	L756-E760 WeakPolarHBondContact CA-O 3.5Å
757	I	55.2	Low	56.2	Low	108 Å²	108	90.4 Å²	90.4	55%	0.554	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.2	175	-54.8	179.1	0	0	0	107.7	G759 E760	I757-G759 PolarHBondContact O-N 3.48Å; I757-E760 PolarHBondContact N-O 3.39Å; I757-E760 PolarHBondContact O-N 3.34Å
758	D	55	Low	55.5	Low	180 Å²	180	88.4 Å²	88.4	96%	0.963	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	22.9	-176.3	-77.4	-17.2	0	0	0	116.6
759	G	58.5	Low	55	Low	69 Å²	69	89.6 Å²	89.6	71%	0.711	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-0.5	-179.4	0	0	0	0	0	114.8	I757	I757-G759 PolarHBondContact O-N 3.48Å
760	E	51.8	Low	55.6	Low	130 Å²	130	90.1 Å²	90.1	61%	0.607	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	148.2	173.8	-164	156.9	-144.6	0	0	110.6	L756 I757	L756-E760 WeakPolarHBondContact CA-O 3.5Å; I757-E760 PolarHBondContact N-O 3.39Å; I757-E760 PolarHBondContact O-N 3.34Å
761	C	55.5	Low	56	Low	53 Å²	53	89.9 Å²	89.9	36%	0.358	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.4	178.1	-101.6	0	0	0	0	110.4	C754	C754-C761 HydrophobicContact CB-CB 3.91Å; C754-C761 WeakPolarHBondContact CB-SG 3.44Å; C754-C761 WeakPolarHBondContact SG-CA 3.36Å; C754-C761 WeakPolarHBondContact SG-CB 3.48Å; C754-C761 CovalentContact SG-SG 2.04Å; C754-C761 PolarHBondContact SG-SG 3.39Å
762	D	62.6	Low	56.2	Low	86 Å²	86	91.5 Å²	91.5	46%	0.46	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.7	166.6	-174.7	28.9	0	0	0	109.5	C754 N755	C754-D762 CarbonylContact C-O 3.21Å; C754-D762 WeakPolarHBondContact CA-O 3.38Å; N755-D762 PolarHBondContact N-O 3.03Å; N755-D762 PolarHBondContact O-N 2.77Å
763	C	60	Low	56.6	Low	8 Å²	8	92.5 Å²	92.5	5%	0.054	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.9	-168.9	-70	0	0	0	0	113.1	C750 Q753 C765	C750-C763 HydrophobicContact CB-CB 3.79Å; C750-C763 WeakPolarHBondContact CB-SG 3.26Å; C750-C763 WeakPolarHBondContact SG-CB 3.36Å; C750-C763 CovalentContact SG-SG 2.04Å; C750-C763 PolarHBondContact SG-SG 3.38Å; Q753-C763 WeakPolarHBondContact O-CA 3.41Å; C763-C765 PolarHBondContact O-N 2.8Å; C763-C765 PolarHBondContact O-SG 2.88Å
764	E	57.6	Low	56.7	Low	122 Å²	122	85.3 Å²	85.3	57%	0.57	48%	0.476	S	S	*	.			trans	-77.3	106.4	-179.6	-76.6	-166.9	-172.3	0	0	112.4	S752 Q753	S752-E764 PolarHBondContact OG-O 2.88Å; Q753-E764 PolarHBondContact O-N 3.13Å
765	C	59.3	Low	56.6	Low	51 Å²	51	87.5 Å²	87.5	35%	0.345	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-84.7	133.4	-175.5	-53.4	0	0	0	0	113.7	C763 H769 C774	C763-C765 PolarHBondContact O-N 2.8Å; C763-C765 PolarHBondContact O-SG 2.88Å; C765-H769 HydrophobicContact CB-CB 4.29Å; C765-H769 WeakPolarHBondContact CB-O 3.29Å; C765-C774 WeakPolarHBondContact CA-SG 3.25Å; C765-C774 HydrophobicContact CB-CB 3.78Å; C765-C774 WeakPolarHBondContact CB-SG 3Å; C765-C774 PolarHBondContact N-SG 2.84Å; C765-C774 WeakPolarHBondContact SG-CA 3.34Å; C765-C774 WeakPolarHBondContact SG-CB 3.03Å; C765-C774 CovalentContact SG-SG 2.04Å; C765-C774 PolarHBondContact SG-SG 3.1Å
766	K	53.3	Low	56.3	Low	139 Å²	139	89 Å²	89	60%	0.604	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-69.1	152.9	170.6	-71.1	175.3	-177.5	165.8	0	111.3	G768 H769	K766-G768 PolarHBondContact O-N 3.02Å; K766-G768 VanDerWaalsContact O-N 3.13Å; K766-H769 PolarHBondContact O-N 2.95Å
767	L	50.3	Low	56.1	Low	187 Å²	187	84.2 Å²	84.2	98%	0.979	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	116.9	179.2	-145.9	84.3	0	0	0	111.2
768	G	50.6	Low	56.2	Low	40 Å²	40	83.3 Å²	83.3	41%	0.412	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.9	-1.4	-175.6	0	0	0	0	0	115.7	K766	K766-G768 PolarHBondContact O-N 3.02Å; K766-G768 VanDerWaalsContact O-N 3.13Å
769	H	50.8	Low	56.5	Low	70 Å²	70	78.3 Å²	78.3	32%	0.324	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	146.9	174.9	-71.7	-111.5	0	0	0	111.4	C765 K766 C774 Q776 T777	C765-H769 HydrophobicContact CB-CB 4.29Å; C765-H769 WeakPolarHBondContact CB-O 3.29Å; K766-H769 PolarHBondContact O-N 2.95Å; H769-C774 HydrophobicContact CB-CB 4.19Å; H769-C774 WeakPolarHBondContact CB-O 3.45Å; H769-C774 PolarHBondContact ND1-O 2.82Å; H769-Q776 CarbonylContact C-O 3.58Å; H769-Q776 WeakPolarHBondContact CA-O 3.46Å; H769-T777 VanDerWaalsContact CE1-CG2 3.44Å; H769-T777 WeakPolarHBondContact CE1-CG2 3.23Å
770	F	63.5	Low	57	Low	101 Å²	101	75.5 Å²	75.5	44%	0.443	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	179.9	-179.5	49.1	-81	0	0	0	112.7	C774 Q776 V778	F770-C774 CarbonylContact O-C 3.56Å; F770-C774 WeakPolarHBondContact O-CA 3.4Å; F770-Q776 WeakPolarHBondContact CD1-O 3.22Å; F770-Q776 HydrophobicContact CD2-CB 3.52Å; F770-Q776 HydrophobicContact CD2-CG 4.41Å; F770-Q776 VanDerWaalsContact CD2-OE1 3.28Å; F770-Q776 HydrophobicContact CE2-CB 3.61Å; F770-Q776 HydrophobicContact CG-CB 4.01Å; F770-Q776 HydrophobicContact CZ-CB 4.17Å; F770-Q776 PolarHBondContact N-O 3.29Å; F770-Q776 VanDerWaalsContact O-CB 3.26Å; F770-Q776 WeakPolarHBondContact O-CB 3.03Å; F770-Q776 PolarHBondContact O-N 3.29Å; F770-V778 HydrophobicContact CE1-CG2 4.14Å
771	G	58.4	Low	58.2	Low	33 Å²	33	70.3 Å²	70.3	34%	0.34	39%	0.385	S	S	.	.	S	Bend	trans	78.1	161.3	-174.3	0	0	0	0	0	113.7	N773 C774	G771-N773 PolarHBondContact O-N 3.37Å; G771-C774 PolarHBondContact O-N 2.76Å
772	L	57.7	Low	59	Low	104 Å²	104	71.1 Å²	71.1	55%	0.545	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.8	-32	-174.6	-83.7	153.8	0	0	0	115.9
773	N	57.5	Low	59.5	Low	51 Å²	51	73.6 Å²	73.6	27%	0.273	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	8.3	-174.3	-58	-57.6	0	0	0	113.6	I748 G771 N775	I748-N773 HydrophobicContact CG2-CB 3.58Å; I748-N773 VanDerWaalsContact CG2-OD1 3.31Å; I748-N773 WeakPolarHBondContact CG2-OD1 3.44Å; G771-N773 PolarHBondContact O-N 3.37Å; N773-N775 HydrophobicContact CB-CB 4.31Å; N773-N775 WeakPolarHBondContact CB-ND2 3.41Å; N773-N775 PolarHBondContact O-N 2.97Å
774	C	59.2	Low	60.3	Low	1 Å²	1	82 Å²	82	1%	0.007	44%	0.442	C	S	.	.	S	Bend	trans	54.5	18.4	-168.9	-48.1	0	0	0	0	115	P751 C765 H769 F770 G771	P751-C774 HydrophobicContact CG-CB 4.05Å; C765-C774 WeakPolarHBondContact CA-SG 3.25Å; C765-C774 HydrophobicContact CB-CB 3.78Å; C765-C774 WeakPolarHBondContact CB-SG 3Å; C765-C774 PolarHBondContact N-SG 2.84Å; C765-C774 WeakPolarHBondContact SG-CA 3.34Å; C765-C774 WeakPolarHBondContact SG-CB 3.03Å; C765-C774 CovalentContact SG-SG 2.04Å; C765-C774 PolarHBondContact SG-SG 3.1Å; H769-C774 HydrophobicContact CB-CB 4.19Å; H769-C774 WeakPolarHBondContact CB-O 3.45Å; H769-C774 PolarHBondContact ND1-O 2.82Å; F770-C774 CarbonylContact O-C 3.56Å; F770-C774 WeakPolarHBondContact O-CA 3.4Å; G771-C774 PolarHBondContact O-N 2.76Å
775	N	56.4	Low	61.4	Low	95 Å²	95	76.6 Å²	76.6	51%	0.508	42%	0.418	S	S	.	.			trans	-88.2	-8.1	-177.6	-75.9	-29	0	0	0	113.2	N773 T777	N773-N775 HydrophobicContact CB-CB 4.31Å; N773-N775 WeakPolarHBondContact CB-ND2 3.41Å; N773-N775 PolarHBondContact O-N 2.97Å; N775-T777 PolarHBondContact O-N 3.45Å
776	Q	55	Low	62.6	Low	108 Å²	108	75 Å²	75	51%	0.505	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	97.9	169.6	-56.2	176.8	-31.6	0	0	107.4	H769 F770	H769-Q776 CarbonylContact C-O 3.58Å; H769-Q776 WeakPolarHBondContact CA-O 3.46Å; F770-Q776 WeakPolarHBondContact CD1-O 3.22Å; F770-Q776 HydrophobicContact CD2-CB 3.52Å; F770-Q776 HydrophobicContact CD2-CG 4.41Å; F770-Q776 VanDerWaalsContact CD2-OE1 3.28Å; F770-Q776 HydrophobicContact CE2-CB 3.61Å; F770-Q776 HydrophobicContact CG-CB 4.01Å; F770-Q776 HydrophobicContact CZ-CB 4.17Å; F770-Q776 PolarHBondContact N-O 3.29Å; F770-Q776 VanDerWaalsContact O-CB 3.26Å; F770-Q776 WeakPolarHBondContact O-CB 3.03Å; F770-Q776 PolarHBondContact O-N 3.29Å
777	T	49.7	Very low	64	Low	32 Å²	32	73.1 Å²	73.1	20%	0.196	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	158.7	167.3	35	0	0	0	0	109.5	H769 N775 D779	H769-T777 VanDerWaalsContact CE1-CG2 3.44Å; H769-T777 WeakPolarHBondContact CE1-CG2 3.23Å; N775-T777 PolarHBondContact O-N 3.45Å; T777-D779 PolarHBondContact O-N 2.63Å; T777-D779 VanDerWaalsContact O-N 3.14Å
778	V	57.9	Low	65.5	Low	90 Å²	90	67.1 Å²	67.1	55%	0.545	37%	0.371	S	S	.	.			trans	-60.6	116.5	166.3	174.4	0	0	0	0	108.4	F770 S780	F770-V778 HydrophobicContact CE1-CG2 4.14Å; V778-S780 PolarHBondContact O-N 2.93Å
779	D	60.5	Low	67.2	Low	75 Å²	75	68.2 Å²	68.2	40%	0.401	37%	0.366	S	S	.	.			trans	-52.1	109.2	179.7	169.7	19.3	0	0	0	111.4	T777 C781 A782	T777-D779 PolarHBondContact O-N 2.63Å; T777-D779 VanDerWaalsContact O-N 3.14Å; D779-C781 PolarHBondContact O-N 3.11Å; D779-C781 VanDerWaalsContact OD1-CA 3.32Å; D779-C781 WeakPolarHBondContact OD1-CA 3.36Å; D779-C781 WeakPolarHBondContact OD1-CB 3.03Å; D779-C781 PolarHBondContact OD1-N 3.29Å; D779-A782 HydrophobicContact CB-CB 4.09Å; D779-A782 VanDerWaalsContact CG-N 3.34Å; D779-A782 VanDerWaalsContact O-CB 3.3Å; D779-A782 WeakPolarHBondContact O-CB 3.41Å; D779-A782 PolarHBondContact O-N 2.03Å; D779-A782 VanDerWaalsContact O-N 3.09Å; D779-A782 PolarHBondContact OD1-N 3.05Å; D779-A782 PolarHBondContact OD2-N 3.49Å
780	S	70	Confident	68.9	Low	9 Å²	9	66.6 Å²	66.6	6%	0.063	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.7	179.6	-41.3	0	0	0	0	112.5	V778 I783 D792 G796 K797	V778-S780 PolarHBondContact O-N 2.93Å; S780-I783 VanDerWaalsContact O-CG1 3.29Å; S780-I783 WeakPolarHBondContact O-CG1 3.02Å; S780-D792 WeakPolarHBondContact CB-OD1 3.37Å; S780-D792 PolarHBondContact N-OD1 2.82Å; S780-D792 PolarHBondContact OG-OD1 3.41Å; S780-G796 VanDerWaalsContact OG-C 3.27Å; S780-G796 VanDerWaalsContact OG-CA 3.25Å; S780-G796 WeakPolarHBondContact OG-CA 3.47Å; S780-K797 PolarHBondContact OG-N 2.84Å; S780-K797 PolarHBondContact OG-O 3.37Å
781	C	75.8	Confident	69.8	Low	22 Å²	22	63.9 Å²	63.9	15%	0.149	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-12.3	176.3	-64.9	0	0	0	0	113.7	D779 I783 K784 C790 D792	D779-C781 PolarHBondContact O-N 3.11Å; D779-C781 VanDerWaalsContact OD1-CA 3.32Å; D779-C781 WeakPolarHBondContact OD1-CA 3.36Å; D779-C781 WeakPolarHBondContact OD1-CB 3.03Å; D779-C781 PolarHBondContact OD1-N 3.29Å; C781-I783 PolarHBondContact O-N 2.03Å; C781-K784 WeakPolarHBondContact O-CA 3.03Å; C781-K784 PolarHBondContact O-N 2.93Å; C781-C790 WeakPolarHBondContact CA-SG 3.47Å; C781-C790 HydrophobicContact CB-CB 3.65Å; C781-C790 WeakPolarHBondContact CB-SG 3.23Å; C781-C790 WeakPolarHBondContact SG-CB 3.11Å; C781-C790 CovalentContact SG-SG 2.03Å; C781-C790 PolarHBondContact SG-SG 3.33Å; C781-D792 PolarHBondContact SG-N 2.03Å
782	A	72.1	Confident	70.8	Confident	69 Å²	69	65 Å²	65	57%	0.57	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-30	177.3	0	0	0	0	0	112.7	D779 K784	D779-A782 HydrophobicContact CB-CB 4.09Å; D779-A782 VanDerWaalsContact CG-N 3.34Å; D779-A782 VanDerWaalsContact O-CB 3.3Å; D779-A782 WeakPolarHBondContact O-CB 3.41Å; D779-A782 PolarHBondContact O-N 2.03Å; D779-A782 VanDerWaalsContact O-N 3.09Å; D779-A782 PolarHBondContact OD1-N 3.05Å; D779-A782 PolarHBondContact OD2-N 3.49Å; A782-K784 PolarHBondContact O-N 3.08Å
783	I	73.7	Confident	71.6	Confident	139 Å²	139	65 Å²	65	71%	0.713	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	8	173.3	58.8	169.2	0	0	0	113.9	S780 C781	S780-I783 VanDerWaalsContact O-CG1 3.29Å; S780-I783 WeakPolarHBondContact O-CG1 3.02Å; C781-I783 PolarHBondContact O-N 2.03Å
784	K	76	Confident	71.9	Confident	183 Å²	183	63.1 Å²	63.1	80%	0.796	35%	0.346	S	S	*	.			trans	44.3	61.9	-179.1	-61.2	-172.2	178.4	-175.4	0	114.1	C781 A782 C786	C781-K784 WeakPolarHBondContact O-CA 3.03Å; C781-K784 PolarHBondContact O-N 2.93Å; A782-K784 PolarHBondContact O-N 3.08Å; K784-C786 VanDerWaalsContact C-N 3.28Å; K784-C786 PolarHBondContact O-N 3.32Å
785	P	81.9	Confident	72.3	Confident	10 Å²	10	68.7 Å²	68.7	7%	0.065	38%	0.375	C	S	.	.			trans	-81.3	1.7	-172.1	36.3	-38.4	0	0	0	114.9	C790 Y798 R814	P785-C790 VanDerWaalsContact CG-SG 3.57Å; P785-Y798 HydrophobicContact CB-CD1 4.41Å; P785-Y798 HydrophobicContact CB-CD2 4.1Å; P785-Y798 HydrophobicContact CB-CE1 4Å; P785-Y798 HydrophobicContact CB-CE2 3.64Å; P785-Y798 HydrophobicContact CB-CG 4.49Å; P785-Y798 HydrophobicContact CG-CD1 3.94Å; P785-Y798 HydrophobicContact CG-CD2 3.58Å; P785-Y798 HydrophobicContact CG-CE1 4.04Å; P785-Y798 HydrophobicContact CG-CE2 3.68Å; P785-Y798 HydrophobicContact CG-CG 3.74Å; P785-R814 WeakPolarHBondContact O-CB 3.06Å; P785-R814 VanDerWaalsContact O-CD 3.25Å; P785-R814 WeakPolarHBondContact O-CD 3.17Å; P785-R814 VanDerWaalsContact O-CG 3.26Å; P785-R814 WeakPolarHBondContact O-CG 3.02Å
786	C	84.9	Confident	72.8	Confident	17 Å²	17	66.8 Å²	66.8	12%	0.115	38%	0.378	C	S	.	.	S	Bend	trans	-130.4	149.2	-176.8	-52.7	0	0	0	0	110.9	K784 C790 C800	K784-C786 VanDerWaalsContact C-N 3.28Å; K784-C786 PolarHBondContact O-N 3.32Å; C786-C790 HydrophobicContact CB-CB 4.02Å; C786-C800 HydrophobicContact CB-CB 3.64Å; C786-C800 WeakPolarHBondContact CB-SG 3.32Å; C786-C800 WeakPolarHBondContact SG-CA 3.42Å; C786-C800 WeakPolarHBondContact SG-CB 3.47Å; C786-C800 CovalentContact SG-SG 2.03Å; C786-C800 PolarHBondContact SG-SG 2.93Å
787	D	82.7	Confident	73.7	Confident	99 Å²	99	66.9 Å²	66.9	53%	0.529	38%	0.377	S	S	.	.	S	Bend	trans	-68.2	-35.2	-179.2	-78.4	6.8	0	0	0	114.5	R814 R815 C816	D787-R814 PolarHBondContact N-O 2.87Å; D787-R815 VanDerWaalsContact OD2-CA 3.31Å; D787-R815 WeakPolarHBondContact OD2-CA 3.4Å; D787-R815 WeakPolarHBondContact OD2-CG 3.1Å; D787-C816 PolarHBondContact OD2-N 3.37Å
788	Q	81.1	Confident	75.3	Confident	61 Å²	61	68.3 Å²	68.3	29%	0.285	38%	0.379	S	S	.	.	S	Bend	trans	-123.4	-83.4	-172.8	-65.8	-175.2	-2.2	0	0	111.9	F806 C816	Q788-F806 VanDerWaalsContact NE2-CG 3.33Å; Q788-C816 HydrophobicContact CB-CB 4.46Å; Q788-C816 HydrophobicContact CG-CB 3.79Å
789	I	86	Confident	76.6	Confident	63 Å²	63	67 Å²	67	32%	0.323	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.2	-179.8	-53.2	169.9	0	0	0	108.3	V791 C800 K801 N803	I789-V791 HydrophobicContact CG2-CG2 4.06Å; I789-C800 CarbonylContact O-C 3.53Å; I789-C800 WeakPolarHBondContact O-CA 3.43Å; I789-K801 HydrophobicContact CB-CB 3.94Å; I789-K801 WeakPolarHBondContact CB-O 3.45Å; I789-K801 HydrophobicContact CD1-CB 4.2Å; I789-K801 HydrophobicContact CG2-CB 4.18Å; I789-K801 PolarHBondContact N-O 3.33Å; I789-K801 PolarHBondContact O-N 2.04Å; I789-N803 WeakPolarHBondContact CD1-OD1 3.03Å
790	C	86.1	Confident	77.8	Confident	36 Å²	36	64.2 Å²	64.2	24%	0.243	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.8	164.1	-173	0	0	0	0	109.2	C781 P785 C786	C781-C790 WeakPolarHBondContact CA-SG 3.47Å; C781-C790 HydrophobicContact CB-CB 3.65Å; C781-C790 WeakPolarHBondContact CB-SG 3.23Å; C781-C790 WeakPolarHBondContact SG-CB 3.11Å; C781-C790 CovalentContact SG-SG 2.03Å; C781-C790 PolarHBondContact SG-SG 3.33Å; P785-C790 VanDerWaalsContact CG-SG 3.57Å; C786-C790 HydrophobicContact CB-CB 4.02Å
791	V	83.6	Confident	78.5	Confident	45 Å²	45	69.3 Å²	69.3	27%	0.273	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110.8	172.9	-178.8	0	0	0	0	107.1	I789 Y798 T799 K801	I789-V791 HydrophobicContact CG2-CG2 4.06Å; V791-Y798 CarbonylContact O-C 3.6Å; V791-Y798 VanDerWaalsContact O-CA 3.27Å; V791-Y798 WeakPolarHBondContact O-CA 3.36Å; V791-T799 HydrophobicContact CB-CG2 3.91Å; V791-T799 HydrophobicContact CG1-CG2 4.39Å; V791-T799 PolarHBondContact N-O 2.83Å; V791-T799 PolarHBondContact O-N 3.48Å; V791-K801 HydrophobicContact CG2-CD 3.95Å; V791-K801 HydrophobicContact CG2-CG 4.28Å
792	D	79.4	Confident	78.8	Confident	56 Å²	56	69.5 Å²	69.5	30%	0.299	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	142.1	175.7	-175.1	37.2	0	0	0	110.2	S780 C781 G794	S780-D792 WeakPolarHBondContact CB-OD1 3.37Å; S780-D792 PolarHBondContact N-OD1 2.82Å; S780-D792 PolarHBondContact OG-OD1 3.41Å; C781-D792 PolarHBondContact SG-N 2.03Å; D792-G794 PolarHBondContact OD1-N 2.04Å
793	L	74.7	Confident	79.3	Confident	103 Å²	103	70.2 Å²	70.2	54%	0.539	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	3.7	-179.5	-61.5	178	0	0	0	112.1	K797 T799	L793-K797 WeakPolarHBondContact CA-O 3.44Å; L793-K797 HydrophobicContact CB-CB 3.94Å; L793-K797 WeakPolarHBondContact CB-O 3.29Å; L793-K797 PolarHBondContact N-O 3.4Å; L793-T799 HydrophobicContact CD1-CG2 4.12Å; L793-T799 HydrophobicContact CD2-CG2 4.13Å; L793-T799 HydrophobicContact CG-CG2 4.27Å
794	G	63.1	Low	79.1	Confident	13 Å²	13	71.2 Å²	71.2	13%	0.134	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.5	172.6	-174.8	0	0	0	0	0	113.6	D792 G796 K797	D792-G794 PolarHBondContact OD1-N 2.04Å; G794-G796 PolarHBondContact O-N 3.4Å; G794-G796 VanDerWaalsContact O-N 3.14Å; G794-K797 PolarHBondContact N-O 3.5Å; G794-K797 VanDerWaalsContact O-CB 3.25Å; G794-K797 WeakPolarHBondContact O-CB 3.35Å; G794-K797 PolarHBondContact O-N 3.38Å
795	D	67.9	Low	78.5	Confident	117 Å²	117	63.4 Å²	63.4	63%	0.626	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	29.6	-175.2	-54.8	-26.6	0	0	0	114.7	K797	D795-K797 HydrophobicContact CB-CD 4.37Å; D795-K797 PolarHBondContact O-N 3.48Å; D795-K797 IonicContact OD2-NZ 3.78Å; D795-K797 PolarHBondContact OD2-NZ 2.82Å
796	G	67.1	Low	78.4	Confident	55 Å²	55	66.4 Å²	66.4	57%	0.567	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	12.3	-174.5	0	0	0	0	0	114.7	S780 G794	S780-G796 VanDerWaalsContact OG-C 3.27Å; S780-G796 VanDerWaalsContact OG-CA 3.25Å; S780-G796 WeakPolarHBondContact OG-CA 3.47Å; G794-G796 PolarHBondContact O-N 3.4Å; G794-G796 VanDerWaalsContact O-N 3.14Å
797	K	74	Confident	77.8	Confident	111 Å²	111	69.4 Å²	69.4	48%	0.483	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	147.7	175.8	-53.3	163.3	-158.1	142.1	0	109.2	S780 L793 G794 D795	S780-K797 PolarHBondContact OG-N 2.84Å; S780-K797 PolarHBondContact OG-O 3.37Å; L793-K797 WeakPolarHBondContact CA-O 3.44Å; L793-K797 HydrophobicContact CB-CB 3.94Å; L793-K797 WeakPolarHBondContact CB-O 3.29Å; L793-K797 PolarHBondContact N-O 3.4Å; G794-K797 PolarHBondContact N-O 3.5Å; G794-K797 VanDerWaalsContact O-CB 3.25Å; G794-K797 WeakPolarHBondContact O-CB 3.35Å; G794-K797 PolarHBondContact O-N 3.38Å; D795-K797 HydrophobicContact CB-CD 4.37Å; D795-K797 PolarHBondContact O-N 3.48Å; D795-K797 IonicContact OD2-NZ 3.78Å; D795-K797 PolarHBondContact OD2-NZ 2.82Å
798	Y	82.6	Confident	77.4	Confident	61 Å²	61	67.9 Å²	67.9	24%	0.239	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	164.6	172.8	56.3	-82.4	0	0	0	108.4	P785 V791 R814	P785-Y798 HydrophobicContact CB-CD1 4.41Å; P785-Y798 HydrophobicContact CB-CD2 4.1Å; P785-Y798 HydrophobicContact CB-CE1 4Å; P785-Y798 HydrophobicContact CB-CE2 3.64Å; P785-Y798 HydrophobicContact CB-CG 4.49Å; P785-Y798 HydrophobicContact CG-CD1 3.94Å; P785-Y798 HydrophobicContact CG-CD2 3.58Å; P785-Y798 HydrophobicContact CG-CE1 4.04Å; P785-Y798 HydrophobicContact CG-CE2 3.68Å; P785-Y798 HydrophobicContact CG-CG 3.74Å; V791-Y798 CarbonylContact O-C 3.6Å; V791-Y798 VanDerWaalsContact O-CA 3.27Å; V791-Y798 WeakPolarHBondContact O-CA 3.36Å; Y798-R814 PolarHBondContact OH-NE 2.04Å; Y798-R814 PolarHBondContact OH-NH2 2.81Å
799	T	85.5	Confident	76.9	Confident	62 Å²	62	65.8 Å²	65.8	38%	0.38	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.5	165.5	-173.3	0	0	0	0	110.2	V791 L793	V791-T799 HydrophobicContact CB-CG2 3.91Å; V791-T799 HydrophobicContact CG1-CG2 4.39Å; V791-T799 PolarHBondContact N-O 2.83Å; V791-T799 PolarHBondContact O-N 3.48Å; L793-T799 HydrophobicContact CD1-CG2 4.12Å; L793-T799 HydrophobicContact CD2-CG2 4.13Å; L793-T799 HydrophobicContact CG-CG2 4.27Å
800	C	85	Confident	76.2	Confident	17 Å²	17	67.7 Å²	67.7	12%	0.115	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.9	-179	-55.5	0	0	0	0	109.7	C786 I789 P813	C786-C800 HydrophobicContact CB-CB 3.64Å; C786-C800 WeakPolarHBondContact CB-SG 3.32Å; C786-C800 WeakPolarHBondContact SG-CA 3.42Å; C786-C800 WeakPolarHBondContact SG-CB 3.47Å; C786-C800 CovalentContact SG-SG 2.03Å; C786-C800 PolarHBondContact SG-SG 2.93Å; I789-C800 CarbonylContact O-C 3.53Å; I789-C800 WeakPolarHBondContact O-CA 3.43Å; C800-P813 VanDerWaalsContact CB-O 3.27Å; C800-P813 WeakPolarHBondContact CB-O 3.07Å
801	K	85.2	Confident	75.6	Confident	117 Å²	117	73.1 Å²	73.1	51%	0.509	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	161.6	171.3	-64.6	179.9	-178.7	177.2	0	109.2	I789 V791	I789-K801 HydrophobicContact CB-CB 3.94Å; I789-K801 WeakPolarHBondContact CB-O 3.45Å; I789-K801 HydrophobicContact CD1-CB 4.2Å; I789-K801 HydrophobicContact CG2-CB 4.18Å; I789-K801 PolarHBondContact N-O 3.33Å; I789-K801 PolarHBondContact O-N 2.04Å; V791-K801 HydrophobicContact CG2-CD 3.95Å; V791-K801 HydrophobicContact CG2-CG 4.28Å
802	C	83	Confident	75.2	Confident	25 Å²	25	74.1 Å²	74.1	17%	0.169	41%	0.406	C	S	.	.			trans	-118.7	157.1	178	-53.9	0	0	0	0	110.5	F806 E807 C816	C802-F806 HydrophobicContact CB-CB 3.67Å; C802-F806 WeakPolarHBondContact CB-O 2.99Å; C802-E807 VanDerWaalsContact SG-C 3.55Å; C802-C816 WeakPolarHBondContact CA-SG 3.01Å; C802-C816 HydrophobicContact CB-CB 3.82Å; C802-C816 WeakPolarHBondContact CB-SG 3.48Å; C802-C816 WeakPolarHBondContact SG-CB 3.36Å; C802-C816 CovalentContact SG-SG 2.04Å; C802-C816 PolarHBondContact SG-SG 2.96Å
803	N	81	Confident	75.1	Confident	84 Å²	84	75.8 Å²	75.8	45%	0.449	42%	0.419	S	S	.	.			trans	-72.2	166.3	177	-62.4	-24.7	0	0	0	111.1	I789 G805 F806	I789-N803 WeakPolarHBondContact CD1-OD1 3.03Å; N803-G805 PolarHBondContact O-N 2.85Å; N803-F806 HydrophobicContact CB-CD2 4.29Å; N803-F806 PolarHBondContact O-N 3.48Å
804	E	70.5	Confident	75.4	Confident	161 Å²	161	76.4 Å²	76.4	75%	0.752	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	131.1	172	-79.7	-160.9	166.7	0	0	110.8
805	G	64.2	Low	76.2	Confident	18 Å²	18	82.8 Å²	82.8	19%	0.186	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	9.3	-174.8	0	0	0	0	0	115.2	N803 I819	N803-G805 PolarHBondContact O-N 2.85Å; G805-I819 PolarHBondContact O-N 3.07Å
806	F	78.3	Confident	76.6	Confident	73 Å²	73	77.9 Å²	77.9	32%	0.32	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143.9	174.8	-66.9	-96.3	0	0	0	112.4	Q788 C802 N803 C816 Q817 R818	Q788-F806 VanDerWaalsContact NE2-CG 3.33Å; C802-F806 HydrophobicContact CB-CB 3.67Å; C802-F806 WeakPolarHBondContact CB-O 2.99Å; N803-F806 HydrophobicContact CB-CD2 4.29Å; N803-F806 PolarHBondContact O-N 3.48Å; F806-C816 HydrophobicContact CB-CB 4.28Å; F806-C816 HydrophobicContact CD1-CB 4.48Å; F806-Q817 CarbonylContact C-O 3.52Å; F806-Q817 VanDerWaalsContact CA-O 3.3Å; F806-Q817 WeakPolarHBondContact CA-O 3.4Å; F806-R818 HydrophobicContact CD1-CB 4.08Å; F806-R818 HydrophobicContact CE1-CB 3.82Å; F806-R818 HydrophobicContact CE1-CG 4.25Å; F806-R818 HydrophobicContact CZ-CG 4.49Å
807	E	72.5	Confident	76.8	Confident	80 Å²	80	76 Å²	76	37%	0.374	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	151.3	173.3	-80.4	168.4	-126.9	0	0	111	C802 C816 Q817 I819	C802-E807 VanDerWaalsContact SG-C 3.55Å; E807-C816 WeakPolarHBondContact O-CA 2.96Å; E807-Q817 HydrophobicContact CB-CG 4.24Å; E807-Q817 PolarHBondContact N-O 3.07Å; E807-Q817 VanDerWaalsContact O-CG 3.23Å; E807-Q817 WeakPolarHBondContact O-CG 3.11Å; E807-Q817 PolarHBondContact O-N 3.01Å; E807-I819 HydrophobicContact CB-CG1 4.45Å; E807-I819 HydrophobicContact CG-CD1 3.81Å; E807-I819 HydrophobicContact CG-CG1 3.83Å; E807-I819 WeakPolarHBondContact OE1-CG1 3.41Å
808	P	75.5	Confident	76.7	Confident	68 Å²	68	75.6 Å²	75.6	44%	0.442	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	134.8	164.6	-17.2	31.2	0	0	0	110.5
809	S	70.4	Confident	76.3	Confident	16 Å²	16	75.3 Å²	75.3	11%	0.112	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.3	-176.6	-168.1	0	0	0	0	112.2	N811 N812 R815 Q817	S809-N811 PolarHBondContact O-N 3.21Å; S809-N812 CarbonylContact O-C 3.21Å; S809-N812 PolarHBondContact O-N 3.21Å; S809-R815 PolarHBondContact N-O 3.3Å; S809-Q817 VanDerWaalsContact CB-OE1 3.3Å; S809-Q817 PolarHBondContact OG-OE1 3.3Å
810	P	71.2	Confident	75.9	Confident	103 Å²	103	72.9 Å²	72.9	67%	0.669	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.1	-179.2	-26.8	33.5	0	0	0	114.1
811	N	73.5	Confident	75.4	Confident	151 Å²	151	76.7 Å²	76.7	81%	0.807	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-16.9	-177.9	-62.5	-23.5	0	0	0	113.2	S809	S809-N811 PolarHBondContact O-N 3.21Å
812	N	75.3	Confident	75.1	Confident	66 Å²	66	75.3 Å²	75.3	35%	0.353	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	102.6	179.8	-179.4	9.5	0	0	0	110.6	S809 R814 R815	S809-N812 CarbonylContact O-C 3.21Å; S809-N812 PolarHBondContact O-N 3.21Å; N812-R814 PolarHBondContact O-N 3.4Å; N812-R814 VanDerWaalsContact OD1-CB 3.28Å; N812-R814 WeakPolarHBondContact OD1-CB 3.39Å; N812-R814 WeakPolarHBondContact OD1-CG 2.99Å; N812-R814 PolarHBondContact OD1-N 2.83Å; N812-R814 VanDerWaalsContact OD1-N 3.07Å; N812-R815 HydrophobicContact CB-CB 4.22Å; N812-R815 PolarHBondContact O-N 3.44Å
813	P	76	Confident	74.3	Confident	90 Å²	90	76.6 Å²	76.6	58%	0.584	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.9	-17.7	178.2	-26.6	35.6	0	0	0	115	C800 R815	C800-P813 VanDerWaalsContact CB-O 3.27Å; C800-P813 WeakPolarHBondContact CB-O 3.07Å; P813-R815 VanDerWaalsContact C-N 3.29Å
814	R	81.7	Confident	73.9	Confident	117 Å²	117	78 Å²	78	44%	0.442	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-23.2	174.6	-56.8	173	178.6	-138.3	14.3	113.3	P785 D787 Y798 N812	P785-R814 WeakPolarHBondContact O-CB 3.06Å; P785-R814 VanDerWaalsContact O-CD 3.25Å; P785-R814 WeakPolarHBondContact O-CD 3.17Å; P785-R814 VanDerWaalsContact O-CG 3.26Å; P785-R814 WeakPolarHBondContact O-CG 3.02Å; D787-R814 PolarHBondContact N-O 2.87Å; Y798-R814 PolarHBondContact OH-NE 2.04Å; Y798-R814 PolarHBondContact OH-NH2 2.81Å; N812-R814 PolarHBondContact O-N 3.4Å; N812-R814 VanDerWaalsContact OD1-CB 3.28Å; N812-R814 WeakPolarHBondContact OD1-CB 3.39Å; N812-R814 WeakPolarHBondContact OD1-CG 2.99Å; N812-R814 PolarHBondContact OD1-N 2.83Å; N812-R814 VanDerWaalsContact OD1-N 3.07Å
815	R	79.5	Confident	74.1	Confident	147 Å²	147	71 Å²	71	56%	0.555	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	131	-172.8	-153.8	-171.9	-173.8	178.9	0	110.3	D787 S809 N812 P813	D787-R815 VanDerWaalsContact OD2-CA 3.31Å; D787-R815 WeakPolarHBondContact OD2-CA 3.4Å; D787-R815 WeakPolarHBondContact OD2-CG 3.1Å; S809-R815 PolarHBondContact N-O 3.3Å; N812-R815 HydrophobicContact CB-CB 4.22Å; N812-R815 PolarHBondContact O-N 3.44Å; P813-R815 VanDerWaalsContact C-N 3.29Å
816	C	76	Confident	74.9	Confident	14 Å²	14	70.2 Å²	70.2	10%	0.095	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.1	175.6	-69.6	0	0	0	0	110.1	D787 Q788 C802 F806 E807	D787-C816 PolarHBondContact OD2-N 3.37Å; Q788-C816 HydrophobicContact CB-CB 4.46Å; Q788-C816 HydrophobicContact CG-CB 3.79Å; C802-C816 WeakPolarHBondContact CA-SG 3.01Å; C802-C816 HydrophobicContact CB-CB 3.82Å; C802-C816 WeakPolarHBondContact CB-SG 3.48Å; C802-C816 WeakPolarHBondContact SG-CB 3.36Å; C802-C816 CovalentContact SG-SG 2.04Å; C802-C816 PolarHBondContact SG-SG 2.96Å; F806-C816 HydrophobicContact CB-CB 4.28Å; F806-C816 HydrophobicContact CD1-CB 4.48Å; E807-C816 WeakPolarHBondContact O-CA 2.96Å
817	Q	71.8	Confident	74.9	Confident	16 Å²	16	70.5 Å²	70.5	8%	0.075	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.1	-176.8	51.6	176.4	44.5	0	0	110.3	F806 E807 S809 F835	F806-Q817 CarbonylContact C-O 3.52Å; F806-Q817 VanDerWaalsContact CA-O 3.3Å; F806-Q817 WeakPolarHBondContact CA-O 3.4Å; E807-Q817 HydrophobicContact CB-CG 4.24Å; E807-Q817 PolarHBondContact N-O 3.07Å; E807-Q817 VanDerWaalsContact O-CG 3.23Å; E807-Q817 WeakPolarHBondContact O-CG 3.11Å; E807-Q817 PolarHBondContact O-N 3.01Å; S809-Q817 VanDerWaalsContact CB-OE1 3.3Å; S809-Q817 PolarHBondContact OG-OE1 3.3Å; Q817-F835 VanDerWaalsContact CD-CE1 3.46Å; Q817-F835 HydrophobicContact CG-CE1 4.32Å; Q817-F835 VanDerWaalsContact NE2-CZ 3.28Å
818	R	72.7	Confident	75.4	Confident	101 Å²	101	70.5 Å²	70.5	38%	0.381	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	129.3	-170.5	-176	170.5	174.7	-96.6	-9	111.7	F806 D825 T833 D840	F806-R818 HydrophobicContact CD1-CB 4.08Å; F806-R818 HydrophobicContact CE1-CB 3.82Å; F806-R818 HydrophobicContact CE1-CG 4.25Å; F806-R818 HydrophobicContact CZ-CG 4.49Å; R818-D825 IonicContact CZ-OD1 2.7Å; R818-D825 IonicContact CZ-OD2 3.88Å; R818-D825 IonicContact NH1-OD1 2.69Å; R818-D825 PolarHBondContact NH1-OD1 2.81Å; R818-D825 IonicContact NH1-OD2 2.87Å; R818-D825 IonicContact NH2-OD1 2.7Å; R818-D825 PolarHBondContact NH2-OD1 2.99Å; R818-D825 IonicContact NH2-OD2 2.73Å; R818-D825 PolarHBondContact NH2-OD2 3.31Å; R818-T833 WeakPolarHBondContact O-CG2 3.42Å; R818-D840 PolarHBondContact N-OD2 2.75Å
819	I	74.4	Confident	75.5	Confident	56 Å²	56	67.6 Å²	67.6	29%	0.287	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-81.5	133.8	166.3	-33.8	172.4	0	0	0	107.5	G805 E807	G805-I819 PolarHBondContact O-N 3.07Å; E807-I819 HydrophobicContact CB-CG1 4.45Å; E807-I819 HydrophobicContact CG-CD1 3.81Å; E807-I819 HydrophobicContact CG-CG1 3.83Å; E807-I819 WeakPolarHBondContact OE1-CG1 3.41Å
820	C	75.8	Confident	76.1	Confident	11 Å²	11	69.6 Å²	69.6	7%	0.074	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-72.8	155.9	166.9	68.2	0	0	0	0	110.3	D825 C831 R832 T833 S842	C820-D825 VanDerWaalsContact CA-OD2 3.25Å; C820-D825 WeakPolarHBondContact CA-OD2 3.47Å; C820-D825 HydrophobicContact CB-CB 4.05Å; C820-C831 HydrophobicContact CB-CB 3.71Å; C820-C831 WeakPolarHBondContact CB-SG 3.45Å; C820-C831 PolarHBondContact O-SG 3.3Å; C820-C831 WeakPolarHBondContact SG-CB 3.49Å; C820-C831 CovalentContact SG-SG 2.04Å; C820-C831 PolarHBondContact SG-SG 3.35Å; C820-R832 VanDerWaalsContact SG-C 3.53Å; C820-T833 HydrophobicContact CB-CG2 4.28Å; C820-S842 WeakPolarHBondContact CB-OG 3.49Å
821	K	75.9	Confident	76.7	Confident	96 Å²	96	66 Å²	66	42%	0.417	34%	0.339	S	S	.	.			trans	-127.6	130.9	172.2	-73.4	179.7	174.9	-178.7	0	111.2	I824 D825	K821-I824 HydrophobicContact CB-CB 4.1Å; K821-I824 HydrophobicContact CB-CD1 4.07Å; K821-I824 HydrophobicContact CB-CG1 4.26Å; K821-I824 HydrophobicContact CD-CD1 3.9Å; K821-I824 PolarHBondContact O-N 2.03Å; K821-D825 PolarHBondContact N-OD2 3.09Å; K821-D825 PolarHBondContact O-N 2.76Å
822	D	77.3	Confident	77	Confident	89 Å²	89	65.8 Å²	65.8	48%	0.476	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-53.2	139.9	166.4	-71.6	21.2	0	0	0	110	I824 S830 C831	D822-I824 PolarHBondContact O-N 3.19Å; D822-S830 WeakPolarHBondContact OD1-CA 3.09Å; D822-S830 WeakPolarHBondContact OD2-CA 3.07Å; D822-S830 VanDerWaalsContact OD2-CB 3.23Å; D822-S830 WeakPolarHBondContact OD2-CB 3.46Å; D822-S830 PolarHBondContact OD2-OG 2.82Å; D822-C831 PolarHBondContact OD1-N 2.9Å
823	G	66.1	Low	76.9	Confident	51 Å²	51	64.8 Å²	64.8	53%	0.526	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	-11.2	-173.3	0	0	0	0	0	115.6	C826	G823-C826 VanDerWaalsContact CA-O 3.25Å; G823-C826 WeakPolarHBondContact CA-O 3.1Å; G823-C826 PolarHBondContact N-O 3.14Å
824	I	73.6	Confident	76.4	Confident	115 Å²	115	63 Å²	63	59%	0.59	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-53	-178.7	-57.9	-177.7	0	0	0	111.7	K821 D822	K821-I824 HydrophobicContact CB-CB 4.1Å; K821-I824 HydrophobicContact CB-CD1 4.07Å; K821-I824 HydrophobicContact CB-CG1 4.26Å; K821-I824 HydrophobicContact CD-CD1 3.9Å; K821-I824 PolarHBondContact O-N 2.03Å; D822-I824 PolarHBondContact O-N 3.19Å
825	D	74.2	Confident	75.5	Confident	14 Å²	14	62.8 Å²	62.8	8%	0.075	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-31.2	175.8	-71.4	-75.3	0	0	0	112	R818 C820 K821 N854	R818-D825 IonicContact CZ-OD1 2.7Å; R818-D825 IonicContact CZ-OD2 3.88Å; R818-D825 IonicContact NH1-OD1 2.69Å; R818-D825 PolarHBondContact NH1-OD1 2.81Å; R818-D825 IonicContact NH1-OD2 2.87Å; R818-D825 IonicContact NH2-OD1 2.7Å; R818-D825 PolarHBondContact NH2-OD1 2.99Å; R818-D825 IonicContact NH2-OD2 2.73Å; R818-D825 PolarHBondContact NH2-OD2 3.31Å; C820-D825 VanDerWaalsContact CA-OD2 3.25Å; C820-D825 WeakPolarHBondContact CA-OD2 3.47Å; C820-D825 HydrophobicContact CB-CB 4.05Å; K821-D825 PolarHBondContact N-OD2 3.09Å; K821-D825 PolarHBondContact O-N 2.76Å; D825-N854 WeakPolarHBondContact O-CB 3.33Å; D825-N854 PolarHBondContact O-ND2 2.04Å
826	C	81	Confident	74.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-126.8	110	176.9	-52.7	0	0	0	0	107.1	G823 G829 C831 C844 N854	G823-C826 VanDerWaalsContact CA-O 3.25Å; G823-C826 WeakPolarHBondContact CA-O 3.1Å; G823-C826 PolarHBondContact N-O 3.14Å; C826-G829 WeakPolarHBondContact CB-O 3.22Å; C826-C831 HydrophobicContact CB-CB 4.33Å; C826-C831 VanDerWaalsContact SG-CA 3.51Å; C826-C831 WeakPolarHBondContact SG-CB 3.49Å; C826-C844 WeakPolarHBondContact CA-SG 3.47Å; C826-C844 HydrophobicContact CB-CB 3.71Å; C826-C844 WeakPolarHBondContact CB-SG 3.39Å; C826-C844 WeakPolarHBondContact SG-CA 3.04Å; C826-C844 WeakPolarHBondContact SG-CB 3.48Å; C826-C844 CovalentContact SG-SG 2.02Å; C826-C844 PolarHBondContact SG-SG 3.31Å; C826-N854 CarbonylContact C-O 3.49Å; C826-N854 WeakPolarHBondContact CA-O 3.33Å
827	I	79.1	Confident	73	Confident	79 Å²	79	64.8 Å²	64.8	41%	0.405	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-52.8	-170.1	-49.7	-174.1	0	0	0	110	N854 Q856	I827-N854 PolarHBondContact N-O 3.17Å; I827-Q856 HydrophobicContact CD1-CB 3.67Å; I827-Q856 HydrophobicContact CG1-CB 4.31Å
828	Y	81.5	Confident	72.2	Confident	80 Å²	80	71.7 Å²	71.7	31%	0.314	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	58.8	177.3	-52.9	-66.3	0	0	0	110.9	L847 F850 C855 L880	Y828-L847 PolarHBondContact O-N 3.22Å; Y828-F850 VanDerWaalsContact CB-CD1 3.46Å; Y828-F850 AromaticContact CD1-CE1 4Å; Y828-F850 HydrophobicContact CD1-CE1 4Å; Y828-F850 HydrophobicContact CD1-CE2 4.45Å; Y828-F850 AromaticContact CD1-CZ 3.88Å; Y828-F850 HydrophobicContact CD1-CZ 3.88Å; Y828-F850 AromaticContact CD2-CD1 3.39Å; Y828-F850 HydrophobicContact CD2-CD1 3.39Å; Y828-F850 AromaticContact CD2-CE1 3.25Å; Y828-F850 HydrophobicContact CD2-CE1 3.25Å; Y828-F850 HydrophobicContact CD2-CG 4.22Å; Y828-F850 AromaticContact CD2-CZ 4Å; Y828-F850 HydrophobicContact CD2-CZ 4Å; Y828-F850 HydrophobicContact CE2-CD1 4.33Å; Y828-F850 AromaticContact CE2-CE1 3.89Å; Y828-F850 HydrophobicContact CE2-CE1 3.89Å; Y828-F850 AromaticContact CG-CD1 3.58Å; Y828-F850 HydrophobicContact CG-CD1 3.58Å; Y828-F850 HydrophobicContact CG-CD2 4.29Å; Y828-F850 AromaticContact CG-CE1 3.33Å; Y828-F850 HydrophobicContact CG-CE1 3.33Å; Y828-F850 HydrophobicContact CG-CE2 4.08Å; Y828-F850 HydrophobicContact CG-CG 4.04Å; Y828-F850 AromaticContact CG-CZ 3.58Å; Y828-F850 HydrophobicContact CG-CZ 3.58Å; Y828-C855 VanDerWaalsContact CD2-O 3.28Å; Y828-C855 WeakPolarHBondContact CD2-O 3.41Å; Y828-C855 PolarHBondContact N-O 2.93Å; Y828-C855 VanDerWaalsContact N-O 3.15Å; Y828-C855 WeakPolarHBondContact O-CB 3.26Å; Y828-L880 HydrophobicContact CE1-CD2 4.14Å; Y828-L880 HydrophobicContact CE2-CD1 4.18Å
829	G	79.3	Confident	71.1	Confident	8 Å²	8	70.4 Å²	70.4	8%	0.082	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	166.6	-179.4	0	0	0	0	0	112.8	C826 T845	C826-G829 WeakPolarHBondContact CB-O 3.22Å; G829-T845 CarbonylContact C-O 3.58Å; G829-T845 VanDerWaalsContact CA-O 3.22Å; G829-T845 WeakPolarHBondContact CA-O 3.37Å
830	S	83	Confident	70.2	Confident	58 Å²	58	72.7 Å²	72.7	41%	0.406	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	147.9	172.5	-71.7	0	0	0	0	112.1	D822 C844 T845	D822-S830 WeakPolarHBondContact OD1-CA 3.09Å; D822-S830 WeakPolarHBondContact OD2-CA 3.07Å; D822-S830 VanDerWaalsContact OD2-CB 3.23Å; D822-S830 WeakPolarHBondContact OD2-CB 3.46Å; D822-S830 PolarHBondContact OD2-OG 2.82Å; S830-C844 WeakPolarHBondContact O-CA 3.4Å; S830-T845 PolarHBondContact N-O 3.5Å; S830-T845 PolarHBondContact O-N 2.95Å; S830-T845 PolarHBondContact O-OG1 2.03Å
831	C	82.3	Confident	69.4	Low	27 Å²	27	77.7 Å²	77.7	18%	0.182	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	154.5	-177.1	89.6	0	0	0	0	112.2	C820 D822 C826	C820-C831 HydrophobicContact CB-CB 3.71Å; C820-C831 WeakPolarHBondContact CB-SG 3.45Å; C820-C831 PolarHBondContact O-SG 3.3Å; C820-C831 WeakPolarHBondContact SG-CB 3.49Å; C820-C831 CovalentContact SG-SG 2.04Å; C820-C831 PolarHBondContact SG-SG 3.35Å; D822-C831 PolarHBondContact OD1-N 2.9Å; C826-C831 HydrophobicContact CB-CB 4.33Å; C826-C831 VanDerWaalsContact SG-CA 3.51Å; C826-C831 WeakPolarHBondContact SG-CB 3.49Å
832	R	81.1	Confident	68.8	Low	147 Å²	147	75.1 Å²	75.1	56%	0.555	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.6	158.3	73.4	-178.2	-160.1	-153.3	2.6	111	C820 V834 L843	C820-R832 VanDerWaalsContact SG-C 3.53Å; R832-V834 HydrophobicContact CG-CG2 4.19Å; R832-L843 HydrophobicContact CG-CB 4.05Å; R832-L843 VanDerWaalsContact CZ-CD2 3.45Å; R832-L843 PolarHBondContact N-O 3.3Å; R832-L843 VanDerWaalsContact NH2-CD2 3.34Å; R832-L843 PolarHBondContact O-N 2.84Å
833	T	72.3	Confident	68.9	Low	44 Å²	44	74.8 Å²	74.8	27%	0.27	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.3	168.6	39.4	0	0	0	0	110.1	R818 C820	R818-T833 WeakPolarHBondContact O-CG2 3.42Å; C820-T833 HydrophobicContact CB-CG2 4.28Å
834	V	66.6	Low	69.7	Low	54 Å²	54	73.3 Å²	73.3	33%	0.327	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	98.7	174.5	-176.1	0	0	0	0	108.6	R832 S836 Q841 L843	R832-V834 HydrophobicContact CG-CG2 4.19Å; V834-S836 PolarHBondContact O-N 2.65Å; V834-S836 VanDerWaalsContact O-N 3.14Å; V834-Q841 WeakPolarHBondContact CB-O 3.47Å; V834-Q841 PolarHBondContact N-O 2.88Å; V834-L843 HydrophobicContact CG2-CB 3.94Å
835	F	62.5	Low	70.3	Confident	112 Å²	112	71.9 Å²	71.9	49%	0.491	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	107.5	179	-53.7	-65	0	0	0	110.3	Q817	Q817-F835 VanDerWaalsContact CD-CE1 3.46Å; Q817-F835 HydrophobicContact CG-CE1 4.32Å; Q817-F835 VanDerWaalsContact NE2-CZ 3.28Å
836	S	55.5	Low	70.7	Confident	48 Å²	48	73.6 Å²	73.6	34%	0.336	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.5	174	80.1	0	0	0	0	109.4	V834 D838 T839	V834-S836 PolarHBondContact O-N 2.65Å; V834-S836 VanDerWaalsContact O-N 3.14Å; S836-D838 PolarHBondContact O-N 2.84Å; S836-T839 PolarHBondContact O-N 3.02Å; S836-T839 PolarHBondContact OG-O 3.08Å; S836-T839 PolarHBondContact OG-OG1 3.42Å
837	N	48.2	Very low	70.7	Confident	154 Å²	154	78.8 Å²	78.8	82%	0.824	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	-155.7	-81.6	-2.9	0	0	0	117.5
838	D	53.3	Low	70.7	Confident	162 Å²	162	84 Å²	84	87%	0.866	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	-1.5	178.7	-75.9	-66.2	0	0	0	115.1	S836	S836-D838 PolarHBondContact O-N 2.84Å
839	T	50.8	Low	70.5	Confident	73 Å²	73	80.8 Å²	80.8	45%	0.448	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	127.6	175.1	57	0	0	0	0	112.8	S836 Q841	S836-T839 PolarHBondContact O-N 3.02Å; S836-T839 PolarHBondContact OG-O 3.08Å; S836-T839 PolarHBondContact OG-OG1 3.42Å; T839-Q841 PolarHBondContact O-N 3.19Å; T839-Q841 VanDerWaalsContact O-N 3.15Å; T839-Q841 PolarHBondContact OG1-NE2 2.69Å; T839-Q841 VanDerWaalsContact OG1-NE2 3.1Å
840	D	54.7	Low	70.8	Confident	105 Å²	105	81.7 Å²	81.7	56%	0.561	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	102.3	167	-76.6	0.4	0	0	0	109.1	R818	R818-D840 PolarHBondContact N-OD2 2.75Å
841	Q	59.8	Low	70.9	Confident	115 Å²	115	85 Å²	85	54%	0.537	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.5	176	-65.9	-173.2	13.2	0	0	110.4	V834 T839	V834-Q841 WeakPolarHBondContact CB-O 3.47Å; V834-Q841 PolarHBondContact N-O 2.88Å; T839-Q841 PolarHBondContact O-N 3.19Å; T839-Q841 VanDerWaalsContact O-N 3.15Å; T839-Q841 PolarHBondContact OG1-NE2 2.69Å; T839-Q841 VanDerWaalsContact OG1-NE2 3.1Å
842	S	62.9	Low	70.9	Confident	43 Å²	43	85.1 Å²	85.1	30%	0.301	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.6	166.8	-59.2	0	0	0	0	108.2	C820	C820-S842 WeakPolarHBondContact CB-OG 3.49Å
843	L	78.8	Confident	70.9	Confident	81 Å²	81	83.4 Å²	83.4	42%	0.424	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.7	170.6	-174.4	77.3	0	0	0	109.2	R832 V834	R832-L843 HydrophobicContact CG-CB 4.05Å; R832-L843 VanDerWaalsContact CZ-CD2 3.45Å; R832-L843 PolarHBondContact N-O 3.3Å; R832-L843 VanDerWaalsContact NH2-CD2 3.34Å; R832-L843 PolarHBondContact O-N 2.84Å; V834-L843 HydrophobicContact CG2-CB 3.94Å
844	C	83	Confident	71.4	Confident	21 Å²	21	84.5 Å²	84.5	14%	0.142	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.7	175.8	-58	0	0	0	0	112.2	C826 S830 T853 C855	C826-C844 WeakPolarHBondContact CA-SG 3.47Å; C826-C844 HydrophobicContact CB-CB 3.71Å; C826-C844 WeakPolarHBondContact CB-SG 3.39Å; C826-C844 WeakPolarHBondContact SG-CA 3.04Å; C826-C844 WeakPolarHBondContact SG-CB 3.48Å; C826-C844 CovalentContact SG-SG 2.02Å; C826-C844 PolarHBondContact SG-SG 3.31Å; S830-C844 WeakPolarHBondContact O-CA 3.4Å; C844-T853 PolarHBondContact SG-O 3.24Å; C844-T853 VanDerWaalsContact SG-O 3.42Å; C844-C855 WeakPolarHBondContact CB-SG 3.49Å
845	T	85.7	Confident	72.2	Confident	84 Å²	84	81.9 Å²	81.9	52%	0.515	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	106.1	161.6	50.2	0	0	0	0	107.8	G829 S830	G829-T845 CarbonylContact C-O 3.58Å; G829-T845 VanDerWaalsContact CA-O 3.22Å; G829-T845 WeakPolarHBondContact CA-O 3.37Å; S830-T845 PolarHBondContact N-O 3.5Å; S830-T845 PolarHBondContact O-N 2.95Å; S830-T845 PolarHBondContact O-OG1 2.03Å
846	C	84	Confident	73.1	Confident	51 Å²	51	80.1 Å²	80.1	35%	0.345	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	151.3	-175.3	-51.9	0	0	0	0	112.3	F850 C855	C846-F850 HydrophobicContact CB-CB 4.21Å; C846-F850 WeakPolarHBondContact CB-O 3.25Å; C846-C855 WeakPolarHBondContact CA-SG 3.34Å; C846-C855 HydrophobicContact CB-CB 3.71Å; C846-C855 WeakPolarHBondContact CB-SG 2.75Å; C846-C855 PolarHBondContact N-SG 3.3Å; C846-C855 VanDerWaalsContact N-SG 3.4Å; C846-C855 WeakPolarHBondContact SG-CA 3.4Å; C846-C855 WeakPolarHBondContact SG-CB 3.39Å; C846-C855 CovalentContact SG-SG 2.03Å; C846-C855 PolarHBondContact SG-SG 3.35Å
847	L	80.7	Confident	74.4	Confident	109 Å²	109	80.7 Å²	80.7	57%	0.571	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-65.5	158.2	163.4	-64.3	170	0	0	0	109.5	Y828 F850	Y828-L847 PolarHBondContact O-N 3.22Å; L847-F850 HydrophobicContact CB-CD2 3.88Å; L847-F850 HydrophobicContact CB-CE2 4.36Å; L847-F850 PolarHBondContact O-N 3.16Å
848	E	79.6	Confident	76.1	Confident	188 Å²	188	75.5 Å²	75.5	88%	0.879	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	145.3	168.9	-62.4	-169.3	150.7	0	0	109.7	F850	E848-F850 WeakPolarHBondContact O-CD2 3.36Å
849	G	76.4	Confident	77.3	Confident	12 Å²	12	70.2 Å²	70.2	12%	0.124	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	-0.4	-170.4	0	0	0	0	0	115.6	V859	G849-V859 WeakPolarHBondContact O-CB 3.32Å; G849-V859 WeakPolarHBondContact O-CG2 3.38Å; G849-V859 PolarHBondContact O-N 2.83Å
850	F	85.5	Confident	78.5	Confident	27 Å²	27	69.4 Å²	69.4	12%	0.118	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.6	-177.5	-60.4	-82.5	0	0	0	115.2	Y828 C846 L847 E848 N857 L880	Y828-F850 VanDerWaalsContact CB-CD1 3.46Å; Y828-F850 AromaticContact CD1-CE1 4Å; Y828-F850 HydrophobicContact CD1-CE1 4Å; Y828-F850 HydrophobicContact CD1-CE2 4.45Å; Y828-F850 AromaticContact CD1-CZ 3.88Å; Y828-F850 HydrophobicContact CD1-CZ 3.88Å; Y828-F850 AromaticContact CD2-CD1 3.39Å; Y828-F850 HydrophobicContact CD2-CD1 3.39Å; Y828-F850 AromaticContact CD2-CE1 3.25Å; Y828-F850 HydrophobicContact CD2-CE1 3.25Å; Y828-F850 HydrophobicContact CD2-CG 4.22Å; Y828-F850 AromaticContact CD2-CZ 4Å; Y828-F850 HydrophobicContact CD2-CZ 4Å; Y828-F850 HydrophobicContact CE2-CD1 4.33Å; Y828-F850 AromaticContact CE2-CE1 3.89Å; Y828-F850 HydrophobicContact CE2-CE1 3.89Å; Y828-F850 AromaticContact CG-CD1 3.58Å; Y828-F850 HydrophobicContact CG-CD1 3.58Å; Y828-F850 HydrophobicContact CG-CD2 4.29Å; Y828-F850 AromaticContact CG-CE1 3.33Å; Y828-F850 HydrophobicContact CG-CE1 3.33Å; Y828-F850 HydrophobicContact CG-CE2 4.08Å; Y828-F850 HydrophobicContact CG-CG 4.04Å; Y828-F850 AromaticContact CG-CZ 3.58Å; Y828-F850 HydrophobicContact CG-CZ 3.58Å; C846-F850 HydrophobicContact CB-CB 4.21Å; C846-F850 WeakPolarHBondContact CB-O 3.25Å; L847-F850 HydrophobicContact CB-CD2 3.88Å; L847-F850 HydrophobicContact CB-CE2 4.36Å; L847-F850 PolarHBondContact O-N 3.16Å; E848-F850 WeakPolarHBondContact O-CD2 3.36Å; F850-N857 WeakPolarHBondContact CA-O 3.46Å; F850-L880 HydrophobicContact CE1-CD1 3.8Å; F850-L880 HydrophobicContact CE1-CG 3.96Å; F850-L880 HydrophobicContact CZ-CD1 4.41Å; F850-L880 HydrophobicContact CZ-CG 4.06Å
851	Y	84.7	Confident	79.7	Confident	128 Å²	128	66.6 Å²	66.6	50%	0.502	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	179.4	177.4	80	-78.4	0	0	0	113.5	C855 Q856 N857 D858 V859	Y851-C855 CarbonylContact O-C 3.28Å; Y851-C855 WeakPolarHBondContact O-CA 3.49Å; Y851-Q856 PolarHBondContact O-N 2.79Å; Y851-N857 HydrophobicContact CD1-CB 3.53Å; Y851-N857 HydrophobicContact CD2-CB 4.08Å; Y851-N857 HydrophobicContact CE1-CB 3.32Å; Y851-N857 HydrophobicContact CE2-CB 3.89Å; Y851-N857 VanDerWaalsContact CE2-ND2 3.32Å; Y851-N857 WeakPolarHBondContact CE2-ND2 3.48Å; Y851-N857 HydrophobicContact CG-CB 3.92Å; Y851-N857 PolarHBondContact N-O 3.37Å; Y851-N857 WeakPolarHBondContact O-CB 3.41Å; Y851-N857 PolarHBondContact O-N 2.78Å; Y851-D858 WeakPolarHBondContact CE1-O 3.49Å; Y851-V859 HydrophobicContact CD1-CB 4.5Å; Y851-V859 HydrophobicContact CD1-CG2 3.64Å; Y851-V859 HydrophobicContact CG-CG2 4.31Å
852	G	82.4	Confident	80.7	Confident	30 Å²	30	62.5 Å²	62.5	31%	0.309	34%	0.342	S	S	.	.	S	Bend	trans	97	165.4	-175.2	0	0	0	0	0	112.7	N854 C855	G852-N854 PolarHBondContact O-N 2.96Å; G852-C855 PolarHBondContact O-N 3.25Å
853	T	81.1	Confident	81.1	Confident	110 Å²	110	66.5 Å²	66.5	68%	0.675	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.5	-175.4	48.4	0	0	0	0	114	C844	C844-T853 PolarHBondContact SG-O 3.24Å; C844-T853 VanDerWaalsContact SG-O 3.42Å
854	N	82.3	Confident	80.1	Confident	67 Å²	67	65.7 Å²	65.7	36%	0.358	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	15.6	-176.2	-63	70.6	0	0	0	110.8	D825 C826 I827 G852 Q856	D825-N854 WeakPolarHBondContact O-CB 3.33Å; D825-N854 PolarHBondContact O-ND2 2.04Å; C826-N854 CarbonylContact C-O 3.49Å; C826-N854 WeakPolarHBondContact CA-O 3.33Å; I827-N854 PolarHBondContact N-O 3.17Å; G852-N854 PolarHBondContact O-N 2.96Å; N854-Q856 HydrophobicContact CB-CB 4.42Å; N854-Q856 PolarHBondContact O-N 2.84Å
855	C	84.4	Confident	78.5	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.391	C	S	.	.	S	Bend	trans	49.6	44.9	-172.4	-49.7	0	0	0	0	112.1	Y828 C844 C846 Y851 G852	Y828-C855 VanDerWaalsContact CD2-O 3.28Å; Y828-C855 WeakPolarHBondContact CD2-O 3.41Å; Y828-C855 PolarHBondContact N-O 2.93Å; Y828-C855 VanDerWaalsContact N-O 3.15Å; Y828-C855 WeakPolarHBondContact O-CB 3.26Å; C844-C855 WeakPolarHBondContact CB-SG 3.49Å; C846-C855 WeakPolarHBondContact CA-SG 3.34Å; C846-C855 HydrophobicContact CB-CB 3.71Å; C846-C855 WeakPolarHBondContact CB-SG 2.75Å; C846-C855 PolarHBondContact N-SG 3.3Å; C846-C855 VanDerWaalsContact N-SG 3.4Å; C846-C855 WeakPolarHBondContact SG-CA 3.4Å; C846-C855 WeakPolarHBondContact SG-CB 3.39Å; C846-C855 CovalentContact SG-SG 2.03Å; C846-C855 PolarHBondContact SG-SG 3.35Å; Y851-C855 CarbonylContact O-C 3.28Å; Y851-C855 WeakPolarHBondContact O-CA 3.49Å; G852-C855 PolarHBondContact O-N 3.25Å
856	Q	81.6	Confident	76.8	Confident	74 Å²	74	76.8 Å²	76.8	35%	0.346	41%	0.405	S	S	.	.			trans	-100.4	-13.3	-173	77.3	-80.2	18.8	0	0	113.6	I827 Y851 N854	I827-Q856 HydrophobicContact CD1-CB 3.67Å; I827-Q856 HydrophobicContact CG1-CB 4.31Å; Y851-Q856 PolarHBondContact O-N 2.79Å; N854-Q856 HydrophobicContact CB-CB 4.42Å; N854-Q856 PolarHBondContact O-N 2.84Å
857	N	82.8	Confident	75.2	Confident	60 Å²	60	77.6 Å²	77.6	32%	0.321	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	138.5	179.6	-57.1	-24.7	0	0	0	110	F850 Y851	F850-N857 WeakPolarHBondContact CA-O 3.46Å; Y851-N857 HydrophobicContact CD1-CB 3.53Å; Y851-N857 HydrophobicContact CD2-CB 4.08Å; Y851-N857 HydrophobicContact CE1-CB 3.32Å; Y851-N857 HydrophobicContact CE2-CB 3.89Å; Y851-N857 VanDerWaalsContact CE2-ND2 3.32Å; Y851-N857 WeakPolarHBondContact CE2-ND2 3.48Å; Y851-N857 HydrophobicContact CG-CB 3.92Å; Y851-N857 PolarHBondContact N-O 3.37Å; Y851-N857 WeakPolarHBondContact O-CB 3.41Å; Y851-N857 PolarHBondContact O-N 2.78Å
858	D	83.1	Confident	73.8	Confident	45 Å²	45	79.8 Å²	79.8	24%	0.241	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.1	176.4	-173	54.8	0	0	0	110.6	Y851 N860 N878 L880 G881	Y851-D858 WeakPolarHBondContact CE1-O 3.49Å; D858-N860 PolarHBondContact O-N 3.37Å; D858-N878 PolarHBondContact OD2-ND2 3.06Å; D858-L880 HydrophobicContact CB-CD1 4.32Å; D858-L880 WeakPolarHBondContact OD1-CA 3.39Å; D858-G881 PolarHBondContact OD1-N 2.66Å
859	V	79	Confident	72.6	Confident	51 Å²	51	77.6 Å²	77.6	31%	0.309	42%	0.416	S	S	.	.			trans	-76.4	108.5	177.6	177	0	0	0	0	108.3	G849 Y851 E861	G849-V859 WeakPolarHBondContact O-CB 3.32Å; G849-V859 WeakPolarHBondContact O-CG2 3.38Å; G849-V859 PolarHBondContact O-N 2.83Å; Y851-V859 HydrophobicContact CD1-CB 4.5Å; Y851-V859 HydrophobicContact CD1-CG2 3.64Å; Y851-V859 HydrophobicContact CG-CG2 4.31Å; V859-E861 HydrophobicContact CG1-CG 4.29Å; V859-E861 VanDerWaalsContact O-CD 3.27Å; V859-E861 PolarHBondContact O-N 3.45Å
860	N	76.1	Confident	72.2	Confident	56 Å²	56	78.9 Å²	78.9	30%	0.299	42%	0.419	S	S	.	.			trans	-79.5	91	-177.8	-168.5	-51.4	0	0	0	112.1	D858 C862 L863 N878	D858-N860 PolarHBondContact O-N 3.37Å; N860-C862 PolarHBondContact O-N 2.81Å; N860-C862 WeakPolarHBondContact OD1-CB 3.21Å; N860-C862 PolarHBondContact OD1-N 3.26Å; N860-L863 HydrophobicContact CB-CB 4.14Å; N860-L863 HydrophobicContact CB-CD1 4.22Å; N860-L863 HydrophobicContact CB-CG 4.35Å; N860-L863 PolarHBondContact O-N 2.04Å; N860-L863 WeakPolarHBondContact OD1-CG 3.37Å; N860-L863 PolarHBondContact OD1-N 3.43Å; N860-N878 WeakPolarHBondContact CA-OD1 3.33Å; N860-N878 VanDerWaalsContact CG-CG 3.41Å; N860-N878 PolarHBondContact ND2-ND2 3.37Å; N860-N878 PolarHBondContact OD1-OD1 2.87Å
861	E	79.9	Confident	71.7	Confident	47 Å²	47	84.5 Å²	84.5	22%	0.22	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.9	-175.9	-56.2	101	164.4	0	0	114	V859 N864 N878 Y883	V859-E861 HydrophobicContact CG1-CG 4.29Å; V859-E861 VanDerWaalsContact O-CD 3.27Å; V859-E861 PolarHBondContact O-N 3.45Å; E861-N864 PolarHBondContact O-ND2 2.95Å; E861-N878 PolarHBondContact N-OD1 2.95Å; E861-Y883 HydrophobicContact CB-CD1 3.45Å; E861-Y883 VanDerWaalsContact CB-CD1 3.45Å; E861-Y883 HydrophobicContact CB-CE1 4.03Å; E861-Y883 HydrophobicContact CB-CG 4.01Å; E861-Y883 HydrophobicContact CG-CD1 3.82Å; E861-Y883 HydrophobicContact CG-CE1 4.29Å; E861-Y883 WeakPolarHBondContact OE2-CD1 3.24Å; E861-Y883 PolarHBondContact OE2-N 2.88Å
862	C	81.1	Confident	71.5	Confident	28 Å²	28	78.5 Å²	78.5	19%	0.189	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-29	168.6	-54.4	0	0	0	0	112	N860 N864 C876 I877	N860-C862 PolarHBondContact O-N 2.81Å; N860-C862 WeakPolarHBondContact OD1-CB 3.21Å; N860-C862 PolarHBondContact OD1-N 3.26Å; C862-N864 PolarHBondContact O-N 3.45Å; C862-N864 PolarHBondContact O-ND2 2.88Å; C862-C876 WeakPolarHBondContact CA-SG 3.46Å; C862-C876 HydrophobicContact CB-CB 3.88Å; C862-C876 WeakPolarHBondContact CB-SG 3.41Å; C862-C876 WeakPolarHBondContact SG-CB 3.24Å; C862-C876 CovalentContact SG-SG 2.05Å; C862-C876 PolarHBondContact SG-SG 3.05Å; C862-I877 VanDerWaalsContact SG-C 3.59Å
863	L	71	Confident	71.4	Confident	127 Å²	127	81.1 Å²	81.1	67%	0.665	42%	0.424	S	S	*	.	S	Bend	trans	-93.3	82.8	-179.5	-69.5	179.5	0	0	0	112.4	N860 E865	N860-L863 HydrophobicContact CB-CB 4.14Å; N860-L863 HydrophobicContact CB-CD1 4.22Å; N860-L863 HydrophobicContact CB-CG 4.35Å; N860-L863 PolarHBondContact O-N 2.04Å; N860-L863 WeakPolarHBondContact OD1-CG 3.37Å; N860-L863 PolarHBondContact OD1-N 3.43Å; L863-E865 PolarHBondContact O-N 3.42Å; L863-E865 VanDerWaalsContact O-N 3.1Å
864	N	58.2	Low	71.5	Confident	65 Å²	65	78 Å²	78	35%	0.348	40%	0.402	S	S	.	.			trans	-80.1	94.1	-170.4	-73	-83.8	0	0	0	113.6	E861 C862 N866 G867 Q868	E861-N864 PolarHBondContact O-ND2 2.95Å; C862-N864 PolarHBondContact O-N 3.45Å; C862-N864 PolarHBondContact O-ND2 2.88Å; N864-N866 PolarHBondContact O-N 3.09Å; N864-G867 PolarHBondContact O-N 3.26Å; N864-Q868 WeakPolarHBondContact CB-O 3.34Å; N864-Q868 PolarHBondContact OD1-O 2.84Å
865	E	48.4	Very low	71.5	Confident	190 Å²	190	78.8 Å²	78.8	89%	0.888	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.3	179	-66.3	-159.9	131.9	0	0	115.3	L863	L863-E865 PolarHBondContact O-N 3.42Å; L863-E865 VanDerWaalsContact O-N 3.1Å
866	N	49.7	Very low	71.4	Confident	148 Å²	148	80 Å²	80	79%	0.791	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	11.8	178.6	-72.6	-80.4	0	0	0	114.4	N864 Q868	N864-N866 PolarHBondContact O-N 3.09Å; N866-Q868 VanDerWaalsContact C-N 3.25Å; N866-Q868 PolarHBondContact O-N 2.81Å
867	G	51.3	Low	71.4	Confident	67 Å²	67	80.8 Å²	80.8	69%	0.691	42%	0.417	S	S	*	.			trans	69.6	10.1	172.6	0	0	0	0	0	116.6	N864 K869	N864-G867 PolarHBondContact O-N 3.26Å; G867-K869 PolarHBondContact O-N 2.84Å
868	Q	51.4	Low	71.1	Confident	155 Å²	155	80 Å²	80	72%	0.724	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-68.2	121.8	160.7	-67.6	-178.4	-64.6	0	0	107.5	N864 N866	N864-Q868 WeakPolarHBondContact CB-O 3.34Å; N864-Q868 PolarHBondContact OD1-O 2.84Å; N866-Q868 VanDerWaalsContact C-N 3.25Å; N866-Q868 PolarHBondContact O-N 2.81Å
869	K	53.4	Low	70.8	Confident	142 Å²	142	79.7 Å²	79.7	62%	0.617	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-63.9	140.6	178.9	-161.4	-165.3	-178.3	-152.9	0	109.4	G867 E873	G867-K869 PolarHBondContact O-N 2.84Å; K869-E873 PolarHBondContact NZ-O 2.93Å
870	H	68.6	Low	70.7	Confident	39 Å²	39	82.5 Å²	82.5	18%	0.181	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-49.6	148.5	169.4	55	57.5	0	0	0	111.4	C872 C876	H870-C872 PolarHBondContact CE1-O 2.57Å; H870-C872 VanDerWaalsContact CE1-O 3.29Å; H870-C872 PolarHBondContact ND1-O 2.92Å; H870-C872 PolarHBondContact O-N 2.77Å; H870-C872 VanDerWaalsContact O-N 3.11Å; H870-C876 HydrophobicContact CB-CB 4.15Å; H870-C876 WeakPolarHBondContact CD2-CB 3.22Å
871	F	75.7	Confident	70.6	Confident	145 Å²	145	80.6 Å²	80.6	64%	0.636	42%	0.419	S	S	*	.	S	Bend	trans	-69.5	-9.8	-175.5	-66.1	-83.2	0	0	0	114.4	Y883 R898	F871-Y883 HydrophobicContact CB-CE2 4.45Å; F871-Y883 WeakPolarHBondContact CD2-OH 3.26Å; F871-R898 HydrophobicContact CB-CG 4.36Å
872	C	79.7	Confident	70.4	Confident	2 Å²	2	81.2 Å²	81.2	1%	0.014	43%	0.428	C	S	.	.			trans	-67.4	134	171.3	-48.8	0	0	0	0	111.9	H870 H875 C876 C885	H870-C872 PolarHBondContact CE1-O 2.57Å; H870-C872 VanDerWaalsContact CE1-O 3.29Å; H870-C872 PolarHBondContact ND1-O 2.92Å; H870-C872 PolarHBondContact O-N 2.77Å; H870-C872 VanDerWaalsContact O-N 3.11Å; C872-H875 WeakPolarHBondContact CB-O 3.02Å; C872-C876 HydrophobicContact CB-CB 4.23Å; C872-C885 WeakPolarHBondContact CA-SG 3.36Å; C872-C885 HydrophobicContact CB-CB 3.5Å; C872-C885 WeakPolarHBondContact CB-SG 3.39Å; C872-C885 WeakPolarHBondContact SG-CA 3.25Å; C872-C885 WeakPolarHBondContact SG-CB 3.32Å; C872-C885 CovalentContact SG-SG 2.03Å; C872-C885 PolarHBondContact SG-SG 2.97Å
873	E	81.2	Confident	70.4	Confident	86 Å²	86	81.7 Å²	81.7	40%	0.402	43%	0.427	S	S	.	.	S	Bend	trans	-66.8	-51.7	178.8	-168.5	169	168.6	0	0	111.5	K869 R898 T899 C900	K869-E873 PolarHBondContact NZ-O 2.93Å; E873-R898 PolarHBondContact N-O 2.72Å; E873-T899 VanDerWaalsContact OE2-CA 3.24Å; E873-T899 WeakPolarHBondContact OE2-CA 3.02Å; E873-T899 WeakPolarHBondContact OE2-CB 3.31Å; E873-C900 HydrophobicContact CB-CB 4.26Å; E873-C900 PolarHBondContact OE2-N 3.12Å
874	H	83.3	Confident	70.8	Confident	44 Å²	44	80.7 Å²	80.7	20%	0.204	42%	0.418	C	S	.	.	S	Bend	trans	-99.6	-86.3	-177.5	-69.3	-171.3	0	0	0	112.1	F886 D888 Y891	H874-F886 WeakPolarHBondContact CB-O 3.29Å; H874-D888 VanDerWaalsContact CB-OD2 3.29Å; H874-D888 WeakPolarHBondContact CB-OD2 3.44Å; H874-D888 IonicContact CE1-OD2 3.76Å; H874-D888 IonicContact CG-OD2 3.18Å; H874-D888 PolarHBondContact ND1-N 2.91Å; H874-D888 IonicContact ND1-OD2 3.77Å; H874-D888 PolarHBondContact ND1-OD2 2.86Å; H874-D888 VanDerWaalsContact ND1-OD2 3.07Å; H874-Y891 AromaticContact CE1-CD1 3.36Å; H874-Y891 WeakPolarHBondContact CE1-CD1 3.42Å; H874-Y891 AromaticContact CE1-CD2 3.82Å; H874-Y891 AromaticContact CE1-CE1 3.6Å; H874-Y891 AromaticContact CE1-CG 3.5Å; H874-Y891 AromaticContact CE1-CZ 3.96Å; H874-Y891 AromaticContact NE2-CD1 3.95Å; H874-Y891 AromaticContact NE2-CE1 3.9Å
875	H	81	Confident	72.1	Confident	84 Å²	84	78 Å²	78	39%	0.389	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	146.6	-176.7	-48.7	-29.2	0	0	0	112.2	C872 C885 F886 D888	C872-H875 WeakPolarHBondContact CB-O 3.02Å; H875-C885 WeakPolarHBondContact O-CA 2.84Å; H875-F886 HydrophobicContact CB-CB 4.26Å; H875-F886 WeakPolarHBondContact CB-O 3.28Å; H875-F886 PolarHBondContact N-O 3.4Å; H875-F886 PolarHBondContact O-N 2.99Å; H875-D888 IonicContact CE1-OD1 2.59Å; H875-D888 PolarHBondContact CE1-OD1 3.41Å; H875-D888 IonicContact CE1-OD2 2.74Å; H875-D888 PolarHBondContact CE1-OD2 3.26Å; H875-D888 VanDerWaalsContact CE1-OD2 3.3Å; H875-D888 IonicContact ND1-OD2 2.71Å; H875-D888 IonicContact NE2-OD1 3.64Å; H875-D888 IonicContact NE2-OD2 2.81Å
876	C	84	Confident	73.7	Confident	24 Å²	24	73 Å²	73	16%	0.162	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.2	171.6	-176	0	0	0	0	108.5	C862 H870 C872	C862-C876 WeakPolarHBondContact CA-SG 3.46Å; C862-C876 HydrophobicContact CB-CB 3.88Å; C862-C876 WeakPolarHBondContact CB-SG 3.41Å; C862-C876 WeakPolarHBondContact SG-CB 3.24Å; C862-C876 CovalentContact SG-SG 2.05Å; C862-C876 PolarHBondContact SG-SG 3.05Å; H870-C876 HydrophobicContact CB-CB 4.15Å; H870-C876 WeakPolarHBondContact CD2-CB 3.22Å; C872-C876 HydrophobicContact CB-CB 4.23Å
877	I	80	Confident	75.3	Confident	91 Å²	91	67.2 Å²	67.2	47%	0.467	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.6	170.3	-62	-177.7	0	0	0	107.9	C862 Y883 Q884 F886	C862-I877 VanDerWaalsContact SG-C 3.59Å; I877-Y883 WeakPolarHBondContact O-CA 3.23Å; I877-Q884 PolarHBondContact N-O 2.74Å; I877-Q884 PolarHBondContact O-N 3.19Å; I877-F886 HydrophobicContact CB-CD2 4.15Å; I877-F886 HydrophobicContact CB-CE2 3.9Å; I877-F886 HydrophobicContact CD1-CD2 3.67Å; I877-F886 HydrophobicContact CD1-CE2 3.71Å; I877-F886 HydrophobicContact CD1-CG 4.42Å; I877-F886 HydrophobicContact CD1-CZ 4.47Å; I877-F886 HydrophobicContact CG1-CD2 3.83Å; I877-F886 HydrophobicContact CG1-CE2 3.99Å
878	N	78	Confident	76.8	Confident	43 Å²	43	67.2 Å²	67.2	23%	0.23	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	138	179	-163.3	68.8	0	0	0	111.1	D858 N860 E861	D858-N878 PolarHBondContact OD2-ND2 3.06Å; N860-N878 WeakPolarHBondContact CA-OD1 3.33Å; N860-N878 VanDerWaalsContact CG-CG 3.41Å; N860-N878 PolarHBondContact ND2-ND2 3.37Å; N860-N878 PolarHBondContact OD1-OD1 2.87Å; E861-N878 PolarHBondContact N-OD1 2.95Å
879	T	75.9	Confident	77.3	Confident	39 Å²	39	65.1 Å²	65.1	24%	0.239	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	164.5	179.3	62.5	0	0	0	0	110.1	G881 S882 Q884	T879-G881 PolarHBondContact O-N 3.18Å; T879-S882 CarbonylContact C-O 3.53Å; T879-S882 VanDerWaalsContact C-O 3.24Å; T879-S882 VanDerWaalsContact CA-O 3.26Å; T879-S882 WeakPolarHBondContact CA-O 3.45Å; T879-S882 WeakPolarHBondContact CB-O 3.32Å; T879-S882 PolarHBondContact N-O 2.76Å; T879-S882 PolarHBondContact O-N 2.83Å; T879-S882 VanDerWaalsContact O-N 3.17Å; T879-S882 PolarHBondContact OG1-O 2.85Å; T879-Q884 HydrophobicContact CG2-CB 4.38Å; T879-Q884 HydrophobicContact CG2-CG 3.95Å
880	L	77.6	Confident	78	Confident	111 Å²	111	63.8 Å²	63.8	58%	0.581	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	104.8	-173.8	-171.3	68.9	0	0	0	111.1	Y828 F850 D858	Y828-L880 HydrophobicContact CE1-CD2 4.14Å; Y828-L880 HydrophobicContact CE2-CD1 4.18Å; F850-L880 HydrophobicContact CE1-CD1 3.8Å; F850-L880 HydrophobicContact CE1-CG 3.96Å; F850-L880 HydrophobicContact CZ-CD1 4.41Å; F850-L880 HydrophobicContact CZ-CG 4.06Å; D858-L880 HydrophobicContact CB-CD1 4.32Å; D858-L880 WeakPolarHBondContact OD1-CA 3.39Å
881	G	73.1	Confident	78.6	Confident	16 Å²	16	65.5 Å²	65.5	17%	0.165	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	11.3	-176.6	0	0	0	0	0	115.7	D858 T879	D858-G881 PolarHBondContact OD1-N 2.66Å; T879-G881 PolarHBondContact O-N 3.18Å
882	S	76.8	Confident	78.5	Confident	59 Å²	59	63.6 Å²	63.6	41%	0.413	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	-179.9	178.3	-146.2	0	0	0	0	112.5	T879	T879-S882 CarbonylContact C-O 3.53Å; T879-S882 VanDerWaalsContact C-O 3.24Å; T879-S882 VanDerWaalsContact CA-O 3.26Å; T879-S882 WeakPolarHBondContact CA-O 3.45Å; T879-S882 WeakPolarHBondContact CB-O 3.32Å; T879-S882 PolarHBondContact N-O 2.76Å; T879-S882 PolarHBondContact O-N 2.83Å; T879-S882 VanDerWaalsContact O-N 3.17Å; T879-S882 PolarHBondContact OG1-O 2.85Å
883	Y	80.6	Confident	78.5	Confident	39 Å²	39	67.2 Å²	67.2	15%	0.153	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	147.1	171.3	64.8	-75.6	0	0	0	111.3	E861 F871 I877	E861-Y883 HydrophobicContact CB-CD1 3.45Å; E861-Y883 VanDerWaalsContact CB-CD1 3.45Å; E861-Y883 HydrophobicContact CB-CE1 4.03Å; E861-Y883 HydrophobicContact CB-CG 4.01Å; E861-Y883 HydrophobicContact CG-CD1 3.82Å; E861-Y883 HydrophobicContact CG-CE1 4.29Å; E861-Y883 WeakPolarHBondContact OE2-CD1 3.24Å; E861-Y883 PolarHBondContact OE2-N 2.88Å; F871-Y883 HydrophobicContact CB-CE2 4.45Å; F871-Y883 WeakPolarHBondContact CD2-OH 3.26Å; I877-Y883 WeakPolarHBondContact O-CA 3.23Å
884	Q	80	Confident	78.6	Confident	105 Å²	105	66.9 Å²	66.9	49%	0.491	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135	176.8	-70.4	-176	1.7	0	0	110.5	I877 T879 F886	I877-Q884 PolarHBondContact N-O 2.74Å; I877-Q884 PolarHBondContact O-N 3.19Å; T879-Q884 HydrophobicContact CG2-CB 4.38Å; T879-Q884 HydrophobicContact CG2-CG 3.95Å; Q884-F886 HydrophobicContact CB-CD2 4.4Å; Q884-F886 HydrophobicContact CB-CE2 3.51Å; Q884-F886 HydrophobicContact CB-CZ 3.99Å
885	C	84.7	Confident	78.3	Confident	8 Å²	8	71.4 Å²	71.4	5%	0.054	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	136.6	177.8	-57	0	0	0	0	111	C872 H875 L893 G897	C872-C885 WeakPolarHBondContact CA-SG 3.36Å; C872-C885 HydrophobicContact CB-CB 3.5Å; C872-C885 WeakPolarHBondContact CB-SG 3.39Å; C872-C885 WeakPolarHBondContact SG-CA 3.25Å; C872-C885 WeakPolarHBondContact SG-CB 3.32Å; C872-C885 CovalentContact SG-SG 2.03Å; C872-C885 PolarHBondContact SG-SG 2.97Å; H875-C885 WeakPolarHBondContact O-CA 2.84Å; C885-L893 HydrophobicContact CB-CD1 3.93Å; C885-L893 WeakPolarHBondContact O-CD2 3.48Å; C885-G897 VanDerWaalsContact CB-O 3.26Å; C885-G897 WeakPolarHBondContact CB-O 3.4Å; C885-G897 PolarHBondContact SG-O 3.48Å; C885-G897 VanDerWaalsContact SG-O 3.4Å
886	F	82.6	Confident	78.1	Confident	86 Å²	86	70.9 Å²	70.9	38%	0.377	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.9	176.7	-62.3	-93.1	0	0	0	109.8	H874 H875 I877 Q884	H874-F886 WeakPolarHBondContact CB-O 3.29Å; H875-F886 HydrophobicContact CB-CB 4.26Å; H875-F886 WeakPolarHBondContact CB-O 3.28Å; H875-F886 PolarHBondContact N-O 3.4Å; H875-F886 PolarHBondContact O-N 2.99Å; I877-F886 HydrophobicContact CB-CD2 4.15Å; I877-F886 HydrophobicContact CB-CE2 3.9Å; I877-F886 HydrophobicContact CD1-CD2 3.67Å; I877-F886 HydrophobicContact CD1-CE2 3.71Å; I877-F886 HydrophobicContact CD1-CG 4.42Å; I877-F886 HydrophobicContact CD1-CZ 4.47Å; I877-F886 HydrophobicContact CG1-CD2 3.83Å; I877-F886 HydrophobicContact CG1-CE2 3.99Å; Q884-F886 HydrophobicContact CB-CD2 4.4Å; Q884-F886 HydrophobicContact CB-CE2 3.51Å; Q884-F886 HydrophobicContact CB-CZ 3.99Å
887	C	83	Confident	77.7	Confident	27 Å²	27	70.9 Å²	70.9	18%	0.182	39%	0.391	C	S	.	.			trans	-105.3	141.1	-178.9	-55.6	0	0	0	0	111	C900	C887-C900 WeakPolarHBondContact CA-SG 3.22Å; C887-C900 HydrophobicContact CB-CB 3.81Å; C887-C900 WeakPolarHBondContact CB-SG 3.43Å; C887-C900 WeakPolarHBondContact SG-CA 3.31Å; C887-C900 WeakPolarHBondContact SG-CB 3.31Å; C887-C900 CovalentContact SG-SG 2.04Å; C887-C900 PolarHBondContact SG-SG 2.89Å
888	D	82.1	Confident	77.7	Confident	67 Å²	67	71.5 Å²	71.5	36%	0.358	39%	0.387	S	S	.	.			trans	-45.5	153.4	159.2	-68.2	-90.2	0	0	0	112.2	H874 H875 Y891	H874-D888 VanDerWaalsContact CB-OD2 3.29Å; H874-D888 WeakPolarHBondContact CB-OD2 3.44Å; H874-D888 IonicContact CE1-OD2 3.76Å; H874-D888 IonicContact CG-OD2 3.18Å; H874-D888 PolarHBondContact ND1-N 2.91Å; H874-D888 IonicContact ND1-OD2 3.77Å; H874-D888 PolarHBondContact ND1-OD2 2.86Å; H874-D888 VanDerWaalsContact ND1-OD2 3.07Å; H875-D888 IonicContact CE1-OD1 2.59Å; H875-D888 PolarHBondContact CE1-OD1 3.41Å; H875-D888 IonicContact CE1-OD2 2.74Å; H875-D888 PolarHBondContact CE1-OD2 3.26Å; H875-D888 VanDerWaalsContact CE1-OD2 3.3Å; H875-D888 IonicContact ND1-OD2 2.71Å; H875-D888 IonicContact NE2-OD1 3.64Å; H875-D888 IonicContact NE2-OD2 2.81Å; D888-Y891 PolarHBondContact O-N 3.04Å
889	P	62.4	Low	78	Confident	110 Å²	110	71.4 Å²	71.4	71%	0.714	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	149.5	172.1	-27.5	35.6	0	0	0	113.5	Y891	P889-Y891 VanDerWaalsContact C-N 3.31Å; P889-Y891 WeakPolarHBondContact O-CD2 3.47Å
890	D	67.7	Low	78.3	Confident	115 Å²	115	69.8 Å²	69.8	62%	0.615	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	8.4	-170.9	-56.2	-33.6	0	0	0	116.4	Q903	D890-Q903 PolarHBondContact O-N 2.96Å
891	Y	81.8	Confident	78.4	Confident	75 Å²	75	70.1 Å²	70.1	29%	0.294	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.7	177.2	-67.2	-116.2	0	0	0	111.9	H874 D888 P889 C900 K901 K902	H874-Y891 AromaticContact CE1-CD1 3.36Å; H874-Y891 WeakPolarHBondContact CE1-CD1 3.42Å; H874-Y891 AromaticContact CE1-CD2 3.82Å; H874-Y891 AromaticContact CE1-CE1 3.6Å; H874-Y891 AromaticContact CE1-CG 3.5Å; H874-Y891 AromaticContact CE1-CZ 3.96Å; H874-Y891 AromaticContact NE2-CD1 3.95Å; H874-Y891 AromaticContact NE2-CE1 3.9Å; D888-Y891 PolarHBondContact O-N 3.04Å; P889-Y891 VanDerWaalsContact C-N 3.31Å; P889-Y891 WeakPolarHBondContact O-CD2 3.47Å; Y891-C900 HydrophobicContact CD1-CB 4.12Å; Y891-C900 WeakPolarHBondContact CD1-O 3.21Å; Y891-K901 WeakPolarHBondContact CA-O 3.04Å; Y891-K902 VanDerWaalsContact CD1-CA 3.45Å; Y891-K902 HydrophobicContact CD1-CB 3.77Å; Y891-K902 HydrophobicContact CD1-CG 4.26Å; Y891-K902 HydrophobicContact CD2-CG 4.29Å; Y891-K902 HydrophobicContact CE1-CB 3.58Å; Y891-K902 HydrophobicContact CE1-CD 4.24Å; Y891-K902 HydrophobicContact CE1-CG 3.96Å; Y891-K902 HydrophobicContact CE2-CB 4.47Å; Y891-K902 HydrophobicContact CE2-CD 4.11Å; Y891-K902 HydrophobicContact CE2-CG 3.96Å; Y891-K902 HydrophobicContact CG-CB 4.31Å; Y891-K902 HydrophobicContact CG-CG 4.41Å; Y891-K902 PolarHBondContact OH-NZ 3.49Å
892	E	72.9	Confident	78.3	Confident	104 Å²	104	74.4 Å²	74.4	49%	0.486	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136	176.1	-67.8	179.1	156.5	0	0	110.5	Q894 C900 K901 Q903	E892-Q894 PolarHBondContact O-N 3.28Å; E892-C900 CarbonylContact O-C 3.55Å; E892-K901 PolarHBondContact N-O 2.67Å; E892-K901 PolarHBondContact O-N 3.21Å; E892-Q903 HydrophobicContact CG-CB 4.34Å; E892-Q903 HydrophobicContact CG-CG 4.33Å; E892-Q903 PolarHBondContact OE1-NE2 2.85Å
893	L	80.5	Confident	77.3	Confident	78 Å²	78	75.6 Å²	75.6	41%	0.408	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.8	174.1	-166.7	73.6	0	0	0	109.7	C885	C885-L893 HydrophobicContact CB-CD1 3.93Å; C885-L893 WeakPolarHBondContact O-CD2 3.48Å
894	Q	82	Confident	76	Confident	80 Å²	80	82.3 Å²	82.3	37%	0.374	42%	0.419	S	S	.	.			trans	-76.4	170.3	180	-62.8	-162.7	82.6	0	0	112.1	E892 D896 G897 T899 K901	E892-Q894 PolarHBondContact O-N 3.28Å; Q894-D896 PolarHBondContact O-N 2.81Å; Q894-G897 PolarHBondContact O-N 2.92Å; Q894-T899 WeakPolarHBondContact CB-OG1 3.36Å; Q894-T899 PolarHBondContact N-O 3.44Å; Q894-T899 PolarHBondContact NE2-OG1 3.24Å; Q894-K901 HydrophobicContact CG-CB 3.62Å
895	S	77.2	Confident	74.2	Confident	138 Å²	138	83.6 Å²	83.6	97%	0.965	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-5.2	179.5	55.8	0	0	0	0	114.8	G897	S895-G897 VanDerWaalsContact C-N 3.32Å
896	D	77.6	Confident	72.1	Confident	74 Å²	74	86.5 Å²	86.5	40%	0.396	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-6	170.4	67.5	-1	0	0	0	113.2	Q894 R898 T899	Q894-D896 PolarHBondContact O-N 2.81Å; D896-R898 WeakPolarHBondContact O-CG 3.45Å; D896-R898 PolarHBondContact O-N 3.44Å; D896-R898 PolarHBondContact OD1-N 3.27Å; D896-T899 VanDerWaalsContact CG-OG1 3.25Å; D896-T899 PolarHBondContact OD1-N 3.01Å; D896-T899 PolarHBondContact OD1-OG1 3.39Å; D896-T899 WeakPolarHBondContact OD2-CB 3.46Å; D896-T899 VanDerWaalsContact OD2-CG2 3.28Å; D896-T899 WeakPolarHBondContact OD2-CG2 3.04Å; D896-T899 PolarHBondContact OD2-N 2.8Å; D896-T899 PolarHBondContact OD2-OG1 2.77Å
897	G	74.6	Confident	70.1	Confident	24 Å²	24	89.4 Å²	89.4	25%	0.247	47%	0.468	C	S	.	.	S	Bend	trans	64.7	16.9	-176.8	0	0	0	0	0	114.4	C885 Q894 S895	C885-G897 VanDerWaalsContact CB-O 3.26Å; C885-G897 WeakPolarHBondContact CB-O 3.4Å; C885-G897 PolarHBondContact SG-O 3.48Å; C885-G897 VanDerWaalsContact SG-O 3.4Å; Q894-G897 PolarHBondContact O-N 2.92Å; S895-G897 VanDerWaalsContact C-N 3.32Å
898	R	80.2	Confident	68	Low	103 Å²	103	92.1 Å²	92.1	39%	0.389	48%	0.479	S	S	.	.	S	Bend	trans	-138.2	-42.7	-166.9	-71.4	169.6	-174.1	-143.2	2.2	114	F871 E873 D896	F871-R898 HydrophobicContact CB-CG 4.36Å; E873-R898 PolarHBondContact N-O 2.72Å; D896-R898 WeakPolarHBondContact O-CG 3.45Å; D896-R898 PolarHBondContact O-N 3.44Å; D896-R898 PolarHBondContact OD1-N 3.27Å
899	T	83.9	Confident	66.4	Low	41 Å²	41	97.2 Å²	97.2	25%	0.252	50%	0.498	S	S	.	.			trans	-93.6	151.9	-179.3	56	0	0	0	0	112.1	E873 Q894 D896	E873-T899 VanDerWaalsContact OE2-CA 3.24Å; E873-T899 WeakPolarHBondContact OE2-CA 3.02Å; E873-T899 WeakPolarHBondContact OE2-CB 3.31Å; Q894-T899 WeakPolarHBondContact CB-OG1 3.36Å; Q894-T899 PolarHBondContact N-O 3.44Å; Q894-T899 PolarHBondContact NE2-OG1 3.24Å; D896-T899 VanDerWaalsContact CG-OG1 3.25Å; D896-T899 PolarHBondContact OD1-N 3.01Å; D896-T899 PolarHBondContact OD1-OG1 3.39Å; D896-T899 WeakPolarHBondContact OD2-CB 3.46Å; D896-T899 VanDerWaalsContact OD2-CG2 3.28Å; D896-T899 WeakPolarHBondContact OD2-CG2 3.04Å; D896-T899 PolarHBondContact OD2-N 2.8Å; D896-T899 PolarHBondContact OD2-OG1 2.77Å
900	C	83.8	Confident	65.8	Low	5 Å²	5	95.4 Å²	95.4	3%	0.034	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	102	-173.8	-72.5	0	0	0	0	109	E873 C887 Y891 E892 K902	E873-C900 HydrophobicContact CB-CB 4.26Å; E873-C900 PolarHBondContact OE2-N 3.12Å; C887-C900 WeakPolarHBondContact CA-SG 3.22Å; C887-C900 HydrophobicContact CB-CB 3.81Å; C887-C900 WeakPolarHBondContact CB-SG 3.43Å; C887-C900 WeakPolarHBondContact SG-CA 3.31Å; C887-C900 WeakPolarHBondContact SG-CB 3.31Å; C887-C900 CovalentContact SG-SG 2.04Å; C887-C900 PolarHBondContact SG-SG 2.89Å; Y891-C900 HydrophobicContact CD1-CB 4.12Å; Y891-C900 WeakPolarHBondContact CD1-O 3.21Å; E892-C900 CarbonylContact O-C 3.55Å; C900-K902 PolarHBondContact O-N 3.37Å
901	K	79.8	Confident	65.2	Low	119 Å²	119	90.8 Å²	90.8	52%	0.517	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	117.4	175.6	-172.9	173.6	-176.3	179.6	0	108.9	Y891 E892 Q894 Q903	Y891-K901 WeakPolarHBondContact CA-O 3.04Å; E892-K901 PolarHBondContact N-O 2.67Å; E892-K901 PolarHBondContact O-N 3.21Å; Q894-K901 HydrophobicContact CG-CB 3.62Å; K901-Q903 PolarHBondContact O-N 3.43Å
902	K	70.3	Confident	64.2	Low	105 Å²	105	96.4 Å²	96.4	46%	0.457	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	126.7	170.5	-163.1	167.6	-163.2	134	0	109.2	Y891 C900 F904	Y891-K902 VanDerWaalsContact CD1-CA 3.45Å; Y891-K902 HydrophobicContact CD1-CB 3.77Å; Y891-K902 HydrophobicContact CD1-CG 4.26Å; Y891-K902 HydrophobicContact CD2-CG 4.29Å; Y891-K902 HydrophobicContact CE1-CB 3.58Å; Y891-K902 HydrophobicContact CE1-CD 4.24Å; Y891-K902 HydrophobicContact CE1-CG 3.96Å; Y891-K902 HydrophobicContact CE2-CB 4.47Å; Y891-K902 HydrophobicContact CE2-CD 4.11Å; Y891-K902 HydrophobicContact CE2-CG 3.96Å; Y891-K902 HydrophobicContact CG-CB 4.31Å; Y891-K902 HydrophobicContact CG-CG 4.41Å; Y891-K902 PolarHBondContact OH-NZ 3.49Å; C900-K902 PolarHBondContact O-N 3.37Å; K902-F904 WeakPolarHBondContact O-CD2 3.38Å; K902-F904 PolarHBondContact O-N 3.09Å
903	Q	55.8	Low	63.9	Low	85 Å²	85	97.6 Å²	97.6	40%	0.397	49%	0.494	S	S	.	.			trans	-70.5	95.4	-177.7	-165.6	-167.4	72	0	0	108.3	D890 E892 K901 K905	D890-Q903 PolarHBondContact O-N 2.96Å; E892-Q903 HydrophobicContact CG-CB 4.34Å; E892-Q903 HydrophobicContact CG-CG 4.33Å; E892-Q903 PolarHBondContact OE1-NE2 2.85Å; K901-Q903 PolarHBondContact O-N 3.43Å; Q903-K905 VanDerWaalsContact C-N 3.25Å; Q903-K905 PolarHBondContact O-N 2.85Å
904	F	52.7	Low	63.7	Low	179 Å²	179	95.5 Å²	95.5	79%	0.785	49%	0.485	S	S	*	.			trans	-65.6	90	168.4	-79.7	-89.9	0	0	0	108.5	K902 G906	K902-F904 WeakPolarHBondContact O-CD2 3.38Å; K902-F904 PolarHBondContact O-N 3.09Å; F904-G906 PolarHBondContact O-N 2.55Å
905	K	43.1	Very low	63.4	Low	133 Å²	133	95.5 Å²	95.5	58%	0.578	49%	0.487	S	S	*	.			trans	-58.2	87.3	153.9	-76.8	179.3	176.8	169	0	107.3	Q903 E907 M908	Q903-K905 VanDerWaalsContact C-N 3.25Å; Q903-K905 PolarHBondContact O-N 2.85Å; K905-E907 PolarHBondContact O-N 2.94Å; K905-E907 VanDerWaalsContact O-N 3.09Å; K905-M908 HydrophobicContact CB-CB 4.38Å; K905-M908 HydrophobicContact CD-SD 4.2Å; K905-M908 PolarHBondContact O-N 3.26Å
906	G	40.3	Very low	63.3	Low	68 Å²	68	92.1 Å²	92.1	70%	0.701	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	115.4	-170	0	0	0	0	0	110.4	F904 M908	F904-G906 PolarHBondContact O-N 2.55Å; G906-M908 PolarHBondContact O-N 3.06Å; G906-M908 VanDerWaalsContact O-N 3.11Å
907	E	40.3	Very low	63.1	Low	147 Å²	147	90.9 Å²	90.9	69%	0.687	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	10.3	77.4	-164.3	-67.8	-166	154.1	0	0	113.6	R545 K905 K909	R545-E907 IonicContact NH1-OE1 2.67Å; R545-E907 PolarHBondContact NH1-OE1 3.38Å; K905-E907 PolarHBondContact O-N 2.94Å; K905-E907 VanDerWaalsContact O-N 3.09Å; E907-K909 PolarHBondContact O-N 3.22Å
908	M	39.8	Very low	63.1	Low	84 Å²	84	90.5 Å²	90.5	41%	0.414	46%	0.458	S	S	.	.			trans	-68.1	77.8	171.7	-163	174.6	90	0	0	108.8	K905 G906 C910 G924	K905-M908 HydrophobicContact CB-CB 4.38Å; K905-M908 HydrophobicContact CD-SD 4.2Å; K905-M908 PolarHBondContact O-N 3.26Å; G906-M908 PolarHBondContact O-N 3.06Å; G906-M908 VanDerWaalsContact O-N 3.11Å; M908-C910 PolarHBondContact O-N 2.69Å; M908-G924 WeakPolarHBondContact CE-O 3.47Å
909	K	47.7	Very low	63.2	Low	174 Å²	174	90.2 Å²	90.2	76%	0.757	47%	0.468	S	S	*	.			trans	-41.5	131.1	169.7	-70.1	177.5	178.3	176.9	0	107.2	E907 P911	E907-K909 PolarHBondContact O-N 3.22Å; K909-P911 WeakPolarHBondContact O-CD 3.1Å
910	C	50.3	Low	62.7	Low	73 Å²	73	90.1 Å²	90.1	49%	0.493	47%	0.468	S	S	.	.			trans	-43.3	116.6	174.4	-61.4	0	0	0	0	107.5	M908 E912 C920	M908-C910 PolarHBondContact O-N 2.69Å; C910-E912 PolarHBondContact O-N 2.69Å; C910-C920 HydrophobicContact CB-CB 3.85Å; C910-C920 WeakPolarHBondContact CB-SG 3.28Å; C910-C920 WeakPolarHBondContact SG-CB 3.49Å; C910-C920 CovalentContact SG-SG 2.04Å; C910-C920 PolarHBondContact SG-SG 2.8Å
911	P	53.7	Low	62.3	Low	18 Å²	18	94.3 Å²	94.3	12%	0.117	49%	0.486	C	S	.	.			trans	-55.4	147.8	-176.8	-10.3	13.2	0	0	0	108.5	K909 Y913 C914 Y936	K909-P911 WeakPolarHBondContact O-CD 3.1Å; P911-Y913 HydrophobicContact CB-CD1 4.44Å; P911-Y913 HydrophobicContact CB-CD2 3.41Å; P911-Y913 VanDerWaalsContact CB-CD2 3.41Å; P911-Y913 HydrophobicContact CB-CE1 4.33Å; P911-Y913 HydrophobicContact CB-CE2 3.3Å; P911-Y913 HydrophobicContact CB-CG 3.99Å; P911-Y913 HydrophobicContact CG-CE2 4.41Å; P911-Y913 PolarHBondContact O-N 3.27Å; P911-C914 PolarHBondContact O-N 2.99Å; P911-Y936 HydrophobicContact CB-CD1 4.41Å; P911-Y936 HydrophobicContact CB-CE1 4.15Å; P911-Y936 HydrophobicContact CG-CD1 3.88Å; P911-Y936 HydrophobicContact CG-CE1 3.52Å
912	E	61.6	Low	61.5	Low	193 Å²	193	95.1 Å²	95.1	90%	0.902	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	14.3	180	-158.2	171.3	-157.9	0	0	112.9	C910	C910-E912 PolarHBondContact O-N 2.69Å
913	Y	67	Low	61	Low	128 Å²	128	94.9 Å²	94.9	50%	0.502	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.3	28	-166.1	23.9	-79.9	0	0	0	111.3	P911 L915 Y936	P911-Y913 HydrophobicContact CB-CD1 4.44Å; P911-Y913 HydrophobicContact CB-CD2 3.41Å; P911-Y913 VanDerWaalsContact CB-CD2 3.41Å; P911-Y913 HydrophobicContact CB-CE1 4.33Å; P911-Y913 HydrophobicContact CB-CE2 3.3Å; P911-Y913 HydrophobicContact CB-CG 3.99Å; P911-Y913 HydrophobicContact CG-CE2 4.41Å; P911-Y913 PolarHBondContact O-N 3.27Å; Y913-L915 VanDerWaalsContact C-N 3.32Å; Y913-L915 WeakPolarHBondContact O-CG 3.11Å; Y913-L915 PolarHBondContact O-N 3.03Å; Y913-Y936 HydrophobicContact CD2-CD1 4.48Å; Y913-Y936 HydrophobicContact CD2-CG 4.5Å; Y913-Y936 WeakPolarHBondContact O-CB 3.42Å
914	C	75.1	Confident	61.4	Low	34 Å²	34	91.3 Å²	91.3	23%	0.23	50%	0.5	C	S	.	.			trans	-65.1	98.3	152.9	-76.1	0	0	0	0	107.8	P911 A918 C926	P911-C914 PolarHBondContact O-N 2.99Å; C914-A918 HydrophobicContact CB-CB 4.4Å; C914-C926 VanDerWaalsContact CA-SG 3.51Å; C914-C926 HydrophobicContact CB-CB 3.97Å; C914-C926 WeakPolarHBondContact CB-SG 3.46Å; C914-C926 WeakPolarHBondContact SG-CB 3.43Å; C914-C926 CovalentContact SG-SG 2.05Å; C914-C926 PolarHBondContact SG-SG 3.1Å
915	L	77.5	Confident	62.2	Low	80 Å²	80	87.3 Å²	87.3	42%	0.419	48%	0.484	S	S	.	.			trans	-82.3	172.6	-172.9	-64	-179.2	0	0	0	112.1	Y913 G917 A918 Y936 E938	Y913-L915 VanDerWaalsContact C-N 3.32Å; Y913-L915 WeakPolarHBondContact O-CG 3.11Å; Y913-L915 PolarHBondContact O-N 3.03Å; L915-G917 VanDerWaalsContact C-N 3.25Å; L915-G917 PolarHBondContact O-N 2.04Å; L915-G917 VanDerWaalsContact O-N 3.08Å; L915-A918 VanDerWaalsContact O-CB 3.31Å; L915-A918 WeakPolarHBondContact O-CB 3Å; L915-A918 PolarHBondContact O-N 3.12Å; L915-A918 VanDerWaalsContact O-N 3.1Å; L915-Y936 PolarHBondContact N-O 2.65Å; L915-E938 HydrophobicContact CD1-CB 3.89Å
916	N	73.5	Confident	64	Low	67 Å²	67	81.3 Å²	81.3	36%	0.358	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	36.2	166.1	-59.7	-44.1	0	0	0	115.1	A918 Y932 C937	N916-A918 VanDerWaalsContact C-N 3.29Å; N916-A918 PolarHBondContact O-N 3.43Å; N916-Y932 HydrophobicContact CB-CD1 3.4Å; N916-Y932 VanDerWaalsContact CB-CD1 3.4Å; N916-Y932 HydrophobicContact CB-CD2 3.8Å; N916-Y932 HydrophobicContact CB-CE1 3.49Å; N916-Y932 VanDerWaalsContact CB-CE1 3.49Å; N916-Y932 HydrophobicContact CB-CE2 3.89Å; N916-Y932 HydrophobicContact CB-CG 3.56Å; N916-Y932 VanDerWaalsContact ND2-CD1 3.32Å; N916-Y932 WeakPolarHBondContact ND2-CD1 3.26Å; N916-C937 PolarHBondContact ND2-O 3.48Å
917	G	73.3	Confident	66.1	Low	48 Å²	48	81 Å²	81	50%	0.495	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	15.9	176	0	0	0	0	0	114.9	L915 Q929	L915-G917 VanDerWaalsContact C-N 3.25Å; L915-G917 PolarHBondContact O-N 2.04Å; L915-G917 VanDerWaalsContact O-N 3.08Å; G917-Q929 WeakPolarHBondContact O-CG 3.43Å; G917-Q929 PolarHBondContact O-NE2 3.24Å
918	A	76.2	Confident	68	Low	16 Å²	16	75.8 Å²	75.8	13%	0.132	42%	0.422	C	S	.	.			trans	-64.3	144.5	-179	0	0	0	0	0	113.4	C914 L915 N916 C926 V927 C937	C914-A918 HydrophobicContact CB-CB 4.4Å; L915-A918 VanDerWaalsContact O-CB 3.31Å; L915-A918 WeakPolarHBondContact O-CB 3Å; L915-A918 PolarHBondContact O-N 3.12Å; L915-A918 VanDerWaalsContact O-N 3.1Å; N916-A918 VanDerWaalsContact C-N 3.29Å; N916-A918 PolarHBondContact O-N 3.43Å; A918-C926 HydrophobicContact CB-CB 4.01Å; A918-V927 CarbonylContact C-O 3.5Å; A918-V927 VanDerWaalsContact CA-O 3.22Å; A918-V927 WeakPolarHBondContact CA-O 3.47Å; A918-V927 WeakPolarHBondContact CB-O 3.44Å; A918-C937 HydrophobicContact CB-CB 3.71Å; A918-C937 WeakPolarHBondContact CB-SG 3.32Å
919	T	80.8	Confident	69.7	Low	97 Å²	97	76.6 Å²	76.6	60%	0.595	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.5	-178.5	-51.5	0	0	0	0	110.4	K921 V927	T919-K921 PolarHBondContact O-N 3.13Å; T919-V927 PolarHBondContact N-O 2.91Å; T919-V927 VanDerWaalsContact O-CB 3.29Å; T919-V927 WeakPolarHBondContact O-CB 3.45Å; T919-V927 WeakPolarHBondContact O-CG2 3.06Å; T919-V927 PolarHBondContact O-N 3.44Å
920	C	73.6	Confident	71	Confident	39 Å²	39	74.4 Å²	74.4	26%	0.264	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	122.9	178	-172.2	0	0	0	0	111.3	C910	C910-C920 HydrophobicContact CB-CB 3.85Å; C910-C920 WeakPolarHBondContact CB-SG 3.28Å; C910-C920 WeakPolarHBondContact SG-CB 3.49Å; C910-C920 CovalentContact SG-SG 2.04Å; C910-C920 PolarHBondContact SG-SG 2.8Å
921	K	75.4	Confident	71.7	Confident	93 Å²	93	72.3 Å²	72.3	40%	0.404	42%	0.419	S	S	.	.			trans	-72.5	160.3	167.6	-80.5	158.3	163.2	179.6	0	110.8	T919 T923 G924 E925 V927	T919-K921 PolarHBondContact O-N 3.13Å; K921-T923 VanDerWaalsContact CB-OG1 3.28Å; K921-T923 WeakPolarHBondContact CB-OG1 3.31Å; K921-T923 PolarHBondContact O-N 3.14Å; K921-G924 PolarHBondContact O-N 3.23Å; K921-E925 HydrophobicContact CB-CB 4.35Å; K921-E925 HydrophobicContact CD-CB 3.97Å; K921-E925 HydrophobicContact CD-CG 4.18Å; K921-E925 WeakPolarHBondContact CD-OE2 3.47Å; K921-E925 PolarHBondContact N-O 2.87Å; K921-E925 IonicContact NZ-OE1 3.5Å; K921-E925 PolarHBondContact NZ-OE1 3.04Å; K921-E925 IonicContact NZ-OE2 2.69Å; K921-E925 PolarHBondContact NZ-OE2 3.29Å; K921-V927 HydrophobicContact CD-CG2 3.56Å; K921-V927 HydrophobicContact CG-CG2 3.64Å
922	S	62.8	Low	72.9	Confident	137 Å²	137	74.8 Å²	74.8	96%	0.958	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.1	168.7	49.7	0	0	0	0	114.5
923	T	60.2	Low	73.5	Confident	99 Å²	99	69.1 Å²	69.1	61%	0.607	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.5	173.2	52.6	0	0	0	0	114.3	K921 E925	K921-T923 VanDerWaalsContact CB-OG1 3.28Å; K921-T923 WeakPolarHBondContact CB-OG1 3.31Å; K921-T923 PolarHBondContact O-N 3.14Å; T923-E925 VanDerWaalsContact C-N 3.32Å; T923-E925 WeakPolarHBondContact OG1-CB 3.18Å
924	G	65	Low	73.8	Confident	10 Å²	10	64.4 Å²	64.4	10%	0.103	39%	0.39	C	S	.	.	S	Bend	trans	79.7	12.1	-173	0	0	0	0	0	114.3	M908 K921	M908-G924 WeakPolarHBondContact CE-O 3.47Å; K921-G924 PolarHBondContact O-N 3.23Å
925	E	69.4	Low	74	Confident	95 Å²	95	69.2 Å²	69.2	44%	0.444	41%	0.413	S	S	.	.			trans	-92.6	125.1	179	-175.8	-160.1	147.9	0	0	110.6	K921 T923 V927	K921-E925 HydrophobicContact CB-CB 4.35Å; K921-E925 HydrophobicContact CD-CB 3.97Å; K921-E925 HydrophobicContact CD-CG 4.18Å; K921-E925 WeakPolarHBondContact CD-OE2 3.47Å; K921-E925 PolarHBondContact N-O 2.87Å; K921-E925 IonicContact NZ-OE1 3.5Å; K921-E925 PolarHBondContact NZ-OE1 3.04Å; K921-E925 IonicContact NZ-OE2 2.69Å; K921-E925 PolarHBondContact NZ-OE2 3.29Å; T923-E925 VanDerWaalsContact C-N 3.32Å; T923-E925 WeakPolarHBondContact OG1-CB 3.18Å; E925-V927 PolarHBondContact O-N 2.87Å
926	C	80.7	Confident	74.1	Confident	7 Å²	7	69.8 Å²	69.8	5%	0.047	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	114.9	174.9	-53.9	0	0	0	0	110.3	C914 A918 C928 C937	C914-C926 VanDerWaalsContact CA-SG 3.51Å; C914-C926 HydrophobicContact CB-CB 3.97Å; C914-C926 WeakPolarHBondContact CB-SG 3.46Å; C914-C926 WeakPolarHBondContact SG-CB 3.43Å; C914-C926 CovalentContact SG-SG 2.05Å; C914-C926 PolarHBondContact SG-SG 3.1Å; A918-C926 HydrophobicContact CB-CB 4.01Å; C926-C928 PolarHBondContact O-N 3.01Å; C926-C937 PolarHBondContact O-SG 2.81Å; C926-C937 VanDerWaalsContact O-SG 3.36Å
927	V	83.4	Confident	74.5	Confident	61 Å²	61	66.6 Å²	66.6	37%	0.37	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	103.2	174.2	-179.2	0	0	0	0	109.5	A918 T919 K921 E925	A918-V927 CarbonylContact C-O 3.5Å; A918-V927 VanDerWaalsContact CA-O 3.22Å; A918-V927 WeakPolarHBondContact CA-O 3.47Å; A918-V927 WeakPolarHBondContact CB-O 3.44Å; T919-V927 PolarHBondContact N-O 2.91Å; T919-V927 VanDerWaalsContact O-CB 3.29Å; T919-V927 WeakPolarHBondContact O-CB 3.45Å; T919-V927 WeakPolarHBondContact O-CG2 3.06Å; T919-V927 PolarHBondContact O-N 3.44Å; K921-V927 HydrophobicContact CD-CG2 3.56Å; K921-V927 HydrophobicContact CG-CG2 3.64Å; E925-V927 PolarHBondContact O-N 2.87Å
928	C	79.9	Confident	74.7	Confident	38 Å²	38	67.8 Å²	67.8	26%	0.257	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-66.8	140.8	-176.3	-48.9	0	0	0	0	112.7	C926 Y932 C937	C926-C928 PolarHBondContact O-N 3.01Å; C928-Y932 VanDerWaalsContact CB-O 3.25Å; C928-Y932 WeakPolarHBondContact CB-O 3.3Å; C928-C937 WeakPolarHBondContact CA-SG 3.23Å; C928-C937 HydrophobicContact CB-CB 3.74Å; C928-C937 WeakPolarHBondContact CB-SG 3.06Å; C928-C937 PolarHBondContact N-SG 3.36Å; C928-C937 WeakPolarHBondContact SG-CA 3.46Å; C928-C937 WeakPolarHBondContact SG-CB 3.48Å; C928-C937 CovalentContact SG-SG 2.03Å; C928-C937 PolarHBondContact SG-SG 3.46Å
929	Q	77.2	Confident	74.5	Confident	101 Å²	101	72.3 Å²	72.3	47%	0.472	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68	157.7	170	-61.5	-156.4	12.1	0	0	111	G917 G931 Y932	G917-Q929 WeakPolarHBondContact O-CG 3.43Å; G917-Q929 PolarHBondContact O-NE2 3.24Å; Q929-G931 PolarHBondContact O-N 3.29Å; Q929-Y932 HydrophobicContact CB-CD2 4.31Å; Q929-Y932 PolarHBondContact O-N 2.92Å
930	P	75.1	Confident	73.8	Confident	129 Å²	129	73.4 Å²	73.4	84%	0.838	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	124.7	172.2	-25.2	35	0	0	0	110.7
931	G	65	Low	73.2	Confident	28 Å²	28	75.5 Å²	75.5	29%	0.289	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.3	-3.3	-172.3	0	0	0	0	0	115.3	Q929 I940 K941	Q929-G931 PolarHBondContact O-N 3.29Å; G931-I940 CarbonylContact O-C 3.24Å; G931-I940 WeakPolarHBondContact O-CA 3.46Å; G931-K941 PolarHBondContact O-N 3.01Å
932	Y	78.3	Confident	72.6	Confident	71 Å²	71	73.3 Å²	73.3	28%	0.278	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.3	179.4	-57.1	-82.4	0	0	0	114.2	N916 C928 Q929 K939 I940 K941	N916-Y932 HydrophobicContact CB-CD1 3.4Å; N916-Y932 VanDerWaalsContact CB-CD1 3.4Å; N916-Y932 HydrophobicContact CB-CD2 3.8Å; N916-Y932 HydrophobicContact CB-CE1 3.49Å; N916-Y932 VanDerWaalsContact CB-CE1 3.49Å; N916-Y932 HydrophobicContact CB-CE2 3.89Å; N916-Y932 HydrophobicContact CB-CG 3.56Å; N916-Y932 VanDerWaalsContact ND2-CD1 3.32Å; N916-Y932 WeakPolarHBondContact ND2-CD1 3.26Å; C928-Y932 VanDerWaalsContact CB-O 3.25Å; C928-Y932 WeakPolarHBondContact CB-O 3.3Å; Q929-Y932 HydrophobicContact CB-CD2 4.31Å; Q929-Y932 PolarHBondContact O-N 2.92Å; Y932-K939 CarbonylContact C-O 3.46Å; Y932-K939 VanDerWaalsContact CA-O 3.29Å; Y932-K939 WeakPolarHBondContact CA-O 3.22Å; Y932-I940 HydrophobicContact CD1-CG1 4.02Å; Y932-I940 HydrophobicContact CE1-CG1 3.68Å; Y932-K941 WeakPolarHBondContact O-CD 3.45Å; Y932-K941 WeakPolarHBondContact O-CE 3.38Å; Y932-K941 WeakPolarHBondContact O-CG 3.35Å
933	E	74.1	Confident	72.7	Confident	73 Å²	73	68.4 Å²	68.4	34%	0.341	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-179.1	177.8	66.7	178.1	-147.3	0	0	111.4	C937 E938 K939 K941	E933-C937 CarbonylContact O-C 3.59Å; E933-C937 VanDerWaalsContact O-CA 3.25Å; E933-C937 WeakPolarHBondContact O-CA 3.45Å; E933-E938 PolarHBondContact O-N 2.05Å; E933-K939 HydrophobicContact CG-CB 3.9Å; E933-K939 PolarHBondContact N-O 3.26Å; E933-K939 WeakPolarHBondContact O-CB 3.36Å; E933-K939 PolarHBondContact O-N 2.86Å; E933-K939 VanDerWaalsContact O-O 3.1Å; E933-K941 HydrophobicContact CB-CD 4.46Å; E933-K941 HydrophobicContact CB-CG 3.68Å; E933-K941 HydrophobicContact CG-CG 3.83Å; E933-K941 WeakPolarHBondContact OE2-CG 3.42Å
934	G	72.9	Confident	73.1	Confident	29 Å²	29	64.5 Å²	64.5	30%	0.299	34%	0.339	S	S	.	.	S	Bend	trans	96.6	164.2	-170.1	0	0	0	0	0	112	Y936 C937 E938	G934-Y936 PolarHBondContact O-N 2.03Å; G934-C937 PolarHBondContact O-N 2.71Å; G934-C937 VanDerWaalsContact O-N 3.15Å; G934-E938 VanDerWaalsContact CA-OE1 3.28Å; G934-E938 WeakPolarHBondContact CA-OE1 3.37Å; G934-E938 VanDerWaalsContact CA-OE2 3.31Å; G934-E938 WeakPolarHBondContact CA-OE2 3.5Å
935	I	79	Confident	73.1	Confident	136 Å²	136	66.9 Å²	66.9	70%	0.697	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.6	-171.9	-42.3	178.1	0	0	0	110.9	E938	I935-E938 PolarHBondContact N-OE2 3.49Å; I935-E938 VanDerWaalsContact N-OE2 3.09Å
936	Y	81.2	Confident	72.7	Confident	92 Å²	92	66.5 Å²	66.5	36%	0.361	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	12	179.9	-59.4	-46.1	0	0	0	111.6	P911 Y913 L915 G934 E938	P911-Y936 HydrophobicContact CB-CD1 4.41Å; P911-Y936 HydrophobicContact CB-CE1 4.15Å; P911-Y936 HydrophobicContact CG-CD1 3.88Å; P911-Y936 HydrophobicContact CG-CE1 3.52Å; Y913-Y936 HydrophobicContact CD2-CD1 4.48Å; Y913-Y936 HydrophobicContact CD2-CG 4.5Å; Y913-Y936 WeakPolarHBondContact O-CB 3.42Å; L915-Y936 PolarHBondContact N-O 2.65Å; G934-Y936 PolarHBondContact O-N 2.03Å; Y936-E938 WeakPolarHBondContact CA-OE2 3.28Å; Y936-E938 WeakPolarHBondContact CB-OE2 3.28Å; Y936-E938 PolarHBondContact N-OE2 2.86Å; Y936-E938 PolarHBondContact O-N 2.69Å
937	C	81.5	Confident	72	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.38	C	S	.	.	S	Bend	trans	55.6	29.6	-170.1	-52.5	0	0	0	0	113	N916 A918 C926 C928 E933 G934 K939	N916-C937 PolarHBondContact ND2-O 3.48Å; A918-C937 HydrophobicContact CB-CB 3.71Å; A918-C937 WeakPolarHBondContact CB-SG 3.32Å; C926-C937 PolarHBondContact O-SG 2.81Å; C926-C937 VanDerWaalsContact O-SG 3.36Å; C928-C937 WeakPolarHBondContact CA-SG 3.23Å; C928-C937 HydrophobicContact CB-CB 3.74Å; C928-C937 WeakPolarHBondContact CB-SG 3.06Å; C928-C937 PolarHBondContact N-SG 3.36Å; C928-C937 WeakPolarHBondContact SG-CA 3.46Å; C928-C937 WeakPolarHBondContact SG-CB 3.48Å; C928-C937 CovalentContact SG-SG 2.03Å; C928-C937 PolarHBondContact SG-SG 3.46Å; E933-C937 CarbonylContact O-C 3.59Å; E933-C937 VanDerWaalsContact O-CA 3.25Å; E933-C937 WeakPolarHBondContact O-CA 3.45Å; G934-C937 PolarHBondContact O-N 2.71Å; G934-C937 VanDerWaalsContact O-N 3.15Å; C937-K939 VanDerWaalsContact C-N 3.3Å; C937-K939 PolarHBondContact O-N 3.36Å
938	E	78	Confident	71.1	Confident	72 Å²	72	72.8 Å²	72.8	34%	0.336	38%	0.384	S	S	.	.			trans	-74.6	-17.5	-173.1	74.2	-69.5	168	0	0	113.9	L915 E933 G934 I935 Y936	L915-E938 HydrophobicContact CD1-CB 3.89Å; E933-E938 PolarHBondContact O-N 2.05Å; G934-E938 VanDerWaalsContact CA-OE1 3.28Å; G934-E938 WeakPolarHBondContact CA-OE1 3.37Å; G934-E938 VanDerWaalsContact CA-OE2 3.31Å; G934-E938 WeakPolarHBondContact CA-OE2 3.5Å; I935-E938 PolarHBondContact N-OE2 3.49Å; I935-E938 VanDerWaalsContact N-OE2 3.09Å; Y936-E938 WeakPolarHBondContact CA-OE2 3.28Å; Y936-E938 WeakPolarHBondContact CB-OE2 3.28Å; Y936-E938 PolarHBondContact N-OE2 2.86Å; Y936-E938 PolarHBondContact O-N 2.69Å
939	K	71.4	Confident	70.8	Confident	112 Å²	112	74.4 Å²	74.4	49%	0.487	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139.7	-179.6	-54.4	175	-174.3	172.6	0	109.4	Y932 E933 C937	Y932-K939 CarbonylContact C-O 3.46Å; Y932-K939 VanDerWaalsContact CA-O 3.29Å; Y932-K939 WeakPolarHBondContact CA-O 3.22Å; E933-K939 HydrophobicContact CG-CB 3.9Å; E933-K939 PolarHBondContact N-O 3.26Å; E933-K939 WeakPolarHBondContact O-CB 3.36Å; E933-K939 PolarHBondContact O-N 2.86Å; E933-K939 VanDerWaalsContact O-O 3.1Å; C937-K939 VanDerWaalsContact C-N 3.3Å; C937-K939 PolarHBondContact O-N 3.36Å
940	I	65.8	Low	71	Confident	120 Å²	120	70.1 Å²	70.1	62%	0.615	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	133.8	158.6	-68.9	163.5	0	0	0	106.8	G931 Y932 D942	G931-I940 CarbonylContact O-C 3.24Å; G931-I940 WeakPolarHBondContact O-CA 3.46Å; Y932-I940 HydrophobicContact CD1-CG1 4.02Å; Y932-I940 HydrophobicContact CE1-CG1 3.68Å; I940-D942 PolarHBondContact O-N 2.69Å; I940-D942 VanDerWaalsContact O-N 3.09Å
941	K	61.1	Low	71.2	Confident	83 Å²	83	66.7 Å²	66.7	36%	0.361	35%	0.345	S	S	.	.			trans	-59	114.1	169.8	-95.8	-177.6	169.4	-176.4	0	108.3	G931 Y932 E933 I943 I946	G931-K941 PolarHBondContact O-N 3.01Å; Y932-K941 WeakPolarHBondContact O-CD 3.45Å; Y932-K941 WeakPolarHBondContact O-CE 3.38Å; Y932-K941 WeakPolarHBondContact O-CG 3.35Å; E933-K941 HydrophobicContact CB-CD 4.46Å; E933-K941 HydrophobicContact CB-CG 3.68Å; E933-K941 HydrophobicContact CG-CG 3.83Å; E933-K941 WeakPolarHBondContact OE2-CG 3.42Å; K941-I943 VanDerWaalsContact C-N 3.33Å; K941-I943 PolarHBondContact O-N 3.39Å; K941-I946 HydrophobicContact CB-CD1 3.7Å; K941-I946 HydrophobicContact CD-CD1 3.63Å; K941-I946 HydrophobicContact CG-CD1 3.58Å
942	D	62.6	Low	72	Confident	47 Å²	47	66.7 Å²	66.7	25%	0.251	34%	0.338	S	S	.	.			trans	-67.4	96.9	175.5	-176.7	10.9	0	0	0	109.1	I940 C944 A945 I946 R1161	I940-D942 PolarHBondContact O-N 2.69Å; I940-D942 VanDerWaalsContact O-N 3.09Å; D942-C944 PolarHBondContact O-N 2.03Å; D942-C944 VanDerWaalsContact O-N 3.15Å; D942-C944 WeakPolarHBondContact OD1-CB 3.02Å; D942-C944 PolarHBondContact OD1-N 3.44Å; D942-A945 HydrophobicContact CB-CB 3.88Å; D942-A945 WeakPolarHBondContact O-CA 3.01Å; D942-A945 WeakPolarHBondContact O-CB 3.49Å; D942-A945 PolarHBondContact O-N 2.88Å; D942-I946 WeakPolarHBondContact O-CG1 3.37Å; D942-I946 PolarHBondContact O-N 2.92Å; D942-R1161 IonicContact OD2-NH2 3.22Å
943	I	65	Low	72.1	Confident	34 Å²	34	66.2 Å²	66.2	17%	0.174	34%	0.338	C	S	.	.	H	α-helix	trans	-56	-29.3	177.1	-84.3	173.1	0	0	0	111	K941 L947 G960 Y962	K941-I943 VanDerWaalsContact C-N 3.33Å; K941-I943 PolarHBondContact O-N 3.39Å; I943-L947 HydrophobicContact CG2-CD1 4.3Å; I943-L947 PolarHBondContact O-N 3.36Å; I943-G960 WeakPolarHBondContact CD1-O 3.36Å; I943-Y962 HydrophobicContact CG2-CD1 3.65Å; I943-Y962 HydrophobicContact CG2-CE1 4.5Å; I943-Y962 HydrophobicContact CG2-CG 4.04Å
944	C	69.3	Low	72.5	Confident	16 Å²	16	64.1 Å²	64.1	11%	0.108	33%	0.331	C	S	.	.	H	α-helix	trans	-69.6	-38.4	174.4	-58.4	0	0	0	0	112.4	D942 K948 C954	D942-C944 PolarHBondContact O-N 2.03Å; D942-C944 VanDerWaalsContact O-N 3.15Å; D942-C944 WeakPolarHBondContact OD1-CB 3.02Å; D942-C944 PolarHBondContact OD1-N 3.44Å; C944-K948 PolarHBondContact O-N 2.91Å; C944-C954 WeakPolarHBondContact CA-SG 3.42Å; C944-C954 HydrophobicContact CB-CB 3.44Å; C944-C954 VanDerWaalsContact CB-CB 3.44Å; C944-C954 WeakPolarHBondContact CB-SG 3.44Å; C944-C954 WeakPolarHBondContact SG-CB 3.44Å; C944-C954 PolarHBondContact SG-O 3.34Å; C944-C954 VanDerWaalsContact SG-O 3.42Å; C944-C954 CovalentContact SG-SG 2.03Å; C944-C954 PolarHBondContact SG-SG 3.17Å
945	A	63.3	Low	72.9	Confident	60 Å²	60	66.9 Å²	66.9	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-72.8	-38.9	174.7	0	0	0	0	0	112.8	D942	D942-A945 HydrophobicContact CB-CB 3.88Å; D942-A945 WeakPolarHBondContact O-CA 3.01Å; D942-A945 WeakPolarHBondContact O-CB 3.49Å; D942-A945 PolarHBondContact O-N 2.88Å
946	I	62.2	Low	72.5	Confident	87 Å²	87	64 Å²	64	45%	0.446	33%	0.325	S	S	.	.	H	α-helix	trans	-79.2	-49.4	-173.6	-66	175.4	0	0	0	112.3	K941 D942	K941-I946 HydrophobicContact CB-CD1 3.7Å; K941-I946 HydrophobicContact CD-CD1 3.63Å; K941-I946 HydrophobicContact CG-CD1 3.58Å; D942-I946 WeakPolarHBondContact O-CG1 3.37Å; D942-I946 PolarHBondContact O-N 2.92Å
947	L	64.9	Low	72.1	Confident	96 Å²	96	64.2 Å²	64.2	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-96.9	-19.5	-171.8	-61.4	176.3	0	0	0	113.5	I943 L949	I943-L947 HydrophobicContact CG2-CD1 4.3Å; I943-L947 PolarHBondContact O-N 3.36Å; L947-L949 VanDerWaalsContact C-N 3.28Å; L947-L949 HydrophobicContact CB-CD1 3.46Å; L947-L949 VanDerWaalsContact CB-CD1 3.46Å; L947-L949 HydrophobicContact CB-CG 3.71Å; L947-L949 HydrophobicContact CD1-CD1 3.71Å; L947-L949 HydrophobicContact CG-CD1 4.19Å; L947-L949 PolarHBondContact O-N 2.98Å
948	K	66.4	Low	71.3	Confident	105 Å²	105	74.2 Å²	74.2	46%	0.457	38%	0.375	S	S	.	.			trans	49.5	45.2	178.6	-60.5	178.7	170.6	-173.9	0	113.6	C944 C950 T1163 N1164	C944-K948 PolarHBondContact O-N 2.91Å; K948-C950 VanDerWaalsContact C-N 3.32Å; K948-C950 PolarHBondContact O-N 2.76Å; K948-T1163 HydrophobicContact CB-CG2 4.23Å; K948-T1163 HydrophobicContact CD-CG2 4.08Å; K948-T1163 HydrophobicContact CG-CG2 4.16Å; K948-N1164 VanDerWaalsContact CB-ND2 3.34Å; K948-N1164 WeakPolarHBondContact CB-ND2 3.25Å; K948-N1164 PolarHBondContact O-ND2 2.86Å
949	L	73	Confident	70.9	Confident	72 Å²	72	76.2 Å²	76.2	38%	0.377	39%	0.388	S	S	.	.			trans	-88.4	17.4	-171.5	-73.3	165	0	0	0	114.9	L947 Y962 C964 H977	L947-L949 VanDerWaalsContact C-N 3.28Å; L947-L949 HydrophobicContact CB-CD1 3.46Å; L947-L949 VanDerWaalsContact CB-CD1 3.46Å; L947-L949 HydrophobicContact CB-CG 3.71Å; L947-L949 HydrophobicContact CD1-CD1 3.71Å; L947-L949 HydrophobicContact CG-CD1 4.19Å; L947-L949 PolarHBondContact O-N 2.98Å; L949-Y962 HydrophobicContact CB-CD2 4.48Å; L949-Y962 HydrophobicContact CB-CE1 4.32Å; L949-Y962 HydrophobicContact CB-CE2 3.58Å; L949-Y962 WeakPolarHBondContact CB-OH 3.3Å; L949-Y962 HydrophobicContact CD1-CE1 3.66Å; L949-Y962 HydrophobicContact CD1-CE2 4.46Å; L949-Y962 WeakPolarHBondContact CD1-OH 3.07Å; L949-C964 PolarHBondContact O-SG 3.46Å; L949-H977 PolarHBondContact O-ND1 3Å
950	C	80.8	Confident	70.2	Confident	10 Å²	10	73.2 Å²	73.2	7%	0.068	39%	0.388	C	S	.	.	S	Bend	trans	-140.8	145.4	176.9	-54.9	0	0	0	0	108.9	K948 Q953 C954 C964	K948-C950 VanDerWaalsContact C-N 3.32Å; K948-C950 PolarHBondContact O-N 2.76Å; C950-Q953 WeakPolarHBondContact CB-O 3.35Å; C950-C954 HydrophobicContact CB-CB 3.87Å; C950-C954 WeakPolarHBondContact SG-CB 3.05Å; C950-C954 VanDerWaalsContact SG-SG 3.63Å; C950-C964 WeakPolarHBondContact CA-SG 3.42Å; C950-C964 HydrophobicContact CB-CB 3.57Å; C950-C964 WeakPolarHBondContact CB-SG 3.05Å; C950-C964 WeakPolarHBondContact SG-CA 3.44Å; C950-C964 WeakPolarHBondContact SG-CB 3.5Å; C950-C964 CovalentContact SG-SG 2.03Å; C950-C964 PolarHBondContact SG-SG 2.76Å
951	D	80.1	Confident	70.5	Confident	58 Å²	58	70.2 Å²	70.2	31%	0.31	38%	0.376	S	S	.	.	S	Bend	trans	-62.4	-54.3	176.2	-92.2	-12.3	0	0	0	111.8	H977 S978 C979 L1162 T1163	D951-H977 PolarHBondContact N-O 2.94Å; D951-S978 WeakPolarHBondContact OD2-CA 3.05Å; D951-C979 HydrophobicContact CB-CB 3.92Å; D951-C979 PolarHBondContact OD2-N 2.74Å; D951-L1162 WeakPolarHBondContact O-CD2 3.26Å; D951-T1163 PolarHBondContact O-OG1 3Å
952	Q	80.7	Confident	71.2	Confident	27 Å²	27	68.9 Å²	68.9	13%	0.126	37%	0.369	C	S	.	.	S	Bend	trans	-114.6	-83.1	-168.5	-70.3	172.6	3.7	0	0	112.9	C966 Y970 C979 L1162	Q952-C966 HydrophobicContact CB-CB 4.25Å; Q952-Y970 VanDerWaalsContact NE2-CD2 3.32Å; Q952-Y970 VanDerWaalsContact NE2-CE2 3.32Å; Q952-C979 HydrophobicContact CG-CB 4.09Å; Q952-L1162 HydrophobicContact CG-CD2 4.08Å
953	Q	81.6	Confident	72.2	Confident	62 Å²	62	71.1 Å²	71.1	29%	0.29	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138.5	-178.6	-49.2	-176.7	-5	0	0	109.7	C950 F955 C964 G965 C966 D967	C950-Q953 WeakPolarHBondContact CB-O 3.35Å; Q953-F955 HydrophobicContact CB-CE2 3.7Å; Q953-F955 HydrophobicContact CB-CZ 4.01Å; Q953-F955 VanDerWaalsContact OE1-CZ 3.26Å; Q953-C964 CarbonylContact O-C 3.6Å; Q953-C964 WeakPolarHBondContact O-CA 3.33Å; Q953-G965 WeakPolarHBondContact CA-O 3.45Å; Q953-G965 VanDerWaalsContact CB-O 3.26Å; Q953-G965 WeakPolarHBondContact CB-O 3.01Å; Q953-G965 PolarHBondContact N-O 3.31Å; Q953-G965 PolarHBondContact O-N 3.42Å; Q953-C966 PolarHBondContact NE2-O 2.99Å; Q953-D967 PolarHBondContact NE2-OD1 2.88Å
954	C	82.7	Confident	73.1	Confident	28 Å²	28	69.9 Å²	69.9	19%	0.189	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133	174.4	176.9	0	0	0	0	108.6	C944 C950	C944-C954 WeakPolarHBondContact CA-SG 3.42Å; C944-C954 HydrophobicContact CB-CB 3.44Å; C944-C954 VanDerWaalsContact CB-CB 3.44Å; C944-C954 WeakPolarHBondContact CB-SG 3.44Å; C944-C954 WeakPolarHBondContact SG-CB 3.44Å; C944-C954 PolarHBondContact SG-O 3.34Å; C944-C954 VanDerWaalsContact SG-O 3.42Å; C944-C954 CovalentContact SG-SG 2.03Å; C944-C954 PolarHBondContact SG-SG 3.17Å; C950-C954 HydrophobicContact CB-CB 3.87Å; C950-C954 WeakPolarHBondContact SG-CB 3.05Å; C950-C954 VanDerWaalsContact SG-SG 3.63Å
955	F	80.3	Confident	73.7	Confident	87 Å²	87	69.7 Å²	69.7	38%	0.382	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	106.9	-174	-62.6	-79.9	0	0	0	108.8	Q953 Y962 H963	Q953-F955 HydrophobicContact CB-CE2 3.7Å; Q953-F955 HydrophobicContact CB-CZ 4.01Å; Q953-F955 VanDerWaalsContact OE1-CZ 3.26Å; F955-Y962 CarbonylContact O-C 3.37Å; F955-Y962 VanDerWaalsContact O-CA 3.28Å; F955-Y962 WeakPolarHBondContact O-CA 3.45Å; F955-H963 WeakPolarHBondContact CB-CE1 3.14Å; F955-H963 WeakPolarHBondContact CB-ND1 3.06Å; F955-H963 AromaticContact CD2-NE2 3.88Å; F955-H963 AromaticContact CG-CE1 3.87Å; F955-H963 PolarHBondContact N-O 3.19Å; F955-H963 PolarHBondContact O-N 2.9Å; F955-H963 PolarHBondContact O-ND1 2.92Å
956	P	70.2	Confident	74.7	Confident	76 Å²	76	68.1 Å²	68.1	49%	0.494	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	151.5	175.3	29.6	-33.8	0	0	0	110.2
957	K	72.4	Confident	75.4	Confident	96 Å²	96	66.8 Å²	66.8	42%	0.417	35%	0.352	S	S	.	.			trans	-116.3	155.2	177.5	-73.7	161.1	172	164.9	0	110.5	D959 G960 T961 Y962	K957-D959 WeakPolarHBondContact CB-OD1 3.26Å; K957-D959 PolarHBondContact O-N 2.66Å; K957-D959 VanDerWaalsContact O-N 3.1Å; K957-G960 PolarHBondContact O-N 2.76Å; K957-G960 VanDerWaalsContact O-N 3.09Å; K957-T961 WeakPolarHBondContact CD-OG1 3.29Å; K957-T961 PolarHBondContact N-O 3.24Å; K957-Y962 PolarHBondContact NZ-O 2.78Å
958	E	65.3	Low	76	Confident	211 Å²	211	67.5 Å²	67.5	99%	0.986	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20	-179.7	-59.8	-178.5	165.2	0	0	113.9	G960	E958-G960 VanDerWaalsContact C-N 3.3Å; E958-G960 PolarHBondContact O-N 3.41Å
959	D	69.7	Low	75.7	Confident	114 Å²	114	65.7 Å²	65.7	61%	0.61	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	3.6	178.3	64.4	0.2	0	0	0	114.1	K957 T961	K957-D959 WeakPolarHBondContact CB-OD1 3.26Å; K957-D959 PolarHBondContact O-N 2.66Å; K957-D959 VanDerWaalsContact O-N 3.1Å; D959-T961 VanDerWaalsContact C-N 3.28Å; D959-T961 VanDerWaalsContact CG-OG1 3.29Å; D959-T961 VanDerWaalsContact OD1-CB 3.29Å; D959-T961 WeakPolarHBondContact OD1-CB 3.16Å; D959-T961 WeakPolarHBondContact OD1-CG2 3.43Å; D959-T961 PolarHBondContact OD1-N 2.92Å; D959-T961 PolarHBondContact OD1-OG1 2.81Å; D959-T961 PolarHBondContact OD2-OG1 2.8Å
960	G	56.7	Low	75.9	Confident	48 Å²	48	64.3 Å²	64.3	50%	0.495	35%	0.345	S	S	.	.	S	Bend	trans	76.2	14	-174.5	0	0	0	0	0	113.6	I943 K957 E958	I943-G960 WeakPolarHBondContact CD1-O 3.36Å; K957-G960 PolarHBondContact O-N 2.76Å; K957-G960 VanDerWaalsContact O-N 3.09Å; E958-G960 VanDerWaalsContact C-N 3.3Å; E958-G960 PolarHBondContact O-N 3.41Å
961	T	72.9	Confident	75.5	Confident	58 Å²	58	69.6 Å²	69.6	36%	0.356	37%	0.369	S	S	.	.			trans	-99	-172.4	165.9	75.4	0	0	0	0	110.8	K957 D959	K957-T961 WeakPolarHBondContact CD-OG1 3.29Å; K957-T961 PolarHBondContact N-O 3.24Å; D959-T961 VanDerWaalsContact C-N 3.28Å; D959-T961 VanDerWaalsContact CG-OG1 3.29Å; D959-T961 VanDerWaalsContact OD1-CB 3.29Å; D959-T961 WeakPolarHBondContact OD1-CB 3.16Å; D959-T961 WeakPolarHBondContact OD1-CG2 3.43Å; D959-T961 PolarHBondContact OD1-N 2.92Å; D959-T961 PolarHBondContact OD1-OG1 2.81Å; D959-T961 PolarHBondContact OD2-OG1 2.8Å
962	Y	75	Confident	75.4	Confident	55 Å²	55	70.5 Å²	70.5	22%	0.216	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	176.8	176	63.2	-75.9	0	0	0	109.5	I943 L949 F955 K957 H977	I943-Y962 HydrophobicContact CG2-CD1 3.65Å; I943-Y962 HydrophobicContact CG2-CE1 4.5Å; I943-Y962 HydrophobicContact CG2-CG 4.04Å; L949-Y962 HydrophobicContact CB-CD2 4.48Å; L949-Y962 HydrophobicContact CB-CE1 4.32Å; L949-Y962 HydrophobicContact CB-CE2 3.58Å; L949-Y962 WeakPolarHBondContact CB-OH 3.3Å; L949-Y962 HydrophobicContact CD1-CE1 3.66Å; L949-Y962 HydrophobicContact CD1-CE2 4.46Å; L949-Y962 WeakPolarHBondContact CD1-OH 3.07Å; F955-Y962 CarbonylContact O-C 3.37Å; F955-Y962 VanDerWaalsContact O-CA 3.28Å; F955-Y962 WeakPolarHBondContact O-CA 3.45Å; K957-Y962 PolarHBondContact NZ-O 2.78Å; Y962-H977 AromaticContact CE2-CE1 3.89Å; Y962-H977 AromaticContact CE2-ND1 4Å; Y962-H977 AromaticContact CZ-CE1 3.9Å; Y962-H977 PolarHBondContact OH-CE1 3.33Å
963	H	83.5	Confident	75.3	Confident	93 Å²	93	73 Å²	73	43%	0.431	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	154.1	156.2	68.1	-67.3	0	0	0	110.2	F955	F955-H963 WeakPolarHBondContact CB-CE1 3.14Å; F955-H963 WeakPolarHBondContact CB-ND1 3.06Å; F955-H963 AromaticContact CD2-NE2 3.88Å; F955-H963 AromaticContact CG-CE1 3.87Å; F955-H963 PolarHBondContact N-O 3.19Å; F955-H963 PolarHBondContact O-N 2.9Å; F955-H963 PolarHBondContact O-ND1 2.92Å
964	C	85.1	Confident	75.1	Confident	9 Å²	9	75.7 Å²	75.7	6%	0.061	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	153.5	177.9	-53.9	0	0	0	0	111.2	L949 C950 Q953 L972 G976 H977	L949-C964 PolarHBondContact O-SG 3.46Å; C950-C964 WeakPolarHBondContact CA-SG 3.42Å; C950-C964 HydrophobicContact CB-CB 3.57Å; C950-C964 WeakPolarHBondContact CB-SG 3.05Å; C950-C964 WeakPolarHBondContact SG-CA 3.44Å; C950-C964 WeakPolarHBondContact SG-CB 3.5Å; C950-C964 CovalentContact SG-SG 2.03Å; C950-C964 PolarHBondContact SG-SG 2.76Å; Q953-C964 CarbonylContact O-C 3.6Å; Q953-C964 WeakPolarHBondContact O-CA 3.33Å; C964-L972 HydrophobicContact CB-CD1 3.81Å; C964-G976 WeakPolarHBondContact CB-O 3.39Å; C964-G976 PolarHBondContact SG-O 3.1Å; C964-G976 VanDerWaalsContact SG-O 3.38Å; C964-H977 PolarHBondContact SG-ND1 2.81Å
965	G	80.6	Confident	74.8	Confident	12 Å²	12	77.9 Å²	77.9	12%	0.124	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	154.8	174.9	0	0	0	0	0	112.5	Q953	Q953-G965 WeakPolarHBondContact CA-O 3.45Å; Q953-G965 VanDerWaalsContact CB-O 3.26Å; Q953-G965 WeakPolarHBondContact CB-O 3.01Å; Q953-G965 PolarHBondContact N-O 3.31Å; Q953-G965 PolarHBondContact O-N 3.42Å
966	C	83.9	Confident	74.6	Confident	26 Å²	26	75.2 Å²	75.2	18%	0.176	42%	0.424	C	S	.	.			trans	-77.7	137.5	174.9	42.6	0	0	0	0	114.3	Q952 Q953 C979	Q952-C966 HydrophobicContact CB-CB 4.25Å; Q953-C966 PolarHBondContact NE2-O 2.99Å; C966-C979 HydrophobicContact CB-CB 3.58Å; C966-C979 WeakPolarHBondContact CB-SG 3.32Å; C966-C979 WeakPolarHBondContact SG-CB 3.46Å; C966-C979 CovalentContact SG-SG 2.03Å; C966-C979 PolarHBondContact SG-SG 2.83Å
967	D	78.4	Confident	75.2	Confident	60 Å²	60	75 Å²	75	32%	0.321	42%	0.416	S	S	.	.			trans	-62.1	152.2	148.9	-70.6	-41.1	0	0	0	109.2	Q953 E969 Y970	Q953-D967 PolarHBondContact NE2-OD1 2.88Å; D967-E969 PolarHBondContact O-N 3.32Å; D967-Y970 HydrophobicContact CB-CD2 4.24Å; D967-Y970 PolarHBondContact O-N 3.13Å
968	P	75.9	Confident	75.6	Confident	111 Å²	111	72.1 Å²	72.1	72%	0.721	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.4	-164.8	-28.6	36.4	0	0	0	116.3	Y970 K982	P968-Y970 VanDerWaalsContact C-N 3.28Å; P968-Y970 PolarHBondContact O-N 3Å; P968-K982 PolarHBondContact O-NZ 3.43Å
969	E	60.9	Low	76.3	Confident	66 Å²	66	62.6 Å²	62.6	31%	0.308	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.9	-179.4	-64.6	169.3	166.1	0	0	113.5	D967 K982 N997	D967-E969 PolarHBondContact O-N 3.32Å; E969-K982 WeakPolarHBondContact O-CB 3.42Å; E969-K982 PolarHBondContact O-N 3.36Å; E969-N997 HydrophobicContact CB-CB 4.12Å; E969-N997 WeakPolarHBondContact CB-O 3.42Å; E969-N997 HydrophobicContact CG-CB 4.4Å; E969-N997 WeakPolarHBondContact CG-O 3.45Å; E969-N997 WeakPolarHBondContact OE2-CB 3.07Å
970	Y	77.9	Confident	76.4	Confident	43 Å²	43	62.9 Å²	62.9	17%	0.169	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	165.6	-173.6	-69.3	-103.8	0	0	0	112.6	Q952 D967 P968 C979 E980 L981 N997	Q952-Y970 VanDerWaalsContact NE2-CD2 3.32Å; Q952-Y970 VanDerWaalsContact NE2-CE2 3.32Å; D967-Y970 HydrophobicContact CB-CD2 4.24Å; D967-Y970 PolarHBondContact O-N 3.13Å; P968-Y970 VanDerWaalsContact C-N 3.28Å; P968-Y970 PolarHBondContact O-N 3Å; Y970-C979 HydrophobicContact CD1-CB 4.28Å; Y970-C979 WeakPolarHBondContact CD1-O 3.45Å; Y970-E980 CarbonylContact C-O 3.3Å; Y970-E980 WeakPolarHBondContact CA-O 3.11Å; Y970-E980 WeakPolarHBondContact CB-O 3.2Å; Y970-E980 VanDerWaalsContact CD1-C 3.4Å; Y970-E980 WeakPolarHBondContact CD1-O 3.3Å; Y970-L981 HydrophobicContact CD1-CD1 4.27Å; Y970-L981 HydrophobicContact CD1-CG 4.44Å; Y970-L981 HydrophobicContact CE1-CD1 3.44Å; Y970-L981 VanDerWaalsContact CE1-CD1 3.44Å; Y970-L981 HydrophobicContact CE1-CG 4.01Å; Y970-N997 WeakPolarHBondContact CE2-ND2 3.38Å; Y970-N997 PolarHBondContact OH-ND2 3.11Å
971	E	72.6	Confident	76.6	Confident	121 Å²	121	64.3 Å²	64.3	57%	0.565	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.2	173.4	-60.8	-170	173.9	0	0	110.3	Q973 E980 K982	E971-Q973 PolarHBondContact O-N 2.94Å; E971-E980 PolarHBondContact N-O 3.26Å; E971-E980 PolarHBondContact O-N 3.05Å; E971-K982 HydrophobicContact CG-CD 4.26Å; E971-K982 HydrophobicContact CG-CG 3.76Å; E971-K982 WeakPolarHBondContact OE1-CE 3.34Å
972	L	77	Confident	76	Confident	77 Å²	77	66 Å²	66	40%	0.403	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122.3	177.6	-169.9	75.4	0	0	0	109	C964 S978	C964-L972 HydrophobicContact CB-CD1 3.81Å; L972-S978 WeakPolarHBondContact CA-O 3Å
973	Q	78.7	Confident	74.9	Confident	81 Å²	81	69 Å²	69	38%	0.379	39%	0.391	S	S	.	.			trans	-67.5	166.4	179.5	-81.4	-136.6	-31.2	0	0	112.6	E971 D975 G976 S978 E980	E971-Q973 PolarHBondContact O-N 2.94Å; Q973-D975 PolarHBondContact O-N 3.5Å; Q973-G976 PolarHBondContact O-N 3.39Å; Q973-S978 PolarHBondContact N-O 3Å; Q973-E980 HydrophobicContact CG-CB 4.34Å; Q973-E980 HydrophobicContact CG-CG 4.15Å; Q973-E980 PolarHBondContact NE2-OE1 3.44Å; Q973-E980 PolarHBondContact NE2-OE2 2.84Å
974	A	77.1	Confident	73.3	Confident	117 Å²	117	68.1 Å²	68.1	97%	0.967	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-5.9	-178.9	0	0	0	0	0	114.6	G976	A974-G976 VanDerWaalsContact C-N 3.33Å
975	D	76.1	Confident	71.7	Confident	75 Å²	75	70.8 Å²	70.8	40%	0.401	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.4	168.9	67.9	-7.6	0	0	0	112.8	Q973 H977 S978	Q973-D975 PolarHBondContact O-N 3.5Å; D975-H977 VanDerWaalsContact C-N 3.32Å; D975-H977 PolarHBondContact O-CD2 3.35Å; D975-H977 PolarHBondContact OD1-N 2.03Å; D975-S978 PolarHBondContact OD1-N 3.08Å; D975-S978 VanDerWaalsContact OD2-CB 3.3Å; D975-S978 WeakPolarHBondContact OD2-CB 3.36Å; D975-S978 PolarHBondContact OD2-N 2.76Å; D975-S978 PolarHBondContact OD2-OG 2.58Å
976	G	77.4	Confident	70.6	Confident	30 Å²	30	77 Å²	77	31%	0.309	44%	0.443	S	S	.	.	S	Bend	trans	78.5	10.7	-175.9	0	0	0	0	0	114.6	C964 Q973 A974	C964-G976 WeakPolarHBondContact CB-O 3.39Å; C964-G976 PolarHBondContact SG-O 3.1Å; C964-G976 VanDerWaalsContact SG-O 3.38Å; Q973-G976 PolarHBondContact O-N 3.39Å; A974-G976 VanDerWaalsContact C-N 3.33Å
977	H	82.2	Confident	69.7	Low	71 Å²	71	78.2 Å²	78.2	33%	0.329	45%	0.447	S	S	.	.	S	Bend	trans	-132.7	-40.5	-171	-62.8	-59.5	0	0	0	113.9	L949 D951 Y962 C964 D975	L949-H977 PolarHBondContact O-ND1 3Å; D951-H977 PolarHBondContact N-O 2.94Å; Y962-H977 AromaticContact CE2-CE1 3.89Å; Y962-H977 AromaticContact CE2-ND1 4Å; Y962-H977 AromaticContact CZ-CE1 3.9Å; Y962-H977 PolarHBondContact OH-CE1 3.33Å; C964-H977 PolarHBondContact SG-ND1 2.81Å; D975-H977 VanDerWaalsContact C-N 3.32Å; D975-H977 PolarHBondContact O-CD2 3.35Å; D975-H977 PolarHBondContact OD1-N 2.03Å
978	S	80.1	Confident	69.6	Low	37 Å²	37	84.1 Å²	84.1	26%	0.259	47%	0.47	S	S	.	.			trans	-91.4	153.8	-174.6	-52.5	0	0	0	0	112.3	D951 L972 Q973 D975	D951-S978 WeakPolarHBondContact OD2-CA 3.05Å; L972-S978 WeakPolarHBondContact CA-O 3Å; Q973-S978 PolarHBondContact N-O 3Å; D975-S978 PolarHBondContact OD1-N 3.08Å; D975-S978 VanDerWaalsContact OD2-CB 3.3Å; D975-S978 WeakPolarHBondContact OD2-CB 3.36Å; D975-S978 PolarHBondContact OD2-N 2.76Å; D975-S978 PolarHBondContact OD2-OG 2.58Å
979	C	81.2	Confident	69.8	Low	11 Å²	11	80.4 Å²	80.4	7%	0.074	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	105.6	-174.5	-67.5	0	0	0	0	111.5	D951 Q952 C966 Y970	D951-C979 HydrophobicContact CB-CB 3.92Å; D951-C979 PolarHBondContact OD2-N 2.74Å; Q952-C979 HydrophobicContact CG-CB 4.09Å; C966-C979 HydrophobicContact CB-CB 3.58Å; C966-C979 WeakPolarHBondContact CB-SG 3.32Å; C966-C979 WeakPolarHBondContact SG-CB 3.46Å; C966-C979 CovalentContact SG-SG 2.03Å; C966-C979 PolarHBondContact SG-SG 2.83Å; Y970-C979 HydrophobicContact CD1-CB 4.28Å; Y970-C979 WeakPolarHBondContact CD1-O 3.45Å
980	E	72.2	Confident	70.9	Confident	120 Å²	120	81.8 Å²	81.8	56%	0.561	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	146.1	176.8	-93.5	-170	154.5	0	0	112.3	Y970 E971 Q973	Y970-E980 CarbonylContact C-O 3.3Å; Y970-E980 WeakPolarHBondContact CA-O 3.11Å; Y970-E980 WeakPolarHBondContact CB-O 3.2Å; Y970-E980 VanDerWaalsContact CD1-C 3.4Å; Y970-E980 WeakPolarHBondContact CD1-O 3.3Å; E971-E980 PolarHBondContact N-O 3.26Å; E971-E980 PolarHBondContact O-N 3.05Å; Q973-E980 HydrophobicContact CG-CB 4.34Å; Q973-E980 HydrophobicContact CG-CG 4.15Å; Q973-E980 PolarHBondContact NE2-OE1 3.44Å; Q973-E980 PolarHBondContact NE2-OE2 2.84Å
981	L	59.3	Low	71	Confident	78 Å²	78	81.8 Å²	81.8	41%	0.408	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	140.8	174.7	-107	94	0	0	0	111.1	Y970 S983 N997	Y970-L981 HydrophobicContact CD1-CD1 4.27Å; Y970-L981 HydrophobicContact CD1-CG 4.44Å; Y970-L981 HydrophobicContact CE1-CD1 3.44Å; Y970-L981 VanDerWaalsContact CE1-CD1 3.44Å; Y970-L981 HydrophobicContact CE1-CG 4.01Å; L981-S983 PolarHBondContact O-N 3.17Å; L981-N997 HydrophobicContact CD2-CB 4.43Å
982	K	61.1	Low	71.2	Confident	92 Å²	92	83 Å²	83	40%	0.4	47%	0.466	S	S	.	.			trans	-64.8	100.6	154.2	-72.2	176.8	-177.8	146.9	0	108.2	P968 E969 E971 S984	P968-K982 PolarHBondContact O-NZ 3.43Å; E969-K982 WeakPolarHBondContact O-CB 3.42Å; E969-K982 PolarHBondContact O-N 3.36Å; E971-K982 HydrophobicContact CG-CD 4.26Å; E971-K982 HydrophobicContact CG-CG 3.76Å; E971-K982 WeakPolarHBondContact OE1-CE 3.34Å; K982-S984 PolarHBondContact O-N 2.81Å
983	S	52.5	Low	71.3	Confident	120 Å²	120	80 Å²	80	84%	0.839	45%	0.454	S	S	*	.	S	Bend	trans	-76.6	60.5	-164.9	45	0	0	0	0	113.9	L981	L981-S983 PolarHBondContact O-N 3.17Å
984	S	48.5	Very low	71.3	Confident	73 Å²	73	84 Å²	84	51%	0.51	47%	0.47	S	S	.	.			trans	-150.8	82.8	170.4	63.4	0	0	0	0	113.5	K982 N986	K982-S984 PolarHBondContact O-N 2.81Å; S984-N986 PolarHBondContact O-N 3.29Å
985	C	51.9	Low	71.1	Confident	65 Å²	65	80.2 Å²	80.2	44%	0.439	44%	0.436	S	S	.	.			trans	-71.3	68	161.6	-116.7	0	0	0	0	110.1	L987 C995 G998	C985-L987 VanDerWaalsContact C-N 3.33Å; C985-C995 VanDerWaalsContact CA-SG 3.59Å; C985-C995 HydrophobicContact CB-CB 4Å; C985-C995 WeakPolarHBondContact CB-SG 3.44Å; C985-C995 WeakPolarHBondContact SG-CB 3.28Å; C985-C995 CovalentContact SG-SG 2.04Å; C985-C995 PolarHBondContact SG-SG 3.03Å; C985-G998 PolarHBondContact SG-N 2.61Å; C985-G998 VanDerWaalsContact SG-N 3.37Å
986	N	58.4	Low	70.5	Confident	144 Å²	144	82.7 Å²	82.7	77%	0.77	44%	0.444	S	S	*	.			trans	-85.9	-3.2	175.6	-91.2	-34.3	0	0	0	112.7	S984 K988	S984-N986 PolarHBondContact O-N 3.29Å; N986-K988 PolarHBondContact O-N 2.88Å
987	L	64.3	Low	69.6	Low	50 Å²	50	82.7 Å²	82.7	26%	0.262	44%	0.436	S	S	.	.			trans	-70.7	125	175.2	-86.7	77.7	0	0	0	110.7	C985 C989 G998 Y1010	C985-L987 VanDerWaalsContact C-N 3.33Å; L987-C989 PolarHBondContact O-N 2.78Å; L987-G998 WeakPolarHBondContact CD1-O 3.37Å; L987-G998 VanDerWaalsContact CD2-O 3.25Å; L987-G998 WeakPolarHBondContact CD2-O 3.25Å; L987-Y1010 HydrophobicContact CB-CD1 4.48Å; L987-Y1010 HydrophobicContact CB-CE1 4.32Å; L987-Y1010 HydrophobicContact CD2-CD1 3.9Å; L987-Y1010 HydrophobicContact CD2-CE1 3.55Å; L987-Y1010 HydrophobicContact CD2-CE2 4.47Å; L987-Y1010 HydrophobicContact CG-CD1 4.18Å; L987-Y1010 HydrophobicContact CG-CE1 3.62Å
988	K	75.7	Confident	69	Low	185 Å²	185	80.3 Å²	80.3	80%	0.804	43%	0.432	S	S	*	.			trans	-83.9	96.2	167.2	-70.2	-176.4	178.4	-179.8	0	109.2	N986	N986-K988 PolarHBondContact O-N 2.88Å
989	C	81.1	Confident	68.7	Low	32 Å²	32	84.2 Å²	84.2	22%	0.216	44%	0.444	C	S	.	.			trans	-66.3	142	169.2	-50.5	0	0	0	0	110.7	L987 G993 C995 C1000 Y1010	L987-C989 PolarHBondContact O-N 2.78Å; C989-G993 WeakPolarHBondContact CB-O 3.37Å; C989-C995 PolarHBondContact SG-N 3.42Å; C989-C995 VanDerWaalsContact SG-N 3.38Å; C989-C1000 WeakPolarHBondContact CA-SG 3.28Å; C989-C1000 HydrophobicContact CB-CB 3.75Å; C989-C1000 WeakPolarHBondContact CB-SG 3.45Å; C989-C1000 VanDerWaalsContact SG-CA 3.57Å; C989-C1000 WeakPolarHBondContact SG-CB 3.33Å; C989-C1000 CovalentContact SG-SG 2.03Å; C989-C1000 PolarHBondContact SG-SG 3.47Å; C989-Y1010 CarbonylContact C-O 3.47Å; C989-Y1010 WeakPolarHBondContact CA-O 3.5Å
990	Q	83.3	Confident	68.7	Low	96 Å²	96	84 Å²	84	45%	0.449	44%	0.442	S	S	.	.	S	Bend	trans	-95.3	174.7	173.3	-53.6	-169.1	35.6	0	0	109.9	N992 G993 Y1010 E1012	Q990-N992 VanDerWaalsContact C-N 3.28Å; Q990-N992 PolarHBondContact O-N 2.85Å; Q990-G993 PolarHBondContact O-N 2.85Å; Q990-Y1010 PolarHBondContact N-O 3.37Å; Q990-E1012 HydrophobicContact CG-CB 4.45Å
991	N	80	Confident	69.2	Low	42 Å²	42	83.1 Å²	83.1	23%	0.225	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	42.5	168.1	-59.1	-43.6	0	0	0	115.7	G993 T1003 F1006 C1011 Y1035	N991-G993 PolarHBondContact O-N 2.87Å; N991-G993 VanDerWaalsContact O-N 3.11Å; N991-T1003 PolarHBondContact O-OG1 3.08Å; N991-F1006 HydrophobicContact CB-CB 4.24Å; N991-F1006 HydrophobicContact CB-CD1 3.6Å; N991-F1006 HydrophobicContact CB-CD2 3.67Å; N991-F1006 HydrophobicContact CB-CE1 3.75Å; N991-F1006 HydrophobicContact CB-CE2 3.8Å; N991-F1006 HydrophobicContact CB-CG 3.55Å; N991-F1006 HydrophobicContact CB-CZ 3.83Å; N991-F1006 VanDerWaalsContact CG-CD1 3.47Å; N991-F1006 VanDerWaalsContact ND2-CD1 3.27Å; N991-F1006 WeakPolarHBondContact ND2-CD1 3.41Å; N991-F1006 WeakPolarHBondContact ND2-CE1 3.36Å; N991-C1011 PolarHBondContact ND2-O 3.45Å; N991-Y1035 PolarHBondContact ND2-OH 2.04Å; N991-Y1035 PolarHBondContact OD1-OH 2.99Å
992	N	76.3	Confident	70.3	Confident	148 Å²	148	81.3 Å²	81.3	79%	0.791	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	17.1	-177	-64.7	-18	0	0	0	115.4	Q990 T1003	Q990-N992 VanDerWaalsContact C-N 3.28Å; Q990-N992 PolarHBondContact O-N 2.85Å; N992-T1003 HydrophobicContact CB-CG2 4.08Å
993	G	79.3	Confident	71.1	Confident	14 Å²	14	79.6 Å²	79.6	14%	0.144	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-60.6	145.1	169.3	0	0	0	0	0	111.7	C989 Q990 N991 I1001	C989-G993 WeakPolarHBondContact CB-O 3.37Å; Q990-G993 PolarHBondContact O-N 2.85Å; N991-G993 PolarHBondContact O-N 2.87Å; N991-G993 VanDerWaalsContact O-N 3.11Å; G993-I1001 CarbonylContact C-O 3.35Å; G993-I1001 WeakPolarHBondContact CA-O 3.38Å
994	K	78.6	Confident	72.4	Confident	163 Å²	163	78.4 Å²	78.4	71%	0.709	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.9	179.7	-69.3	179.2	180	174.3	0	110.1	F996 I1001	K994-F996 PolarHBondContact O-N 2.82Å; K994-I1001 PolarHBondContact N-O 3.25Å; K994-I1001 PolarHBondContact O-N 3.33Å
995	C	74	Confident	74	Confident	39 Å²	39	77.3 Å²	77.3	26%	0.264	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	124.1	172.1	-169.5	0	0	0	0	109.3	C985 C989 K999	C985-C995 VanDerWaalsContact CA-SG 3.59Å; C985-C995 HydrophobicContact CB-CB 4Å; C985-C995 WeakPolarHBondContact CB-SG 3.44Å; C985-C995 WeakPolarHBondContact SG-CB 3.28Å; C985-C995 CovalentContact SG-SG 2.04Å; C985-C995 PolarHBondContact SG-SG 3.03Å; C989-C995 PolarHBondContact SG-N 3.42Å; C989-C995 VanDerWaalsContact SG-N 3.38Å; C995-K999 WeakPolarHBondContact CA-O 3.1Å
996	F	63.1	Low	75.7	Confident	127 Å²	127	75.7 Å²	75.7	56%	0.557	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	125.9	175	-153.7	-92.5	0	0	0	107	K994 G998 K999 I1001	K994-F996 PolarHBondContact O-N 2.82Å; F996-G998 PolarHBondContact O-N 3.43Å; F996-K999 PolarHBondContact N-O 2.82Å; F996-K999 PolarHBondContact O-N 2.84Å; F996-I1001 HydrophobicContact CB-CD1 3.56Å; F996-I1001 HydrophobicContact CB-CG1 3.98Å; F996-I1001 HydrophobicContact CD1-CD1 4.45Å; F996-I1001 HydrophobicContact CD2-CD1 4.46Å; F996-I1001 HydrophobicContact CG-CD1 3.93Å
997	N	59.1	Low	76.8	Confident	29 Å²	29	73.4 Å²	73.4	16%	0.155	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	7.6	-176.5	-58.2	-2.5	0	0	0	117.6	E969 Y970 L981	E969-N997 HydrophobicContact CB-CB 4.12Å; E969-N997 WeakPolarHBondContact CB-O 3.42Å; E969-N997 HydrophobicContact CG-CB 4.4Å; E969-N997 WeakPolarHBondContact CG-O 3.45Å; E969-N997 WeakPolarHBondContact OE2-CB 3.07Å; Y970-N997 WeakPolarHBondContact CE2-ND2 3.38Å; Y970-N997 PolarHBondContact OH-ND2 3.11Å; L981-N997 HydrophobicContact CD2-CB 4.43Å
998	G	68.6	Low	77.8	Confident	22 Å²	22	72 Å²	72	23%	0.227	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	3.8	-173	0	0	0	0	0	114.1	C985 L987 F996	C985-G998 PolarHBondContact SG-N 2.61Å; C985-G998 VanDerWaalsContact SG-N 3.37Å; L987-G998 WeakPolarHBondContact CD1-O 3.37Å; L987-G998 VanDerWaalsContact CD2-O 3.25Å; L987-G998 WeakPolarHBondContact CD2-O 3.25Å; F996-G998 PolarHBondContact O-N 3.43Å
999	K	73.8	Confident	78.1	Confident	118 Å²	118	68.2 Å²	68.2	51%	0.513	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.5	167.8	-174	169.6	-175.7	172.9	0	110.4	C995 F996	C995-K999 WeakPolarHBondContact CA-O 3.1Å; F996-K999 PolarHBondContact N-O 2.82Å; F996-K999 PolarHBondContact O-N 2.84Å
1000	C	81.3	Confident	78.3	Confident	6 Å²	6	71.9 Å²	71.9	4%	0.041	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.9	173.8	-65.6	0	0	0	0	111.3	C989 C1002 D1009 C1011	C989-C1000 WeakPolarHBondContact CA-SG 3.28Å; C989-C1000 HydrophobicContact CB-CB 3.75Å; C989-C1000 WeakPolarHBondContact CB-SG 3.45Å; C989-C1000 VanDerWaalsContact SG-CA 3.57Å; C989-C1000 WeakPolarHBondContact SG-CB 3.33Å; C989-C1000 CovalentContact SG-SG 2.03Å; C989-C1000 PolarHBondContact SG-SG 3.47Å; C1000-C1002 PolarHBondContact O-N 2.04Å; C1000-D1009 WeakPolarHBondContact CB-O 3.48Å; C1000-C1011 WeakPolarHBondContact CB-SG 3.43Å
1001	I	82.5	Confident	78.4	Confident	102 Å²	102	67.3 Å²	67.3	52%	0.523	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	109.9	166.9	-58.1	179	0	0	0	107.2	G993 K994 F996	G993-I1001 CarbonylContact C-O 3.35Å; G993-I1001 WeakPolarHBondContact CA-O 3.38Å; K994-I1001 PolarHBondContact N-O 3.25Å; K994-I1001 PolarHBondContact O-N 3.33Å; F996-I1001 HydrophobicContact CB-CD1 3.56Å; F996-I1001 HydrophobicContact CB-CG1 3.98Å; F996-I1001 HydrophobicContact CD1-CD1 4.45Å; F996-I1001 HydrophobicContact CD2-CD1 4.46Å; F996-I1001 HydrophobicContact CG-CD1 3.93Å
1002	C	81.9	Confident	78.7	Confident	40 Å²	40	68.1 Å²	68.1	27%	0.27	36%	0.359	S	S	.	.			trans	-78.7	155.4	-175.1	-52.6	0	0	0	0	113	C1000 F1006 C1011	C1000-C1002 PolarHBondContact O-N 2.04Å; C1002-F1006 HydrophobicContact CB-CB 4.4Å; C1002-F1006 WeakPolarHBondContact CB-O 3.48Å; C1002-C1011 WeakPolarHBondContact CA-SG 2.92Å; C1002-C1011 HydrophobicContact CB-CB 3.78Å; C1002-C1011 WeakPolarHBondContact CB-SG 2.99Å; C1002-C1011 PolarHBondContact N-SG 3.27Å; C1002-C1011 WeakPolarHBondContact SG-CA 3.05Å; C1002-C1011 WeakPolarHBondContact SG-CB 3.44Å; C1002-C1011 CovalentContact SG-SG 2.04Å; C1002-C1011 PolarHBondContact SG-SG 2.03Å
1003	T	78.8	Confident	79.1	Confident	56 Å²	56	66 Å²	66	34%	0.344	34%	0.343	S	S	.	.			trans	-68.8	156.8	161.6	52.4	0	0	0	0	108.9	N991 N992 N1005 F1006	N991-T1003 PolarHBondContact O-OG1 3.08Å; N992-T1003 HydrophobicContact CB-CG2 4.08Å; T1003-N1005 PolarHBondContact O-N 3.06Å; T1003-F1006 PolarHBondContact O-N 2.96Å; T1003-F1006 VanDerWaalsContact O-N 3.1Å; T1003-F1006 VanDerWaalsContact OG1-CD2 3.32Å; T1003-F1006 WeakPolarHBondContact OG1-CD2 3.4Å
1004	S	78.9	Confident	79.5	Confident	96 Å²	96	67.1 Å²	67.1	67%	0.671	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20	-163.1	44.8	0	0	0	0	116.7	K1015	S1004-K1015 WeakPolarHBondContact O-CD 3.43Å
1005	N	83.1	Confident	79.7	Confident	49 Å²	49	62.1 Å²	62.1	26%	0.262	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	10.3	-170.2	-48.1	14.8	0	0	0	111.7	T1003 K1015 E1017 G1036	T1003-N1005 PolarHBondContact O-N 3.06Å; N1005-K1015 VanDerWaalsContact C-CB 3.43Å; N1005-K1015 WeakPolarHBondContact O-CB 3.45Å; N1005-K1015 PolarHBondContact O-N 3.11Å; N1005-E1017 WeakPolarHBondContact CA-OE1 3.47Å; N1005-E1017 WeakPolarHBondContact CB-OE1 3.11Å; N1005-G1036 WeakPolarHBondContact CB-O 3.42Å; N1005-G1036 PolarHBondContact ND2-O 2.98Å
1006	F	86.8	Confident	80.3	Confident	31 Å²	31	62.5 Å²	62.5	14%	0.136	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.9	-178.6	-64.2	-85.6	0	0	0	111.9	N991 C1002 T1003 C1011 K1013 Y1035	N991-F1006 HydrophobicContact CB-CB 4.24Å; N991-F1006 HydrophobicContact CB-CD1 3.6Å; N991-F1006 HydrophobicContact CB-CD2 3.67Å; N991-F1006 HydrophobicContact CB-CE1 3.75Å; N991-F1006 HydrophobicContact CB-CE2 3.8Å; N991-F1006 HydrophobicContact CB-CG 3.55Å; N991-F1006 HydrophobicContact CB-CZ 3.83Å; N991-F1006 VanDerWaalsContact CG-CD1 3.47Å; N991-F1006 VanDerWaalsContact ND2-CD1 3.27Å; N991-F1006 WeakPolarHBondContact ND2-CD1 3.41Å; N991-F1006 WeakPolarHBondContact ND2-CE1 3.36Å; C1002-F1006 HydrophobicContact CB-CB 4.4Å; C1002-F1006 WeakPolarHBondContact CB-O 3.48Å; T1003-F1006 PolarHBondContact O-N 2.96Å; T1003-F1006 VanDerWaalsContact O-N 3.1Å; T1003-F1006 VanDerWaalsContact OG1-CD2 3.32Å; T1003-F1006 WeakPolarHBondContact OG1-CD2 3.4Å; F1006-C1011 HydrophobicContact CB-CB 4.42Å; F1006-K1013 CarbonylContact C-O 2.89Å; F1006-K1013 WeakPolarHBondContact CA-O 2.96Å; F1006-K1013 WeakPolarHBondContact CD1-O 3.3Å; F1006-Y1035 HydrophobicContact CE1-CD1 4.18Å; F1006-Y1035 AromaticContact CE1-CE1 3.72Å; F1006-Y1035 HydrophobicContact CE1-CE1 3.72Å; F1006-Y1035 HydrophobicContact CE1-CE2 4.33Å; F1006-Y1035 AromaticContact CE1-CZ 3.82Å; F1006-Y1035 HydrophobicContact CZ-CD1 4.41Å; F1006-Y1035 HydrophobicContact CZ-CE1 4.16Å
1007	E	83.2	Confident	81.4	Confident	96 Å²	96	56.9 Å²	56.9	45%	0.449	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	-173.3	180	66	162.1	-127.1	0	0	112	C1011 E1012 K1013 K1015	E1007-C1011 CarbonylContact O-C 3.21Å; E1007-C1011 VanDerWaalsContact O-C 3.3Å; E1007-C1011 VanDerWaalsContact O-CA 3.25Å; E1007-C1011 WeakPolarHBondContact O-CA 3.46Å; E1007-E1012 PolarHBondContact O-N 3.02Å; E1007-K1013 HydrophobicContact CG-CB 3.91Å; E1007-K1013 PolarHBondContact N-O 2.76Å; E1007-K1013 WeakPolarHBondContact O-CB 3.48Å; E1007-K1013 PolarHBondContact O-N 3.35Å; E1007-K1015 HydrophobicContact CB-CB 4.41Å; E1007-K1015 HydrophobicContact CB-CG 4.47Å; E1007-K1015 HydrophobicContact CG-CB 4.2Å; E1007-K1015 HydrophobicContact CG-CG 4.41Å
1008	G	83.6	Confident	82.7	Confident	21 Å²	21	57.1 Å²	57.1	22%	0.216	30%	0.302	C	S	.	.	S	Bend	trans	87	160	-169.6	0	0	0	0	0	112.7	Y1010 C1011 E1012	G1008-Y1010 PolarHBondContact O-N 2.98Å; G1008-Y1010 VanDerWaalsContact O-N 3.15Å; G1008-C1011 PolarHBondContact O-N 3.19Å; G1008-E1012 WeakPolarHBondContact CA-OE1 3.17Å
1009	D	82.7	Confident	83.5	Confident	105 Å²	105	62.4 Å²	62.4	56%	0.561	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-19	-170.2	-60.3	-56.8	0	0	0	113.4	C1000 E1012	C1000-D1009 WeakPolarHBondContact CB-O 3.48Å; D1009-E1012 PolarHBondContact N-OE2 2.99Å
1010	Y	84.8	Confident	83.8	Confident	110 Å²	110	59 Å²	59	43%	0.431	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	8.6	177	-58.9	-105.6	0	0	0	111.8	L987 C989 Q990 G1008 E1012	L987-Y1010 HydrophobicContact CB-CD1 4.48Å; L987-Y1010 HydrophobicContact CB-CE1 4.32Å; L987-Y1010 HydrophobicContact CD2-CD1 3.9Å; L987-Y1010 HydrophobicContact CD2-CE1 3.55Å; L987-Y1010 HydrophobicContact CD2-CE2 4.47Å; L987-Y1010 HydrophobicContact CG-CD1 4.18Å; L987-Y1010 HydrophobicContact CG-CE1 3.62Å; C989-Y1010 CarbonylContact C-O 3.47Å; C989-Y1010 WeakPolarHBondContact CA-O 3.5Å; Q990-Y1010 PolarHBondContact N-O 3.37Å; G1008-Y1010 PolarHBondContact O-N 2.98Å; G1008-Y1010 VanDerWaalsContact O-N 3.15Å; Y1010-E1012 VanDerWaalsContact CA-OE2 3.32Å; Y1010-E1012 WeakPolarHBondContact CA-OE2 3.26Å; Y1010-E1012 WeakPolarHBondContact CB-OE2 3.01Å; Y1010-E1012 PolarHBondContact N-OE2 3.25Å; Y1010-E1012 PolarHBondContact O-N 3.26Å
1011	C	85.4	Confident	83.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	S	Bend	trans	58.1	28.2	-168.9	-46.8	0	0	0	0	113.3	N991 C1000 C1002 F1006 E1007 G1008	N991-C1011 PolarHBondContact ND2-O 3.45Å; C1000-C1011 WeakPolarHBondContact CB-SG 3.43Å; C1002-C1011 WeakPolarHBondContact CA-SG 2.92Å; C1002-C1011 HydrophobicContact CB-CB 3.78Å; C1002-C1011 WeakPolarHBondContact CB-SG 2.99Å; C1002-C1011 PolarHBondContact N-SG 3.27Å; C1002-C1011 WeakPolarHBondContact SG-CA 3.05Å; C1002-C1011 WeakPolarHBondContact SG-CB 3.44Å; C1002-C1011 CovalentContact SG-SG 2.04Å; C1002-C1011 PolarHBondContact SG-SG 2.03Å; F1006-C1011 HydrophobicContact CB-CB 4.42Å; E1007-C1011 CarbonylContact O-C 3.21Å; E1007-C1011 VanDerWaalsContact O-C 3.3Å; E1007-C1011 VanDerWaalsContact O-CA 3.25Å; E1007-C1011 WeakPolarHBondContact O-CA 3.46Å; G1008-C1011 PolarHBondContact O-N 3.19Å
1012	E	86.5	Confident	82.9	Confident	58 Å²	58	60.8 Å²	60.8	27%	0.271	33%	0.329	S	S	.	.			trans	-79.7	-17.1	-175.7	77	-68.1	168	0	0	113.7	Q990 E1007 G1008 D1009 Y1010	Q990-E1012 HydrophobicContact CG-CB 4.45Å; E1007-E1012 PolarHBondContact O-N 3.02Å; G1008-E1012 WeakPolarHBondContact CA-OE1 3.17Å; D1009-E1012 PolarHBondContact N-OE2 2.99Å; Y1010-E1012 VanDerWaalsContact CA-OE2 3.32Å; Y1010-E1012 WeakPolarHBondContact CA-OE2 3.26Å; Y1010-E1012 WeakPolarHBondContact CB-OE2 3.01Å; Y1010-E1012 PolarHBondContact N-OE2 3.25Å; Y1010-E1012 PolarHBondContact O-N 3.26Å
1013	K	85.3	Confident	82.3	Confident	104 Å²	104	65.5 Å²	65.5	45%	0.452	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	140.6	-179.8	-61.4	169.8	-168.8	164.1	0	110.4	F1006 E1007	F1006-K1013 CarbonylContact C-O 2.89Å; F1006-K1013 WeakPolarHBondContact CA-O 2.96Å; F1006-K1013 WeakPolarHBondContact CD1-O 3.3Å; E1007-K1013 HydrophobicContact CG-CB 3.91Å; E1007-K1013 PolarHBondContact N-O 2.76Å; E1007-K1013 WeakPolarHBondContact O-CB 3.48Å; E1007-K1013 PolarHBondContact O-N 3.35Å
1014	D	87.1	Confident	82	Confident	38 Å²	38	68.5 Å²	68.5	20%	0.203	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.9	165.1	-171.4	34.4	0	0	0	109.4	N1016 N1033 T1034 Y1035 G1036	D1014-N1016 PolarHBondContact O-N 2.82Å; D1014-N1033 PolarHBondContact OD2-ND2 2.78Å; D1014-T1034 VanDerWaalsContact OD2-O 3.08Å; D1014-Y1035 HydrophobicContact CB-CD2 3.9Å; D1014-Y1035 HydrophobicContact CB-CE2 4.1Å; D1014-G1036 PolarHBondContact OD1-N 3.44Å
1015	K	84	Confident	81.7	Confident	58 Å²	58	64.5 Å²	64.5	25%	0.252	33%	0.326	S	S	.	.			trans	-86.2	102.3	-176.6	-173.7	-154.3	-173.3	-158.4	0	109	S1004 N1005 E1007 E1017 Q1020	S1004-K1015 WeakPolarHBondContact O-CD 3.43Å; N1005-K1015 VanDerWaalsContact C-CB 3.43Å; N1005-K1015 WeakPolarHBondContact O-CB 3.45Å; N1005-K1015 PolarHBondContact O-N 3.11Å; E1007-K1015 HydrophobicContact CB-CB 4.41Å; E1007-K1015 HydrophobicContact CB-CG 4.47Å; E1007-K1015 HydrophobicContact CG-CB 4.2Å; E1007-K1015 HydrophobicContact CG-CG 4.41Å; K1015-E1017 WeakPolarHBondContact O-CG 3.39Å; K1015-E1017 PolarHBondContact O-N 3.08Å; K1015-Q1020 VanDerWaalsContact CE-NE2 3.27Å
1016	N	86.2	Confident	81.4	Confident	46 Å²	46	64.5 Å²	64.5	25%	0.246	33%	0.329	C	S	.	.			trans	-60.8	103	-176.9	-172	-0.7	0	0	0	111.9	D1014 C1018 D1019 Q1020 N1033	D1014-N1016 PolarHBondContact O-N 2.82Å; N1016-C1018 VanDerWaalsContact C-N 3.25Å; N1016-C1018 PolarHBondContact O-N 2.85Å; N1016-C1018 WeakPolarHBondContact OD1-CA 3.07Å; N1016-C1018 WeakPolarHBondContact OD1-CB 3.26Å; N1016-C1018 PolarHBondContact OD1-N 2.84Å; N1016-D1019 HydrophobicContact CB-CB 4.25Å; N1016-D1019 PolarHBondContact ND2-OD1 3.07Å; N1016-D1019 PolarHBondContact ND2-OD2 3.26Å; N1016-D1019 PolarHBondContact O-N 3.15Å; N1016-D1019 PolarHBondContact OD1-N 2.04Å; N1016-Q1020 PolarHBondContact O-NE2 2.81Å; N1016-N1033 WeakPolarHBondContact CA-OD1 3.05Å; N1016-N1033 VanDerWaalsContact OD1-CB 3.31Å; N1016-N1033 WeakPolarHBondContact OD1-CB 2.95Å; N1016-N1033 PolarHBondContact OD1-OD1 3.1Å
1017	E	85.4	Confident	81.1	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.047	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.6	-179.2	-69.2	129.3	152.9	0	0	112.7	N1005 K1015 H1025 N1033 S1037 Y1038	N1005-E1017 WeakPolarHBondContact CA-OE1 3.47Å; N1005-E1017 WeakPolarHBondContact CB-OE1 3.11Å; K1015-E1017 WeakPolarHBondContact O-CG 3.39Å; K1015-E1017 PolarHBondContact O-N 3.08Å; E1017-H1025 VanDerWaalsContact O-CB 3.29Å; E1017-H1025 WeakPolarHBondContact O-CB 3.05Å; E1017-H1025 PolarHBondContact O-CD2 2.88Å; E1017-N1033 PolarHBondContact N-OD1 3.5Å; E1017-S1037 VanDerWaalsContact OE2-C 3.22Å; E1017-Y1038 HydrophobicContact CB-CD1 3.2Å; E1017-Y1038 HydrophobicContact CB-CE1 3.68Å; E1017-Y1038 HydrophobicContact CB-CG 3.84Å; E1017-Y1038 HydrophobicContact CG-CD1 3.75Å; E1017-Y1038 HydrophobicContact CG-CE1 4Å; E1017-Y1038 WeakPolarHBondContact OE2-CD1 3.29Å; E1017-Y1038 PolarHBondContact OE2-N 2.84Å
1018	C	86	Confident	80.7	Confident	33 Å²	33	63.6 Å²	63.6	22%	0.223	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-12	170.9	-49.9	0	0	0	0	113.6	N1016 C1031 N1033	N1016-C1018 VanDerWaalsContact C-N 3.25Å; N1016-C1018 PolarHBondContact O-N 2.85Å; N1016-C1018 WeakPolarHBondContact OD1-CA 3.07Å; N1016-C1018 WeakPolarHBondContact OD1-CB 3.26Å; N1016-C1018 PolarHBondContact OD1-N 2.84Å; C1018-C1031 WeakPolarHBondContact CA-SG 3.5Å; C1018-C1031 HydrophobicContact CB-CB 3.59Å; C1018-C1031 WeakPolarHBondContact CB-SG 3.01Å; C1018-C1031 WeakPolarHBondContact SG-CB 3.4Å; C1018-C1031 CovalentContact SG-SG 2.04Å; C1018-C1031 PolarHBondContact SG-SG 2.59Å; C1018-N1033 PolarHBondContact SG-N 2.04Å; C1018-N1033 VanDerWaalsContact SG-N 3.35Å
1019	D	86.8	Confident	80.3	Confident	134 Å²	134	66.5 Å²	66.5	72%	0.717	34%	0.336	S	S	*	.	S	Bend	trans	-89.9	-6.8	169.9	-69.2	-17.4	0	0	0	112.3	N1016	N1016-D1019 HydrophobicContact CB-CB 4.25Å; N1016-D1019 PolarHBondContact ND2-OD1 3.07Å; N1016-D1019 PolarHBondContact ND2-OD2 3.26Å; N1016-D1019 PolarHBondContact O-N 3.15Å; N1016-D1019 PolarHBondContact OD1-N 2.04Å
1020	Q	79.3	Confident	80.2	Confident	46 Å²	46	62.7 Å²	62.7	22%	0.215	32%	0.321	C	S	.	.	S	Bend	trans	-83.7	174.6	175.9	-85.3	153.4	80.1	0	0	112.1	K1015 N1016 E1024	K1015-Q1020 VanDerWaalsContact CE-NE2 3.27Å; N1016-Q1020 PolarHBondContact O-NE2 2.81Å; Q1020-E1024 HydrophobicContact CB-CB 4.44Å
1021	S	73.9	Confident	80.3	Confident	58 Å²	58	58.9 Å²	58.9	41%	0.406	31%	0.31	S	S	.	.			trans	-65.3	144.1	177.9	-178.5	0	0	0	0	111.5	F1023 E1024 H1025	S1021-F1023 PolarHBondContact O-N 2.88Å; S1021-F1023 PolarHBondContact OG-N 3.49Å; S1021-E1024 WeakPolarHBondContact CB-OE2 3.36Å; S1021-E1024 PolarHBondContact N-OE2 3.26Å; S1021-E1024 VanDerWaalsContact N-OE2 3.08Å; S1021-E1024 WeakPolarHBondContact O-CA 3.24Å; S1021-E1024 WeakPolarHBondContact O-CB 3.45Å; S1021-E1024 PolarHBondContact O-N 2.85Å; S1021-H1025 PolarHBondContact O-CD2 3.16Å; S1021-H1025 PolarHBondContact O-N 2.86Å; S1021-H1025 VanDerWaalsContact O-N 3.15Å
1022	V	71.4	Confident	80.3	Confident	88 Å²	88	63.1 Å²	63.1	53%	0.533	33%	0.332	S	S	.	.	H	α-helix	trans	-57.3	-23.7	171.4	-175.2	0	0	0	0	111.6	H1025 S1026	V1022-H1025 WeakPolarHBondContact CA-NE2 3.32Å; V1022-S1026 WeakPolarHBondContact O-CA 3.46Å; V1022-S1026 PolarHBondContact O-N 3.16Å
1023	F	69.2	Low	80.2	Confident	139 Å²	139	62.7 Å²	62.7	61%	0.61	33%	0.332	S	S	*	.	H	α-helix	trans	-71.3	-24.3	171.6	-75.5	-75.2	0	0	0	114.2	R249 S1021	R249-F1023 VanDerWaalsContact NH1-CE1 3.3Å; S1021-F1023 PolarHBondContact O-N 2.88Å; S1021-F1023 PolarHBondContact OG-N 3.49Å
1024	E	71.7	Confident	80.1	Confident	118 Å²	118	60 Å²	60	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-88.5	-47.7	178.4	-65.8	173.1	113.1	0	0	111.4	Q1020 S1021	Q1020-E1024 HydrophobicContact CB-CB 4.44Å; S1021-E1024 WeakPolarHBondContact CB-OE2 3.36Å; S1021-E1024 PolarHBondContact N-OE2 3.26Å; S1021-E1024 VanDerWaalsContact N-OE2 3.08Å; S1021-E1024 WeakPolarHBondContact O-CA 3.24Å; S1021-E1024 WeakPolarHBondContact O-CB 3.45Å; S1021-E1024 PolarHBondContact O-N 2.85Å
1025	H	74.1	Confident	80	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-89.9	-16.1	-177.9	75.7	81.4	0	0	0	114.2	E1017 S1021 V1022 C1027 Y1038 R1053	E1017-H1025 VanDerWaalsContact O-CB 3.29Å; E1017-H1025 WeakPolarHBondContact O-CB 3.05Å; E1017-H1025 PolarHBondContact O-CD2 2.88Å; S1021-H1025 PolarHBondContact O-CD2 3.16Å; S1021-H1025 PolarHBondContact O-N 2.86Å; S1021-H1025 VanDerWaalsContact O-N 3.15Å; V1022-H1025 WeakPolarHBondContact CA-NE2 3.32Å; H1025-C1027 WeakPolarHBondContact ND1-CB 3.47Å; H1025-C1027 PolarHBondContact ND1-N 3.2Å; H1025-C1027 PolarHBondContact ND1-SG 2.85Å; H1025-C1027 PolarHBondContact O-N 3.48Å; H1025-Y1038 WeakPolarHBondContact CA-OH 3.22Å; H1025-Y1038 HydrophobicContact CB-CD2 4.34Å; H1025-Y1038 HydrophobicContact CB-CE1 4.28Å; H1025-Y1038 HydrophobicContact CB-CE2 3.83Å; H1025-Y1038 WeakPolarHBondContact O-CE2 3.35Å; H1025-Y1038 PolarHBondContact O-OH 2.81Å; H1025-Y1038 VanDerWaalsContact O-OH 3.06Å; H1025-R1053 PolarHBondContact O-NH1 2.02Å
1026	S	76.2	Confident	79.8	Confident	49 Å²	49	63.1 Å²	63.1	34%	0.343	34%	0.337	S	S	.	.			trans	59	13.8	173.2	-24.8	0	0	0	0	117.2	V1022 I1028 R1053	V1022-S1026 WeakPolarHBondContact O-CA 3.46Å; V1022-S1026 PolarHBondContact O-N 3.16Å; S1026-I1028 PolarHBondContact O-N 2.02Å; S1026-R1053 PolarHBondContact OG-NH1 2.03Å
1027	C	80.4	Confident	79.5	Confident	4 Å²	4	63.4 Å²	63.4	3%	0.027	34%	0.343	C	S	.	.			trans	-77.2	121.8	176.2	-57.4	0	0	0	0	110.8	H1025 G1030 C1031 C1040	H1025-C1027 WeakPolarHBondContact ND1-CB 3.47Å; H1025-C1027 PolarHBondContact ND1-N 3.2Å; H1025-C1027 PolarHBondContact ND1-SG 2.85Å; H1025-C1027 PolarHBondContact O-N 3.48Å; C1027-G1030 VanDerWaalsContact CB-O 3.3Å; C1027-G1030 WeakPolarHBondContact CB-O 3.48Å; C1027-C1031 HydrophobicContact CB-CB 4.14Å; C1027-C1040 WeakPolarHBondContact CA-SG 3.03Å; C1027-C1040 HydrophobicContact CB-CB 3.52Å; C1027-C1040 WeakPolarHBondContact CB-SG 3.2Å; C1027-C1040 WeakPolarHBondContact SG-CA 3.42Å; C1027-C1040 WeakPolarHBondContact SG-CB 3.43Å; C1027-C1040 CovalentContact SG-SG 2.02Å; C1027-C1040 PolarHBondContact SG-SG 2.91Å
1028	I	73.9	Confident	79.5	Confident	104 Å²	104	64.6 Å²	64.6	53%	0.533	35%	0.347	S	S	.	.	S	Bend	trans	-78.8	-37.3	-172.4	-58.3	176.8	0	0	0	113.3	S1026 T1054	S1026-I1028 PolarHBondContact O-N 2.02Å; I1028-T1054 HydrophobicContact CD1-CG2 4.04Å
1029	H	76.2	Confident	79.4	Confident	83 Å²	83	67.1 Å²	67.1	38%	0.384	36%	0.355	S	S	.	.	S	Bend	trans	-115.2	-14	-170.7	-66.7	82.8	0	0	0	114.9	P1043 Y1046	H1029-P1043 HydrophobicContact CB-CG 4.17Å; H1029-Y1046 AromaticContact NE2-CE1 3.71Å
1030	G	80.1	Confident	79.2	Confident	24 Å²	24	60.8 Å²	60.8	25%	0.247	32%	0.322	C	S	.	.			trans	161.8	160.4	-179.7	0	0	0	0	0	111.4	C1027 C1040 I1041	C1027-G1030 VanDerWaalsContact CB-O 3.3Å; C1027-G1030 WeakPolarHBondContact CB-O 3.48Å; G1030-C1040 CarbonylContact O-C 3.59Å; G1030-C1040 VanDerWaalsContact O-CA 3.31Å; G1030-C1040 WeakPolarHBondContact O-CA 3.03Å; G1030-I1041 PolarHBondContact O-N 2.96Å
1031	C	86.1	Confident	79.5	Confident	30 Å²	30	62.3 Å²	62.3	20%	0.203	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	134	-174.5	-177.5	0	0	0	0	109	C1018 C1027	C1018-C1031 WeakPolarHBondContact CA-SG 3.5Å; C1018-C1031 HydrophobicContact CB-CB 3.59Å; C1018-C1031 WeakPolarHBondContact CB-SG 3.01Å; C1018-C1031 WeakPolarHBondContact SG-CB 3.4Å; C1018-C1031 CovalentContact SG-SG 2.04Å; C1018-C1031 PolarHBondContact SG-SG 2.59Å; C1027-C1031 HydrophobicContact CB-CB 4.14Å
1032	I	86.3	Confident	79.7	Confident	89 Å²	89	61.4 Å²	61.4	46%	0.456	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.6	168.9	-66.5	-177.4	0	0	0	107.6	Y1038 E1039 I1041	I1032-Y1038 WeakPolarHBondContact O-CA 3.37Å; I1032-E1039 PolarHBondContact N-O 2.89Å; I1032-E1039 PolarHBondContact O-N 2.88Å; I1032-I1041 HydrophobicContact CD1-CD1 4.38Å; I1032-I1041 HydrophobicContact CD1-CG2 3.53Å; I1032-I1041 HydrophobicContact CG1-CD1 4.26Å; I1032-I1041 HydrophobicContact CG1-CG2 3.79Å
1033	N	83.7	Confident	80	Confident	50 Å²	50	59.9 Å²	59.9	27%	0.267	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	141.4	176.7	-165.7	63.8	0	0	0	111	D1014 N1016 E1017 C1018	D1014-N1033 PolarHBondContact OD2-ND2 2.78Å; N1016-N1033 WeakPolarHBondContact CA-OD1 3.05Å; N1016-N1033 VanDerWaalsContact OD1-CB 3.31Å; N1016-N1033 WeakPolarHBondContact OD1-CB 2.95Å; N1016-N1033 PolarHBondContact OD1-OD1 3.1Å; E1017-N1033 PolarHBondContact N-OD1 3.5Å; C1018-N1033 PolarHBondContact SG-N 2.04Å; C1018-N1033 VanDerWaalsContact SG-N 3.35Å
1034	T	83.3	Confident	80.4	Confident	48 Å²	48	61.3 Å²	61.3	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	158.6	-179.3	69.8	0	0	0	0	109.7	D1014 G1036 S1037 E1039	D1014-T1034 VanDerWaalsContact OD2-O 3.08Å; T1034-G1036 PolarHBondContact O-N 3.03Å; T1034-S1037 CarbonylContact C-O 3.49Å; T1034-S1037 VanDerWaalsContact C-O 3.24Å; T1034-S1037 VanDerWaalsContact CA-O 3.26Å; T1034-S1037 WeakPolarHBondContact CA-O 3.41Å; T1034-S1037 WeakPolarHBondContact CB-O 3.17Å; T1034-S1037 PolarHBondContact N-O 3.34Å; T1034-S1037 CarbonylContact O-C 3.59Å; T1034-S1037 PolarHBondContact O-N 3.15Å; T1034-S1037 VanDerWaalsContact O-N 3.08Å; T1034-S1037 VanDerWaalsContact OG1-C 3.24Å; T1034-S1037 PolarHBondContact OG1-O 2.03Å; T1034-E1039 HydrophobicContact CG2-CG 4.35Å
1035	Y	86.2	Confident	80.3	Confident	146 Å²	146	57.7 Å²	57.7	57%	0.573	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	105.2	-173	-165.3	-97.3	0	0	0	112.6	N991 F1006 D1014	N991-Y1035 PolarHBondContact ND2-OH 2.04Å; N991-Y1035 PolarHBondContact OD1-OH 2.99Å; F1006-Y1035 HydrophobicContact CE1-CD1 4.18Å; F1006-Y1035 AromaticContact CE1-CE1 3.72Å; F1006-Y1035 HydrophobicContact CE1-CE1 3.72Å; F1006-Y1035 HydrophobicContact CE1-CE2 4.33Å; F1006-Y1035 AromaticContact CE1-CZ 3.82Å; F1006-Y1035 HydrophobicContact CZ-CD1 4.41Å; F1006-Y1035 HydrophobicContact CZ-CE1 4.16Å; D1014-Y1035 HydrophobicContact CB-CD2 3.9Å; D1014-Y1035 HydrophobicContact CB-CE2 4.1Å
1036	G	79.6	Confident	80.5	Confident	15 Å²	15	61.2 Å²	61.2	16%	0.155	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	17.1	-177.2	0	0	0	0	0	115.5	N1005 D1014 T1034	N1005-G1036 WeakPolarHBondContact CB-O 3.42Å; N1005-G1036 PolarHBondContact ND2-O 2.98Å; D1014-G1036 PolarHBondContact OD1-N 3.44Å; T1034-G1036 PolarHBondContact O-N 3.03Å
1037	S	80.2	Confident	80.6	Confident	51 Å²	51	63.7 Å²	63.7	36%	0.357	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.8	171.7	179	-174.7	0	0	0	0	111	E1017 T1034	E1017-S1037 VanDerWaalsContact OE2-C 3.22Å; T1034-S1037 CarbonylContact C-O 3.49Å; T1034-S1037 VanDerWaalsContact C-O 3.24Å; T1034-S1037 VanDerWaalsContact CA-O 3.26Å; T1034-S1037 WeakPolarHBondContact CA-O 3.41Å; T1034-S1037 WeakPolarHBondContact CB-O 3.17Å; T1034-S1037 PolarHBondContact N-O 3.34Å; T1034-S1037 CarbonylContact O-C 3.59Å; T1034-S1037 PolarHBondContact O-N 3.15Å; T1034-S1037 VanDerWaalsContact O-N 3.08Å; T1034-S1037 VanDerWaalsContact OG1-C 3.24Å; T1034-S1037 PolarHBondContact OG1-O 2.03Å
1038	Y	85.6	Confident	80.1	Confident	36 Å²	36	67.6 Å²	67.6	14%	0.141	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	160.6	163.3	57	-77.4	0	0	0	111.7	E1017 H1025 I1032 R1053	E1017-Y1038 HydrophobicContact CB-CD1 3.2Å; E1017-Y1038 HydrophobicContact CB-CE1 3.68Å; E1017-Y1038 HydrophobicContact CB-CG 3.84Å; E1017-Y1038 HydrophobicContact CG-CD1 3.75Å; E1017-Y1038 HydrophobicContact CG-CE1 4Å; E1017-Y1038 WeakPolarHBondContact OE2-CD1 3.29Å; E1017-Y1038 PolarHBondContact OE2-N 2.84Å; H1025-Y1038 WeakPolarHBondContact CA-OH 3.22Å; H1025-Y1038 HydrophobicContact CB-CD2 4.34Å; H1025-Y1038 HydrophobicContact CB-CE1 4.28Å; H1025-Y1038 HydrophobicContact CB-CE2 3.83Å; H1025-Y1038 WeakPolarHBondContact O-CE2 3.35Å; H1025-Y1038 PolarHBondContact O-OH 2.81Å; H1025-Y1038 VanDerWaalsContact O-OH 3.06Å; I1032-Y1038 WeakPolarHBondContact O-CA 3.37Å; Y1038-R1053 PolarHBondContact OH-NH1 3.21Å; Y1038-R1053 PolarHBondContact OH-NH2 3.02Å
1039	E	82.6	Confident	79.8	Confident	85 Å²	85	63.2 Å²	63.2	40%	0.397	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.1	169.1	-75.9	-147.4	-147.4	0	0	110.2	I1032 T1034 R1048	I1032-E1039 PolarHBondContact N-O 2.89Å; I1032-E1039 PolarHBondContact O-N 2.88Å; T1034-E1039 HydrophobicContact CG2-CG 4.35Å; E1039-R1048 IonicContact OE2-CZ 2.76Å; E1039-R1048 IonicContact OE2-NH1 2.72Å; E1039-R1048 PolarHBondContact OE2-NH1 3.48Å; E1039-R1048 IonicContact OE2-NH2 3.86Å; E1039-R1048 PolarHBondContact OE2-NH2 3.07Å
1040	C	83.3	Confident	79.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.007	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137	172.7	-51.6	0	0	0	0	110.2	C1027 G1030 R1048 K1052	C1027-C1040 WeakPolarHBondContact CA-SG 3.03Å; C1027-C1040 HydrophobicContact CB-CB 3.52Å; C1027-C1040 WeakPolarHBondContact CB-SG 3.2Å; C1027-C1040 WeakPolarHBondContact SG-CA 3.42Å; C1027-C1040 WeakPolarHBondContact SG-CB 3.43Å; C1027-C1040 CovalentContact SG-SG 2.02Å; C1027-C1040 PolarHBondContact SG-SG 2.91Å; G1030-C1040 CarbonylContact O-C 3.59Å; G1030-C1040 VanDerWaalsContact O-CA 3.31Å; G1030-C1040 WeakPolarHBondContact O-CA 3.03Å; C1040-R1048 WeakPolarHBondContact O-CD 3.25Å; C1040-R1048 PolarHBondContact O-NH1 2.87Å; C1040-K1052 WeakPolarHBondContact CB-O 3.05Å
1041	I	84.9	Confident	78.6	Confident	78 Å²	78	64.4 Å²	64.4	40%	0.4	34%	0.344	S	S	.	.			trans	-105.8	152.2	178.6	54.2	168.7	0	0	0	111.8	G1030 I1032 C1055	G1030-I1041 PolarHBondContact O-N 2.96Å; I1032-I1041 HydrophobicContact CD1-CD1 4.38Å; I1032-I1041 HydrophobicContact CD1-CG2 3.53Å; I1032-I1041 HydrophobicContact CG1-CD1 4.26Å; I1032-I1041 HydrophobicContact CG1-CG2 3.79Å; I1041-C1055 PolarHBondContact O-SG 2.98Å; I1041-C1055 VanDerWaalsContact O-SG 3.39Å
1042	C	78.8	Confident	77.8	Confident	39 Å²	39	69.2 Å²	69.2	26%	0.264	36%	0.361	S	S	.	.			trans	-115.2	146.1	179.6	-53.8	0	0	0	0	110.1	Y1046 C1055	C1042-Y1046 WeakPolarHBondContact CB-O 3.49Å; C1042-C1055 WeakPolarHBondContact CA-SG 3.27Å; C1042-C1055 HydrophobicContact CB-CB 3.64Å; C1042-C1055 WeakPolarHBondContact CB-SG 3.23Å; C1042-C1055 WeakPolarHBondContact SG-CB 3.32Å; C1042-C1055 CovalentContact SG-SG 2.03Å; C1042-C1055 PolarHBondContact SG-SG 2.95Å
1043	P	77.5	Confident	77.2	Confident	56 Å²	56	69.3 Å²	69.3	36%	0.364	36%	0.356	S	S	.	.			trans	-66.5	162.6	171.6	-17.1	31.4	0	0	0	111.8	H1029 G1045 Y1046	H1029-P1043 HydrophobicContact CB-CG 4.17Å; P1043-G1045 PolarHBondContact O-N 3.18Å; P1043-Y1046 HydrophobicContact CB-CD2 4.02Å; P1043-Y1046 HydrophobicContact CB-CE2 4.47Å; P1043-Y1046 HydrophobicContact CG-CD2 4.23Å; P1043-Y1046 WeakPolarHBondContact O-CB 3.28Å; P1043-Y1046 PolarHBondContact O-N 2.95Å
1044	D	76.9	Confident	76.8	Confident	170 Å²	170	68.7 Å²	68.7	91%	0.909	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	133.3	171.4	-66.6	-47.6	0	0	0	111
1045	G	70.5	Confident	76.5	Confident	42 Å²	42	66.9 Å²	66.9	43%	0.433	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	15.1	-173.1	0	0	0	0	0	115	P1043 E1058	P1043-G1045 PolarHBondContact O-N 3.18Å; G1045-E1058 PolarHBondContact O-N 2.8Å
1046	Y	77.8	Confident	75.7	Confident	85 Å²	85	61.2 Å²	61.2	33%	0.333	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.2	170.6	-69.8	-115.5	0	0	0	110.6	H1029 C1042 P1043 C1055 V1056 K1057	H1029-Y1046 AromaticContact NE2-CE1 3.71Å; C1042-Y1046 WeakPolarHBondContact CB-O 3.49Å; P1043-Y1046 HydrophobicContact CB-CD2 4.02Å; P1043-Y1046 HydrophobicContact CB-CE2 4.47Å; P1043-Y1046 HydrophobicContact CG-CD2 4.23Å; P1043-Y1046 WeakPolarHBondContact O-CB 3.28Å; P1043-Y1046 PolarHBondContact O-N 2.95Å; Y1046-C1055 HydrophobicContact CD1-CB 4.49Å; Y1046-V1056 CarbonylContact C-O 3.59Å; Y1046-V1056 VanDerWaalsContact CA-O 3.26Å; Y1046-V1056 WeakPolarHBondContact CA-O 3.43Å; Y1046-K1057 HydrophobicContact CD1-CB 3.95Å; Y1046-K1057 VanDerWaalsContact CD1-N 3.35Å; Y1046-K1057 HydrophobicContact CE1-CB 3.7Å; Y1046-K1057 HydrophobicContact CE1-CG 4.39Å; Y1046-K1057 HydrophobicContact CE2-CB 4.47Å; Y1046-K1057 HydrophobicContact CE2-CD 4.47Å; Y1046-K1057 HydrophobicContact CE2-CG 4.34Å; Y1046-K1057 HydrophobicContact CG-CB 4.43Å
1047	R	77.8	Confident	75	Confident	101 Å²	101	65.6 Å²	65.6	38%	0.381	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	144.2	174.5	68	178.4	-172	87.5	-2.1	111.6	C1055 V1056 E1058	R1047-C1055 WeakPolarHBondContact O-CA 3.32Å; R1047-V1056 HydrophobicContact CG-CG2 3.65Å; R1047-V1056 PolarHBondContact N-O 3.1Å; R1047-V1056 PolarHBondContact O-N 2.96Å; R1047-E1058 HydrophobicContact CB-CG 4.16Å; R1047-E1058 HydrophobicContact CG-CG 4.25Å
1048	R	71.1	Confident	74.1	Confident	86 Å²	86	69 Å²	69	33%	0.325	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.3	175.3	-157.4	164.1	66	178.9	1.3	110.3	E1039 C1040	E1039-R1048 IonicContact OE2-CZ 2.76Å; E1039-R1048 IonicContact OE2-NH1 2.72Å; E1039-R1048 PolarHBondContact OE2-NH1 3.48Å; E1039-R1048 IonicContact OE2-NH2 3.86Å; E1039-R1048 PolarHBondContact OE2-NH2 3.07Å; C1040-R1048 WeakPolarHBondContact O-CD 3.25Å; C1040-R1048 PolarHBondContact O-NH1 2.87Å
1049	L	66.7	Low	72.6	Confident	13 Å²	13	72 Å²	72	7%	0.068	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-77.9	172.1	174.2	-65.2	-172.6	0	0	0	111.8	D1051 K1052 T1054 V1056 I1072	L1049-D1051 WeakPolarHBondContact CB-OD1 3.08Å; L1049-D1051 PolarHBondContact O-N 3.15Å; L1049-K1052 PolarHBondContact O-N 3.26Å; L1049-T1054 HydrophobicContact CD1-CG2 3.61Å; L1049-T1054 HydrophobicContact CG-CG2 4.14Å; L1049-T1054 PolarHBondContact N-O 3.4Å; L1049-V1056 HydrophobicContact CD1-CG1 3.95Å; L1049-V1056 HydrophobicContact CD2-CG1 4.01Å; L1049-V1056 HydrophobicContact CD2-CG2 3.65Å; L1049-V1056 HydrophobicContact CG-CG1 4.01Å; L1049-V1056 HydrophobicContact CG-CG2 4.3Å; L1049-I1072 HydrophobicContact CD1-CD1 3.56Å; L1049-I1072 HydrophobicContact CD1-CG1 3.59Å; L1049-I1072 HydrophobicContact CD2-CG1 4.23Å
1050	A	64.9	Low	71.2	Confident	67 Å²	67	76.2 Å²	76.2	55%	0.554	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.1	179.4	0	0	0	0	0	113.5	K1052	A1050-K1052 PolarHBondContact O-N 3.22Å
1051	D	67.1	Low	70	Confident	65 Å²	65	79 Å²	79	35%	0.348	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.2	172.2	73.3	-8.5	0	0	0	113.8	L1049 R1053 T1054	L1049-D1051 WeakPolarHBondContact CB-OD1 3.08Å; L1049-D1051 PolarHBondContact O-N 3.15Å; D1051-R1053 PolarHBondContact O-N 2.96Å; D1051-R1053 VanDerWaalsContact O-N 3.13Å; D1051-R1053 PolarHBondContact OD1-N 2.85Å; D1051-T1054 PolarHBondContact OD1-N 3.24Å; D1051-T1054 WeakPolarHBondContact OD2-CB 3.38Å; D1051-T1054 PolarHBondContact OD2-N 2.92Å; D1051-T1054 PolarHBondContact OD2-OG1 2.84Å
1052	K	68.7	Low	68.7	Low	130 Å²	130	79.9 Å²	79.9	57%	0.565	42%	0.422	S	S	*	.	S	Bend	trans	57.2	13.2	-172.4	-55.7	-177.2	-177.1	179.9	0	115.1	C1040 L1049 A1050	C1040-K1052 WeakPolarHBondContact CB-O 3.05Å; L1049-K1052 PolarHBondContact O-N 3.26Å; A1050-K1052 PolarHBondContact O-N 3.22Å
1053	R	75	Confident	68.1	Low	92 Å²	92	78.6 Å²	78.6	35%	0.347	41%	0.414	S	S	.	.	S	Bend	trans	-119.6	-39.9	-173.6	-69.7	167.6	-176.7	-118.8	0.3	113	H1025 S1026 Y1038 D1051	H1025-R1053 PolarHBondContact O-NH1 2.02Å; S1026-R1053 PolarHBondContact OG-NH1 2.03Å; Y1038-R1053 PolarHBondContact OH-NH1 3.21Å; Y1038-R1053 PolarHBondContact OH-NH2 3.02Å; D1051-R1053 PolarHBondContact O-N 2.96Å; D1051-R1053 VanDerWaalsContact O-N 3.13Å; D1051-R1053 PolarHBondContact OD1-N 2.85Å
1054	T	75.5	Confident	68	Low	37 Å²	37	81.7 Å²	81.7	23%	0.227	43%	0.427	C	S	.	.			trans	-90.3	133	-178.9	-58.8	0	0	0	0	110.5	I1028 L1049 D1051 V1056	I1028-T1054 HydrophobicContact CD1-CG2 4.04Å; L1049-T1054 HydrophobicContact CD1-CG2 3.61Å; L1049-T1054 HydrophobicContact CG-CG2 4.14Å; L1049-T1054 PolarHBondContact N-O 3.4Å; D1051-T1054 PolarHBondContact OD1-N 3.24Å; D1051-T1054 WeakPolarHBondContact OD2-CB 3.38Å; D1051-T1054 PolarHBondContact OD2-N 2.92Å; D1051-T1054 PolarHBondContact OD2-OG1 2.84Å; T1054-V1056 HydrophobicContact CG2-CG1 4.2Å
1055	C	76.7	Confident	67.9	Low	9 Å²	9	76.9 Å²	76.9	6%	0.061	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.6	169.5	-59.3	0	0	0	0	108.9	I1041 C1042 Y1046 R1047	I1041-C1055 PolarHBondContact O-SG 2.98Å; I1041-C1055 VanDerWaalsContact O-SG 3.39Å; C1042-C1055 WeakPolarHBondContact CA-SG 3.27Å; C1042-C1055 HydrophobicContact CB-CB 3.64Å; C1042-C1055 WeakPolarHBondContact CB-SG 3.23Å; C1042-C1055 WeakPolarHBondContact SG-CB 3.32Å; C1042-C1055 CovalentContact SG-SG 2.03Å; C1042-C1055 PolarHBondContact SG-SG 2.95Å; Y1046-C1055 HydrophobicContact CD1-CB 4.49Å; R1047-C1055 WeakPolarHBondContact O-CA 3.32Å
1056	V	68.5	Low	68.4	Low	28 Å²	28	78.9 Å²	78.9	17%	0.17	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.6	173.2	-63.7	0	0	0	0	109.4	Y1046 R1047 L1049 T1054 I1072	Y1046-V1056 CarbonylContact C-O 3.59Å; Y1046-V1056 VanDerWaalsContact CA-O 3.26Å; Y1046-V1056 WeakPolarHBondContact CA-O 3.43Å; R1047-V1056 HydrophobicContact CG-CG2 3.65Å; R1047-V1056 PolarHBondContact N-O 3.1Å; R1047-V1056 PolarHBondContact O-N 2.96Å; L1049-V1056 HydrophobicContact CD1-CG1 3.95Å; L1049-V1056 HydrophobicContact CD2-CG1 4.01Å; L1049-V1056 HydrophobicContact CD2-CG2 3.65Å; L1049-V1056 HydrophobicContact CG-CG1 4.01Å; L1049-V1056 HydrophobicContact CG-CG2 4.3Å; T1054-V1056 HydrophobicContact CG2-CG1 4.2Å; V1056-I1072 HydrophobicContact CG1-CG2 4.44Å
1057	K	66	Low	68.6	Low	106 Å²	106	76.3 Å²	76.3	46%	0.461	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	142.4	174.7	-175.3	162.8	169.7	-87.7	0	109.7	Y1046 D1059	Y1046-K1057 HydrophobicContact CD1-CB 3.95Å; Y1046-K1057 VanDerWaalsContact CD1-N 3.35Å; Y1046-K1057 HydrophobicContact CE1-CB 3.7Å; Y1046-K1057 HydrophobicContact CE1-CG 4.39Å; Y1046-K1057 HydrophobicContact CE2-CB 4.47Å; Y1046-K1057 HydrophobicContact CE2-CD 4.47Å; Y1046-K1057 HydrophobicContact CE2-CG 4.34Å; Y1046-K1057 HydrophobicContact CG-CB 4.43Å; K1057-D1059 IonicContact NZ-OD1 3.5Å; K1057-D1059 PolarHBondContact NZ-OD1 2.89Å; K1057-D1059 IonicContact NZ-OD2 3.18Å; K1057-D1059 PolarHBondContact O-N 3.21Å
1058	E	60.8	Low	69	Low	124 Å²	124	76.8 Å²	76.8	58%	0.579	41%	0.411	S	S	*	.			trans	-76.3	65.6	169.5	-64	-165.5	135.6	0	0	109.9	G1045 R1047	G1045-E1058 PolarHBondContact O-N 2.8Å; R1047-E1058 HydrophobicContact CB-CG 4.16Å; R1047-E1058 HydrophobicContact CG-CG 4.25Å
1059	D	54.6	Low	69.5	Low	99 Å²	99	75.8 Å²	75.8	53%	0.529	41%	0.413	S	S	.	.			trans	-67.1	134.9	161.4	-73.9	-44.2	0	0	0	108.7	K1057 V1061	K1057-D1059 IonicContact NZ-OD1 3.5Å; K1057-D1059 PolarHBondContact NZ-OD1 2.89Å; K1057-D1059 IonicContact NZ-OD2 3.18Å; K1057-D1059 PolarHBondContact O-N 3.21Å; D1059-V1061 PolarHBondContact O-N 2.88Å
1060	N	51.6	Low	69.9	Low	173 Å²	173	76.1 Å²	76.1	93%	0.925	42%	0.419	S	S	*	.	S	Bend	trans	-79.9	42.5	-161.7	-147.8	-1.2	0	0	0	113
1061	V	57.7	Low	70.7	Confident	60 Å²	60	73.1 Å²	73.1	36%	0.364	39%	0.394	S	S	.	.			trans	-99	92.8	-176.4	-173.2	0	0	0	0	108.5	D1059 C1063 C1073	D1059-V1061 PolarHBondContact O-N 2.88Å; V1061-C1063 PolarHBondContact O-N 2.79Å; V1061-C1073 PolarHBondContact O-SG 2.97Å; V1061-C1073 VanDerWaalsContact O-SG 3.38Å
1062	S	59.4	Low	71.3	Confident	95 Å²	95	71.4 Å²	71.4	66%	0.664	39%	0.385	S	S	*	.			trans	-76.9	97.9	173.7	-173.2	0	0	0	0	110.1	N1064	S1062-N1064 PolarHBondContact O-N 2.67Å
1063	C	66.3	Low	71.8	Confident	12 Å²	12	66.6 Å²	66.6	8%	0.081	37%	0.367	C	S	.	.			trans	-61.5	122.8	162.9	-80.9	0	0	0	0	108.4	V1061 P1065 P1066 C1073	V1061-C1063 PolarHBondContact O-N 2.79Å; C1063-P1065 CarbonylContact C-O 3.35Å; C1063-P1065 CarbonylContact O-C 3.24Å; C1063-P1066 WeakPolarHBondContact O-CA 3.25Å; C1063-C1073 VanDerWaalsContact CA-SG 3.6Å; C1063-C1073 HydrophobicContact CB-CB 3.82Å; C1063-C1073 WeakPolarHBondContact CB-SG 3.15Å; C1063-C1073 PolarHBondContact N-SG 2.88Å; C1063-C1073 VanDerWaalsContact N-SG 3.36Å; C1063-C1073 VanDerWaalsContact SG-CA 3.51Å; C1063-C1073 WeakPolarHBondContact SG-CB 3.04Å; C1063-C1073 CovalentContact SG-SG 2.03Å; C1063-C1073 PolarHBondContact SG-SG 2.77Å
1064	N	74.4	Confident	72	Confident	122 Å²	122	67.3 Å²	67.3	65%	0.652	37%	0.37	S	S	*	.	S	Bend	trans	-133.3	107.2	177.5	-164.1	6	0	0	0	109.1	S1062	S1062-N1064 PolarHBondContact O-N 2.67Å
1065	P	74.6	Confident	71.9	Confident	69 Å²	69	70.8 Å²	70.8	45%	0.448	39%	0.393	S	S	.	.	S	Bend	cis	-67	159.6	4.6	-18.9	33.6	0	0	0	114.3	C1063 Q1089	C1063-P1065 CarbonylContact C-O 3.35Å; C1063-P1065 CarbonylContact O-C 3.24Å; P1065-Q1089 HydrophobicContact CB-CG 4.32Å
1066	P	80.9	Confident	71.8	Confident	84 Å²	84	73.9 Å²	73.9	55%	0.545	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-71.5	157.2	178.9	31.2	-36.2	0	0	0	112.2	C1063	C1063-P1066 WeakPolarHBondContact O-CA 3.25Å
1067	C	82.8	Confident	72	Confident	30 Å²	30	76.8 Å²	76.8	20%	0.203	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-75.8	126.9	173.5	-47.2	0	0	0	0	111.1	G1071 C1079 Q1089	C1067-G1071 WeakPolarHBondContact CB-O 3.25Å; C1067-C1079 WeakPolarHBondContact CA-SG 3.27Å; C1067-C1079 HydrophobicContact CB-CB 3.76Å; C1067-C1079 WeakPolarHBondContact CB-SG 3.31Å; C1067-C1079 WeakPolarHBondContact SG-CB 3.13Å; C1067-C1079 CovalentContact SG-SG 2.03Å; C1067-C1079 PolarHBondContact SG-SG 3.07Å; C1067-Q1089 CarbonylContact C-O 3.56Å; C1067-Q1089 WeakPolarHBondContact CA-O 3.42Å
1068	E	85	Confident	72.6	Confident	112 Å²	112	76.9 Å²	76.9	52%	0.523	45%	0.446	S	S	.	.			trans	-83.7	177	171.2	-58.4	-147.8	163.1	0	0	111.7	G1070 G1071 Q1089	E1068-G1070 PolarHBondContact O-N 2.9Å; E1068-G1071 PolarHBondContact O-N 2.05Å; E1068-Q1089 PolarHBondContact N-O 2.76Å
1069	N	82.4	Confident	73.6	Confident	65 Å²	65	71.4 Å²	71.4	35%	0.348	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	18.3	174	-59.9	-47.6	0	0	0	117.2	T1082 Y1085 C1090	N1069-T1082 PolarHBondContact O-OG1 3.02Å; N1069-Y1085 HydrophobicContact CB-CD1 3.48Å; N1069-Y1085 VanDerWaalsContact CB-CD1 3.48Å; N1069-Y1085 HydrophobicContact CB-CD2 3.8Å; N1069-Y1085 HydrophobicContact CB-CE1 3.6Å; N1069-Y1085 HydrophobicContact CB-CE2 3.93Å; N1069-Y1085 HydrophobicContact CB-CG 3.57Å; N1069-Y1085 VanDerWaalsContact CG-CD1 3.45Å; N1069-Y1085 VanDerWaalsContact ND2-CD1 3.35Å; N1069-Y1085 WeakPolarHBondContact ND2-CD1 3.45Å; N1069-Y1085 WeakPolarHBondContact ND2-CE1 3.45Å; N1069-C1090 PolarHBondContact ND2-O 2.86Å
1070	G	75.8	Confident	75	Confident	19 Å²	19	70.9 Å²	70.9	20%	0.196	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	6.9	178.1	0	0	0	0	0	115.9	E1068	E1068-G1070 PolarHBondContact O-N 2.9Å
1071	G	81.9	Confident	76.5	Confident	4 Å²	4	64.8 Å²	64.8	4%	0.041	39%	0.387	C	S	.	.			trans	-54.5	145.3	-177.7	0	0	0	0	0	114.6	C1067 E1068 E1080	C1067-G1071 WeakPolarHBondContact CB-O 3.25Å; E1068-G1071 PolarHBondContact O-N 2.05Å; G1071-E1080 CarbonylContact C-O 3.46Å; G1071-E1080 WeakPolarHBondContact CA-O 3.42Å
1072	I	78.3	Confident	77.7	Confident	30 Å²	30	63.7 Å²	63.7	15%	0.154	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113	179.8	-51.1	176	0	0	0	108.6	L1049 V1056 R1074 E1080	L1049-I1072 HydrophobicContact CD1-CD1 3.56Å; L1049-I1072 HydrophobicContact CD1-CG1 3.59Å; L1049-I1072 HydrophobicContact CD2-CG1 4.23Å; V1056-I1072 HydrophobicContact CG1-CG2 4.44Å; I1072-R1074 PolarHBondContact O-N 3.37Å; I1072-E1080 HydrophobicContact CB-CB 4.29Å; I1072-E1080 PolarHBondContact N-O 3.28Å; I1072-E1080 PolarHBondContact O-N 2.62Å
1073	C	80.5	Confident	78.7	Confident	28 Å²	28	70.6 Å²	70.6	19%	0.189	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	125.6	171.1	-176.9	0	0	0	0	110.7	V1061 C1063	V1061-C1073 PolarHBondContact O-SG 2.97Å; V1061-C1073 VanDerWaalsContact O-SG 3.38Å; C1063-C1073 VanDerWaalsContact CA-SG 3.6Å; C1063-C1073 HydrophobicContact CB-CB 3.82Å; C1063-C1073 WeakPolarHBondContact CB-SG 3.15Å; C1063-C1073 PolarHBondContact N-SG 2.88Å; C1063-C1073 VanDerWaalsContact N-SG 3.36Å; C1063-C1073 VanDerWaalsContact SG-CA 3.51Å; C1063-C1073 WeakPolarHBondContact SG-CB 3.04Å; C1063-C1073 CovalentContact SG-SG 2.03Å; C1063-C1073 PolarHBondContact SG-SG 2.77Å
1074	R	78.6	Confident	79.5	Confident	108 Å²	108	70.2 Å²	70.2	41%	0.408	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	158.1	172.8	-62	-58.2	-168.1	170.8	4.4	110.5	I1072 G1076 N1077 L1078 E1080	I1072-R1074 PolarHBondContact O-N 3.37Å; R1074-G1076 PolarHBondContact O-N 3.43Å; R1074-N1077 PolarHBondContact O-N 3.49Å; R1074-L1078 PolarHBondContact N-O 3.15Å; R1074-E1080 HydrophobicContact CG-CB 4.28Å; R1074-E1080 IonicContact CZ-OE2 3.59Å; R1074-E1080 IonicContact NE-OE2 3.21Å; R1074-E1080 PolarHBondContact NE-OE2 3.44Å; R1074-E1080 IonicContact NH2-OE1 3.45Å; R1074-E1080 IonicContact NH2-OE2 3.83Å; R1074-E1080 PolarHBondContact NH2-OE2 2.65Å
1075	P	73.7	Confident	80.2	Confident	109 Å²	109	66.4 Å²	66.4	71%	0.708	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	130.2	175.8	-26.9	35.7	0	0	0	111.9
1076	G	73.4	Confident	80.7	Confident	75 Å²	75	66.6 Å²	66.6	77%	0.773	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.4	18.8	-176.8	0	0	0	0	0	115.8	R1074 L1078	R1074-G1076 PolarHBondContact O-N 3.43Å; G1076-L1078 PolarHBondContact O-N 2.79Å
1077	N	73.1	Confident	80.9	Confident	88 Å²	88	64 Å²	64	47%	0.471	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	30.1	-177.5	-67.3	-9.5	0	0	0	114.1	R1074	R1074-N1077 PolarHBondContact O-N 3.49Å
1078	L	78.1	Confident	81	Confident	108 Å²	108	68.5 Å²	68.5	57%	0.565	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.9	176	-179.6	62.4	0	0	0	109.9	R1074 G1076	R1074-L1078 PolarHBondContact N-O 3.15Å; G1076-L1078 PolarHBondContact O-N 2.79Å
1079	C	82.7	Confident	81	Confident	10 Å²	10	66 Å²	66	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122.4	171.5	-63.2	0	0	0	0	110.4	C1067 I1088	C1067-C1079 WeakPolarHBondContact CA-SG 3.27Å; C1067-C1079 HydrophobicContact CB-CB 3.76Å; C1067-C1079 WeakPolarHBondContact CB-SG 3.31Å; C1067-C1079 WeakPolarHBondContact SG-CB 3.13Å; C1067-C1079 CovalentContact SG-SG 2.03Å; C1067-C1079 PolarHBondContact SG-SG 3.07Å; C1079-I1088 WeakPolarHBondContact CB-O 3.49Å
1080	E	83.6	Confident	81.2	Confident	87 Å²	87	62.9 Å²	62.9	41%	0.407	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.3	169	178.1	-175.8	165.2	0	0	108.7	G1071 I1072 R1074	G1071-E1080 CarbonylContact C-O 3.46Å; G1071-E1080 WeakPolarHBondContact CA-O 3.42Å; I1072-E1080 HydrophobicContact CB-CB 4.29Å; I1072-E1080 PolarHBondContact N-O 3.28Å; I1072-E1080 PolarHBondContact O-N 2.62Å; R1074-E1080 HydrophobicContact CG-CB 4.28Å; R1074-E1080 IonicContact CZ-OE2 3.59Å; R1074-E1080 IonicContact NE-OE2 3.21Å; R1074-E1080 PolarHBondContact NE-OE2 3.44Å; R1074-E1080 IonicContact NH2-OE1 3.45Å; R1074-E1080 IonicContact NH2-OE2 3.83Å; R1074-E1080 PolarHBondContact NH2-OE2 2.65Å
1081	C	83.8	Confident	81.8	Confident	46 Å²	46	65.5 Å²	65.5	31%	0.311	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-83.1	146.7	-166.1	-57	0	0	0	0	114.3	Y1085 C1090	C1081-Y1085 WeakPolarHBondContact CB-O 2.97Å; C1081-C1090 WeakPolarHBondContact CA-SG 3.31Å; C1081-C1090 HydrophobicContact CB-CB 3.73Å; C1081-C1090 WeakPolarHBondContact CB-SG 3.44Å; C1081-C1090 WeakPolarHBondContact SG-CA 3.46Å; C1081-C1090 WeakPolarHBondContact SG-CB 2.96Å; C1081-C1090 CovalentContact SG-SG 2.04Å; C1081-C1090 PolarHBondContact SG-SG 2.59Å
1082	T	81.6	Confident	82.1	Confident	36 Å²	36	69.6 Å²	69.6	22%	0.221	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-63.5	148.5	168.5	39.6	0	0	0	0	110.3	N1069 G1084 Y1085	N1069-T1082 PolarHBondContact O-OG1 3.02Å; T1082-G1084 PolarHBondContact O-N 2.8Å; T1082-Y1085 PolarHBondContact O-N 2.88Å; T1082-Y1085 WeakPolarHBondContact OG1-CD2 3.41Å
1083	R	81.2	Confident	82.6	Confident	241 Å²	241	70.9 Å²	70.9	91%	0.909	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	126.5	176.2	-179.3	177.1	177.8	160.7	0.9	109.7
1084	G	82.9	Confident	82.8	Confident	3 Å²	3	70.6 Å²	70.6	3%	0.031	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	-9.9	-174.9	0	0	0	0	0	114.4	T1082 I1094	T1082-G1084 PolarHBondContact O-N 2.8Å; G1084-I1094 WeakPolarHBondContact O-CB 3.03Å; G1084-I1094 PolarHBondContact O-N 3.21Å
1085	Y	89.2	Confident	83.1	Confident	42 Å²	42	68.4 Å²	68.4	17%	0.165	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.2	-177.4	-63.4	-84.8	0	0	0	113.5	N1069 C1081 T1082 L1092 I1094 P1114 G1115	N1069-Y1085 HydrophobicContact CB-CD1 3.48Å; N1069-Y1085 VanDerWaalsContact CB-CD1 3.48Å; N1069-Y1085 HydrophobicContact CB-CD2 3.8Å; N1069-Y1085 HydrophobicContact CB-CE1 3.6Å; N1069-Y1085 HydrophobicContact CB-CE2 3.93Å; N1069-Y1085 HydrophobicContact CB-CG 3.57Å; N1069-Y1085 VanDerWaalsContact CG-CD1 3.45Å; N1069-Y1085 VanDerWaalsContact ND2-CD1 3.35Å; N1069-Y1085 WeakPolarHBondContact ND2-CD1 3.45Å; N1069-Y1085 WeakPolarHBondContact ND2-CE1 3.45Å; C1081-Y1085 WeakPolarHBondContact CB-O 2.97Å; T1082-Y1085 PolarHBondContact O-N 2.88Å; T1082-Y1085 WeakPolarHBondContact OG1-CD2 3.41Å; Y1085-L1092 CarbonylContact C-O 3.51Å; Y1085-L1092 VanDerWaalsContact CA-O 3.32Å; Y1085-L1092 WeakPolarHBondContact CA-O 3.14Å; Y1085-I1094 WeakPolarHBondContact O-CD1 3.49Å; Y1085-P1114 PolarHBondContact OH-O 2.04Å; Y1085-P1114 VanDerWaalsContact OH-O 3.11Å; Y1085-G1115 VanDerWaalsContact CE2-CA 3.43Å; Y1085-G1115 VanDerWaalsContact CZ-CA 3.49Å; Y1085-G1115 PolarHBondContact OH-N 2.92Å
1086	E	86.3	Confident	83.8	Confident	73 Å²	73	64.2 Å²	64.2	34%	0.341	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	-173.2	173	72.1	-174.1	158.3	0	0	111.5	C1090 E1091 L1092 I1094 R1099	E1086-C1090 CarbonylContact O-C 3.56Å; E1086-C1090 VanDerWaalsContact O-CA 3.24Å; E1086-C1090 WeakPolarHBondContact O-CA 3.32Å; E1086-E1091 PolarHBondContact O-N 2.89Å; E1086-L1092 HydrophobicContact CG-CB 4.05Å; E1086-L1092 PolarHBondContact N-O 3.2Å; E1086-L1092 WeakPolarHBondContact O-CA 3.01Å; E1086-L1092 WeakPolarHBondContact O-CB 3.01Å; E1086-L1092 PolarHBondContact O-N 3.18Å; E1086-I1094 HydrophobicContact CB-CD1 4.15Å; E1086-I1094 HydrophobicContact CB-CG1 3.9Å; E1086-I1094 HydrophobicContact CG-CG1 3.83Å; E1086-R1099 IonicContact OE1-CZ 3.03Å; E1086-R1099 IonicContact OE1-NH1 2.69Å; E1086-R1099 PolarHBondContact OE1-NH1 2.9Å; E1086-R1099 IonicContact OE1-NH2 3.85Å; E1086-R1099 IonicContact OE2-CZ 2.78Å; E1086-R1099 IonicContact OE2-NH1 3.71Å; E1086-R1099 PolarHBondContact OE2-NH1 2.04Å; E1086-R1099 IonicContact OE2-NH2 3.16Å; E1086-R1099 PolarHBondContact OE2-NH2 3.05Å
1087	G	85.2	Confident	84.5	Confident	29 Å²	29	61.8 Å²	61.8	30%	0.299	31%	0.311	S	S	.	.	S	Bend	trans	99.6	173	-169.4	0	0	0	0	0	112.3	Q1089 E1091	G1087-Q1089 VanDerWaalsContact C-N 3.35Å; G1087-E1091 WeakPolarHBondContact CA-OE2 3.42Å
1088	I	83.5	Confident	85	Confident	125 Å²	125	63.1 Å²	63.1	64%	0.641	32%	0.322	S	S	*	.	S	Bend	trans	-78.1	-27.2	-172.4	-58.7	169.1	0	0	0	111.1	C1079 E1091	C1079-I1088 WeakPolarHBondContact CB-O 3.49Å; I1088-E1091 PolarHBondContact N-OE1 2.73Å; I1088-E1091 PolarHBondContact N-OE2 2.87Å
1089	Q	85.1	Confident	85	Confident	59 Å²	59	63.3 Å²	63.3	28%	0.276	32%	0.315	S	S	.	.	S	Bend	trans	-112.6	10.9	175.2	-72.6	147.6	50.9	0	0	111.7	P1065 C1067 E1068 G1087 E1091	P1065-Q1089 HydrophobicContact CB-CG 4.32Å; C1067-Q1089 CarbonylContact C-O 3.56Å; C1067-Q1089 WeakPolarHBondContact CA-O 3.42Å; E1068-Q1089 PolarHBondContact N-O 2.76Å; G1087-Q1089 VanDerWaalsContact C-N 3.35Å; Q1089-E1091 VanDerWaalsContact C-OE2 3.3Å; Q1089-E1091 VanDerWaalsContact CA-OE2 3.31Å; Q1089-E1091 WeakPolarHBondContact CA-OE2 3.47Å; Q1089-E1091 PolarHBondContact N-OE2 3.12Å; Q1089-E1091 PolarHBondContact O-N 2.91Å
1090	C	87	Confident	84.9	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.339	C	S	.	.	S	Bend	trans	63.2	27.4	-172.4	-45.9	0	0	0	0	113.6	N1069 C1081 E1086 L1092	N1069-C1090 PolarHBondContact ND2-O 2.86Å; C1081-C1090 WeakPolarHBondContact CA-SG 3.31Å; C1081-C1090 HydrophobicContact CB-CB 3.73Å; C1081-C1090 WeakPolarHBondContact CB-SG 3.44Å; C1081-C1090 WeakPolarHBondContact SG-CA 3.46Å; C1081-C1090 WeakPolarHBondContact SG-CB 2.96Å; C1081-C1090 CovalentContact SG-SG 2.04Å; C1081-C1090 PolarHBondContact SG-SG 2.59Å; E1086-C1090 CarbonylContact O-C 3.56Å; E1086-C1090 VanDerWaalsContact O-CA 3.24Å; E1086-C1090 WeakPolarHBondContact O-CA 3.32Å; C1090-L1092 VanDerWaalsContact C-N 3.35Å
1091	E	87.6	Confident	84.8	Confident	75 Å²	75	74.3 Å²	74.3	35%	0.35	36%	0.357	S	S	.	.			trans	-77.8	-13.8	-175.6	73	-78.9	-162.8	0	0	114.1	E1086 G1087 I1088 Q1089	E1086-E1091 PolarHBondContact O-N 2.89Å; G1087-E1091 WeakPolarHBondContact CA-OE2 3.42Å; I1088-E1091 PolarHBondContact N-OE1 2.73Å; I1088-E1091 PolarHBondContact N-OE2 2.87Å; Q1089-E1091 VanDerWaalsContact C-OE2 3.3Å; Q1089-E1091 VanDerWaalsContact CA-OE2 3.31Å; Q1089-E1091 WeakPolarHBondContact CA-OE2 3.47Å; Q1089-E1091 PolarHBondContact N-OE2 3.12Å; Q1089-E1091 PolarHBondContact O-N 2.91Å
1092	L	88	Confident	84.9	Confident	89 Å²	89	73.1 Å²	73.1	47%	0.466	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.8	-177.1	-52.6	178.4	0	0	0	111.4	Y1085 E1086 C1090	Y1085-L1092 CarbonylContact C-O 3.51Å; Y1085-L1092 VanDerWaalsContact CA-O 3.32Å; Y1085-L1092 WeakPolarHBondContact CA-O 3.14Å; E1086-L1092 HydrophobicContact CG-CB 4.05Å; E1086-L1092 PolarHBondContact N-O 3.2Å; E1086-L1092 WeakPolarHBondContact O-CA 3.01Å; E1086-L1092 WeakPolarHBondContact O-CB 3.01Å; E1086-L1092 PolarHBondContact O-N 3.18Å; C1090-L1092 VanDerWaalsContact C-N 3.35Å
1093	D	89.4	Confident	85.2	Confident	57 Å²	57	72.1 Å²	72.1	31%	0.305	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.4	172.2	180	43.3	0	0	0	110.7	N1095 N1112 P1114 G1115	D1093-N1095 PolarHBondContact O-N 3.22Å; D1093-N1112 PolarHBondContact OD2-ND2 3.06Å; D1093-P1114 WeakPolarHBondContact OD1-CA 3.04Å; D1093-G1115 PolarHBondContact OD1-N 3.15Å
1094	I	84.7	Confident	85.3	Confident	23 Å²	23	61.6 Å²	61.6	12%	0.118	31%	0.305	C	S	.	.			trans	-78	105.3	177.7	-61.4	174.5	0	0	0	108.6	G1084 Y1085 E1086 E1096 R1099	G1084-I1094 WeakPolarHBondContact O-CB 3.03Å; G1084-I1094 PolarHBondContact O-N 3.21Å; Y1085-I1094 WeakPolarHBondContact O-CD1 3.49Å; E1086-I1094 HydrophobicContact CB-CD1 4.15Å; E1086-I1094 HydrophobicContact CB-CG1 3.9Å; E1086-I1094 HydrophobicContact CG-CG1 3.83Å; I1094-E1096 HydrophobicContact CG2-CG 4.24Å; I1094-E1096 PolarHBondContact O-N 3.42Å; I1094-R1099 VanDerWaalsContact CG2-NH1 3.28Å
1095	N	86.3	Confident	85.2	Confident	62 Å²	62	67.2 Å²	67.2	33%	0.332	34%	0.341	S	S	.	.			trans	-70.5	90.9	176.2	-170.2	-50.2	0	0	0	111.9	D1093 C1097 V1098 R1099 N1112	D1093-N1095 PolarHBondContact O-N 3.22Å; N1095-C1097 VanDerWaalsContact C-N 3.28Å; N1095-C1097 PolarHBondContact O-N 2.7Å; N1095-C1097 WeakPolarHBondContact OD1-CB 3.5Å; N1095-C1097 PolarHBondContact OD1-N 2.04Å; N1095-V1098 HydrophobicContact CB-CB 4.46Å; N1095-V1098 PolarHBondContact O-N 2.9Å; N1095-V1098 WeakPolarHBondContact OD1-CG2 3.3Å; N1095-V1098 PolarHBondContact OD1-N 2.02Å; N1095-R1099 WeakPolarHBondContact O-CB 3.46Å; N1095-R1099 PolarHBondContact O-N 2.84Å; N1095-N1112 WeakPolarHBondContact CA-OD1 3.12Å
1096	E	87.3	Confident	84.8	Confident	20 Å²	20	71.2 Å²	71.2	9%	0.093	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-27.3	-176	-62.8	121.2	142.8	0	0	112.5	I1094 V1098 R1099 H1100 R1101 P1102 N1112 S1116 F1117	I1094-E1096 HydrophobicContact CG2-CG 4.24Å; I1094-E1096 PolarHBondContact O-N 3.42Å; E1096-V1098 PolarHBondContact O-N 2.86Å; E1096-R1099 PolarHBondContact O-N 2.68Å; E1096-H1100 HydrophobicContact CB-CB 4.41Å; E1096-H1100 WeakPolarHBondContact O-CA 3.05Å; E1096-H1100 PolarHBondContact O-N 2.79Å; E1096-R1101 PolarHBondContact O-N 2.85Å; E1096-P1102 HydrophobicContact CB-CG 4.41Å; E1096-P1102 WeakPolarHBondContact O-CD 3.37Å; E1096-N1112 PolarHBondContact N-OD1 2.04Å; E1096-S1116 VanDerWaalsContact OE2-CA 3.29Å; E1096-S1116 WeakPolarHBondContact OE2-CA 3.31Å; E1096-F1117 HydrophobicContact CB-CB 4.43Å; E1096-F1117 HydrophobicContact CB-CD1 3.69Å; E1096-F1117 HydrophobicContact CB-CE1 4.4Å; E1096-F1117 HydrophobicContact CB-CG 4.33Å; E1096-F1117 HydrophobicContact CG-CD1 4.1Å; E1096-F1117 WeakPolarHBondContact OE2-CD1 3.05Å; E1096-F1117 PolarHBondContact OE2-N 3.34Å
1097	C	87.9	Confident	84.8	Confident	24 Å²	24	72 Å²	72	16%	0.162	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-37.1	173.1	-60.6	0	0	0	0	112.2	N1095 C1110	N1095-C1097 VanDerWaalsContact C-N 3.28Å; N1095-C1097 PolarHBondContact O-N 2.7Å; N1095-C1097 WeakPolarHBondContact OD1-CB 3.5Å; N1095-C1097 PolarHBondContact OD1-N 2.04Å; C1097-C1110 WeakPolarHBondContact CA-SG 3.08Å; C1097-C1110 HydrophobicContact CB-CB 3.61Å; C1097-C1110 WeakPolarHBondContact CB-SG 3.03Å; C1097-C1110 WeakPolarHBondContact SG-CB 3.49Å; C1097-C1110 CovalentContact SG-SG 2.03Å; C1097-C1110 PolarHBondContact SG-SG 2.86Å
1098	V	84.6	Confident	84.8	Confident	117 Å²	117	71.6 Å²	71.6	71%	0.709	36%	0.362	S	S	*	.	H	α-helix	trans	-84.2	-44.7	173.3	175.7	0	0	0	0	111.8	N1095 E1096	N1095-V1098 HydrophobicContact CB-CB 4.46Å; N1095-V1098 PolarHBondContact O-N 2.9Å; N1095-V1098 WeakPolarHBondContact OD1-CG2 3.3Å; N1095-V1098 PolarHBondContact OD1-N 2.02Å; E1096-V1098 PolarHBondContact O-N 2.86Å
1099	R	78	Confident	85	Confident	111 Å²	111	69.8 Å²	69.8	42%	0.419	35%	0.352	S	S	.	.	H	α-helix	trans	-80.1	-32	-169	-165.9	-179.6	-158.4	160.2	14.9	114.7	E1086 I1094 N1095 E1096	E1086-R1099 IonicContact OE1-CZ 3.03Å; E1086-R1099 IonicContact OE1-NH1 2.69Å; E1086-R1099 PolarHBondContact OE1-NH1 2.9Å; E1086-R1099 IonicContact OE1-NH2 3.85Å; E1086-R1099 IonicContact OE2-CZ 2.78Å; E1086-R1099 IonicContact OE2-NH1 3.71Å; E1086-R1099 PolarHBondContact OE2-NH1 2.04Å; E1086-R1099 IonicContact OE2-NH2 3.16Å; E1086-R1099 PolarHBondContact OE2-NH2 3.05Å; I1094-R1099 VanDerWaalsContact CG2-NH1 3.28Å; N1095-R1099 WeakPolarHBondContact O-CB 3.46Å; N1095-R1099 PolarHBondContact O-N 2.84Å; E1096-R1099 PolarHBondContact O-N 2.68Å
1100	H	79.2	Confident	85.3	Confident	122 Å²	122	68.8 Å²	68.8	57%	0.565	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-24	-170.1	-68.4	-75.5	0	0	0	114.5	E1096	E1096-H1100 HydrophobicContact CB-CB 4.41Å; E1096-H1100 WeakPolarHBondContact O-CA 3.05Å; E1096-H1100 PolarHBondContact O-N 2.79Å
1101	R	82.5	Confident	85.4	Confident	206 Å²	206	73.2 Å²	73.2	78%	0.777	37%	0.372	S	S	*	.			trans	47.7	62.8	-172.3	-62.2	-174.7	179.8	-166.4	0.2	112.7	E1096 C1103	E1096-R1101 PolarHBondContact O-N 2.85Å; R1101-C1103 PolarHBondContact O-N 3.32Å
1102	P	84.8	Confident	85.3	Confident	22 Å²	22	72 Å²	72	14%	0.143	37%	0.368	C	S	.	.			trans	-80.6	-12.4	-168.2	33.4	-38.4	0	0	0	115.1	E1096 F1117 Q1132	E1096-P1102 HydrophobicContact CB-CG 4.41Å; E1096-P1102 WeakPolarHBondContact O-CD 3.37Å; P1102-F1117 HydrophobicContact CB-CD1 4.36Å; P1102-F1117 HydrophobicContact CB-CD2 4.08Å; P1102-F1117 HydrophobicContact CB-CE1 3.83Å; P1102-F1117 HydrophobicContact CB-CE2 3.52Å; P1102-F1117 HydrophobicContact CB-CG 4.48Å; P1102-F1117 HydrophobicContact CB-CZ 3.37Å; P1102-F1117 HydrophobicContact CG-CB 4.48Å; P1102-F1117 HydrophobicContact CG-CD1 3.73Å; P1102-F1117 HydrophobicContact CG-CD2 3.36Å; P1102-F1117 HydrophobicContact CG-CE1 3.72Å; P1102-F1117 HydrophobicContact CG-CE2 3.36Å; P1102-F1117 HydrophobicContact CG-CG 3.56Å; P1102-F1117 HydrophobicContact CG-CZ 3.54Å; P1102-Q1132 WeakPolarHBondContact O-CB 3.45Å; P1102-Q1132 WeakPolarHBondContact O-CG 3.45Å
1103	C	88.9	Confident	85.3	Confident	15 Å²	15	70 Å²	70	10%	0.101	36%	0.36	C	S	.	.	S	Bend	trans	-86.4	162.7	178	-52.4	0	0	0	0	112.1	R1101 C1110 C1119	R1101-C1103 PolarHBondContact O-N 3.32Å; C1103-C1110 HydrophobicContact CB-CB 4.31Å; C1103-C1110 VanDerWaalsContact SG-CA 3.56Å; C1103-C1110 WeakPolarHBondContact SG-CB 3.35Å; C1103-C1119 WeakPolarHBondContact CA-SG 3.27Å; C1103-C1119 HydrophobicContact CB-CB 3.8Å; C1103-C1119 WeakPolarHBondContact CB-SG 3.39Å; C1103-C1119 VanDerWaalsContact SG-CA 3.51Å; C1103-C1119 WeakPolarHBondContact SG-CB 3.23Å; C1103-C1119 CovalentContact SG-SG 2.03Å; C1103-C1119 PolarHBondContact SG-SG 2.85Å
1104	D	83.6	Confident	85.1	Confident	20 Å²	20	72.5 Å²	72.5	11%	0.107	38%	0.379	C	S	.	.			trans	-45	119.8	170.4	-164.7	-63.3	0	0	0	112	D1106 Y1107 G1108 Q1132 C1134	D1104-D1106 VanDerWaalsContact C-N 3.3Å; D1104-D1106 PolarHBondContact O-N 2.84Å; D1104-D1106 PolarHBondContact OD1-N 3.05Å; D1104-Y1107 WeakPolarHBondContact OD1-CD2 3.26Å; D1104-Y1107 PolarHBondContact OD1-N 3.22Å; D1104-G1108 WeakPolarHBondContact O-CA 3.38Å; D1104-G1108 PolarHBondContact O-N 2.88Å; D1104-Q1132 PolarHBondContact N-O 3.14Å; D1104-C1134 HydrophobicContact CB-CB 3.89Å; D1104-C1134 PolarHBondContact OD2-N 3.04Å
1105	P	80.8	Confident	84.9	Confident	121 Å²	121	72.1 Å²	72.1	79%	0.786	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-21	-168.8	29.3	-36.3	0	0	0	114
1106	D	80.8	Confident	84.8	Confident	126 Å²	126	71.9 Å²	71.9	67%	0.674	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-29.9	-178.2	-67.9	-37.6	0	0	0	111.9	D1104	D1104-D1106 VanDerWaalsContact C-N 3.3Å; D1104-D1106 PolarHBondContact O-N 2.84Å; D1104-D1106 PolarHBondContact OD1-N 3.05Å
1107	Y	86.4	Confident	84.9	Confident	88 Å²	88	73 Å²	73	35%	0.345	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-1.7	-170.1	-53.2	-69.5	0	0	0	115.2	D1104 C1121 V1122 Y1125 C1134	D1104-Y1107 WeakPolarHBondContact OD1-CD2 3.26Å; D1104-Y1107 PolarHBondContact OD1-N 3.22Å; Y1107-C1121 WeakPolarHBondContact O-CA 3.06Å; Y1107-V1122 HydrophobicContact CD1-CG2 4.03Å; Y1107-V1122 PolarHBondContact O-N 2.85Å; Y1107-Y1125 HydrophobicContact CD1-CD1 4.19Å; Y1107-Y1125 HydrophobicContact CD1-CD2 4.07Å; Y1107-Y1125 AromaticContact CD1-CE1 3.65Å; Y1107-Y1125 HydrophobicContact CD1-CE1 3.65Å; Y1107-Y1125 AromaticContact CD1-CE2 3.55Å; Y1107-Y1125 HydrophobicContact CD1-CE2 3.55Å; Y1107-Y1125 HydrophobicContact CD1-CG 4.42Å; Y1107-Y1125 AromaticContact CD1-CZ 3.32Å; Y1107-Y1125 HydrophobicContact CD2-CD1 4.36Å; Y1107-Y1125 AromaticContact CD2-CE1 3.87Å; Y1107-Y1125 HydrophobicContact CD2-CE1 3.87Å; Y1107-Y1125 AromaticContact CE1-CE1 3.95Å; Y1107-Y1125 HydrophobicContact CE1-CE1 3.95Å; Y1107-Y1125 AromaticContact CE1-CE2 3.92Å; Y1107-Y1125 HydrophobicContact CE1-CE2 3.92Å; Y1107-Y1125 AromaticContact CE1-CZ 3.4Å; Y1107-Y1125 VanDerWaalsContact CE1-CZ 3.4Å; Y1107-Y1125 WeakPolarHBondContact CE1-OH 3.47Å; Y1107-Y1125 HydrophobicContact CE2-CE1 4.17Å; Y1107-Y1125 AromaticContact CG-CD1 3.91Å; Y1107-Y1125 HydrophobicContact CG-CD1 3.91Å; Y1107-Y1125 HydrophobicContact CG-CD2 4.46Å; Y1107-Y1125 AromaticContact CG-CE1 3.61Å; Y1107-Y1125 HydrophobicContact CG-CE1 3.61Å; Y1107-Y1125 HydrophobicContact CG-CE2 4.24Å; Y1107-Y1125 HydrophobicContact CG-CG 4.35Å; Y1107-Y1125 AromaticContact CG-CZ 3.83Å; Y1107-Y1125 AromaticContact CZ-CZ 3.98Å; Y1107-C1134 PolarHBondContact O-SG 2.87Å
1108	G	84.1	Confident	85	Confident	22 Å²	22	74.9 Å²	74.9	23%	0.227	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127	-176.1	0	0	0	0	0	113.8	D1104	D1104-G1108 WeakPolarHBondContact O-CA 3.38Å; D1104-G1108 PolarHBondContact O-N 2.88Å
1109	I	88.4	Confident	85.2	Confident	86 Å²	86	69.7 Å²	69.7	44%	0.441	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122	170.3	-58.2	169.5	0	0	0	107.6	C1119 Q1120 V1122	I1109-C1119 CarbonylContact O-C 3.43Å; I1109-C1119 WeakPolarHBondContact O-CA 3.42Å; I1109-Q1120 HydrophobicContact CB-CB 4.5Å; I1109-Q1120 WeakPolarHBondContact CB-O 3.05Å; I1109-Q1120 PolarHBondContact N-O 3.29Å; I1109-Q1120 PolarHBondContact O-N 2.91Å; I1109-V1122 HydrophobicContact CD1-CG1 4.18Å; I1109-V1122 HydrophobicContact CG1-CG1 4.2Å
1110	C	90.3	Very high	85.7	Confident	39 Å²	39	69 Å²	69	26%	0.264	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.1	178	-166.5	0	0	0	0	110.9	C1097 C1103	C1097-C1110 WeakPolarHBondContact CA-SG 3.08Å; C1097-C1110 HydrophobicContact CB-CB 3.61Å; C1097-C1110 WeakPolarHBondContact CB-SG 3.03Å; C1097-C1110 WeakPolarHBondContact SG-CB 3.49Å; C1097-C1110 CovalentContact SG-SG 2.03Å; C1097-C1110 PolarHBondContact SG-SG 2.86Å; C1103-C1110 HydrophobicContact CB-CB 4.31Å; C1103-C1110 VanDerWaalsContact SG-CA 3.56Å; C1103-C1110 WeakPolarHBondContact SG-CB 3.35Å
1111	E	89.9	Confident	86.1	Confident	92 Å²	92	64.5 Å²	64.5	43%	0.43	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.3	171.3	-70.4	-174.8	163.9	0	0	110	F1117 T1118 Q1120	E1111-F1117 WeakPolarHBondContact O-CA 3.35Å; E1111-T1118 PolarHBondContact N-O 2.86Å; E1111-T1118 PolarHBondContact O-N 3.35Å; E1111-Q1120 PolarHBondContact OE1-NE2 2.03Å; E1111-Q1120 PolarHBondContact OE2-NE2 3.38Å
1112	N	86.2	Confident	86.3	Confident	50 Å²	50	56.8 Å²	56.8	27%	0.267	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	144.1	-177.1	-160.1	71.3	0	0	0	112.1	D1093 N1095 E1096	D1093-N1112 PolarHBondContact OD2-ND2 3.06Å; N1095-N1112 WeakPolarHBondContact CA-OD1 3.12Å; E1096-N1112 PolarHBondContact N-OD1 2.04Å
1113	T	86.4	Confident	86.2	Confident	48 Å²	48	62.2 Å²	62.2	29%	0.294	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.9	-178.8	61	0	0	0	0	110.8	G1115 S1116 T1118	T1113-G1115 PolarHBondContact O-N 2.8Å; T1113-S1116 CarbonylContact C-O 3.44Å; T1113-S1116 WeakPolarHBondContact CA-O 3.41Å; T1113-S1116 PolarHBondContact N-O 3.19Å; T1113-S1116 CarbonylContact O-C 3.57Å; T1113-S1116 PolarHBondContact O-N 2.9Å; T1113-S1116 PolarHBondContact OG1-O 2.9Å; T1113-T1118 HydrophobicContact CG2-CG2 4.22Å
1114	P	85.7	Confident	85.8	Confident	108 Å²	108	63 Å²	63	70%	0.701	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	109.3	-178.9	-28.7	37.4	0	0	0	113.5	Y1085 D1093	Y1085-P1114 PolarHBondContact OH-O 2.04Å; Y1085-P1114 VanDerWaalsContact OH-O 3.11Å; D1093-P1114 WeakPolarHBondContact OD1-CA 3.04Å
1115	G	81.1	Confident	86	Confident	16 Å²	16	65.3 Å²	65.3	17%	0.165	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	9.2	-178	0	0	0	0	0	115.9	Y1085 D1093 T1113	Y1085-G1115 VanDerWaalsContact CE2-CA 3.43Å; Y1085-G1115 VanDerWaalsContact CZ-CA 3.49Å; Y1085-G1115 PolarHBondContact OH-N 2.92Å; D1093-G1115 PolarHBondContact OD1-N 3.15Å; T1113-G1115 PolarHBondContact O-N 2.8Å
1116	S	85	Confident	86	Confident	56 Å²	56	64 Å²	64	39%	0.392	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	-176.3	178.7	-136.2	0	0	0	0	114.1	E1096 T1113	E1096-S1116 VanDerWaalsContact OE2-CA 3.29Å; E1096-S1116 WeakPolarHBondContact OE2-CA 3.31Å; T1113-S1116 CarbonylContact C-O 3.44Å; T1113-S1116 WeakPolarHBondContact CA-O 3.41Å; T1113-S1116 PolarHBondContact N-O 3.19Å; T1113-S1116 CarbonylContact O-C 3.57Å; T1113-S1116 PolarHBondContact O-N 2.9Å; T1113-S1116 PolarHBondContact OG1-O 2.9Å
1117	F	88.8	Confident	86	Confident	43 Å²	43	61.5 Å²	61.5	19%	0.189	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	161.4	172.6	62.6	-84.6	0	0	0	111.2	E1096 P1102 E1111 Q1132	E1096-F1117 HydrophobicContact CB-CB 4.43Å; E1096-F1117 HydrophobicContact CB-CD1 3.69Å; E1096-F1117 HydrophobicContact CB-CE1 4.4Å; E1096-F1117 HydrophobicContact CB-CG 4.33Å; E1096-F1117 HydrophobicContact CG-CD1 4.1Å; E1096-F1117 WeakPolarHBondContact OE2-CD1 3.05Å; E1096-F1117 PolarHBondContact OE2-N 3.34Å; P1102-F1117 HydrophobicContact CB-CD1 4.36Å; P1102-F1117 HydrophobicContact CB-CD2 4.08Å; P1102-F1117 HydrophobicContact CB-CE1 3.83Å; P1102-F1117 HydrophobicContact CB-CE2 3.52Å; P1102-F1117 HydrophobicContact CB-CG 4.48Å; P1102-F1117 HydrophobicContact CB-CZ 3.37Å; P1102-F1117 HydrophobicContact CG-CB 4.48Å; P1102-F1117 HydrophobicContact CG-CD1 3.73Å; P1102-F1117 HydrophobicContact CG-CD2 3.36Å; P1102-F1117 HydrophobicContact CG-CE1 3.72Å; P1102-F1117 HydrophobicContact CG-CE2 3.36Å; P1102-F1117 HydrophobicContact CG-CG 3.56Å; P1102-F1117 HydrophobicContact CG-CZ 3.54Å; E1111-F1117 WeakPolarHBondContact O-CA 3.35Å; F1117-Q1132 HydrophobicContact CE2-CG 4.01Å; F1117-Q1132 HydrophobicContact CZ-CG 4.26Å
1118	T	88.9	Confident	85.6	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.393	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.4	166.2	68.1	0	0	0	0	110.3	E1111 T1113	E1111-T1118 PolarHBondContact N-O 2.86Å; E1111-T1118 PolarHBondContact O-N 3.35Å; T1113-T1118 HydrophobicContact CG2-CG2 4.22Å
1119	C	90.1	Very high	84.9	Confident	9 Å²	9	66 Å²	66	6%	0.061	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131	176.5	-59.4	0	0	0	0	109.7	C1103 I1109 L1127 G1131	C1103-C1119 WeakPolarHBondContact CA-SG 3.27Å; C1103-C1119 HydrophobicContact CB-CB 3.8Å; C1103-C1119 WeakPolarHBondContact CB-SG 3.39Å; C1103-C1119 VanDerWaalsContact SG-CA 3.51Å; C1103-C1119 WeakPolarHBondContact SG-CB 3.23Å; C1103-C1119 CovalentContact SG-SG 2.03Å; C1103-C1119 PolarHBondContact SG-SG 2.85Å; I1109-C1119 CarbonylContact O-C 3.43Å; I1109-C1119 WeakPolarHBondContact O-CA 3.42Å; C1119-L1127 HydrophobicContact CB-CD1 3.69Å; C1119-L1127 VanDerWaalsContact O-CD2 3.3Å; C1119-L1127 WeakPolarHBondContact O-CD2 3.29Å; C1119-G1131 WeakPolarHBondContact CB-O 3.08Å; C1119-G1131 PolarHBondContact SG-O 2.62Å; C1119-G1131 VanDerWaalsContact SG-O 3.38Å
1120	Q	88.9	Confident	84	Confident	96 Å²	96	64.1 Å²	64.1	45%	0.449	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.4	169.7	-59.4	-168.9	25.5	0	0	109.3	I1109 E1111	I1109-Q1120 HydrophobicContact CB-CB 4.5Å; I1109-Q1120 WeakPolarHBondContact CB-O 3.05Å; I1109-Q1120 PolarHBondContact N-O 3.29Å; I1109-Q1120 PolarHBondContact O-N 2.91Å; E1111-Q1120 PolarHBondContact OE1-NE2 2.03Å; E1111-Q1120 PolarHBondContact OE2-NE2 3.38Å
1121	C	87.2	Confident	83.5	Confident	27 Å²	27	63.6 Å²	63.6	18%	0.182	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	146	179.3	-59.9	0	0	0	0	112.5	Y1107 Q1126 L1127 C1134	Y1107-C1121 WeakPolarHBondContact O-CA 3.06Å; C1121-Q1126 PolarHBondContact SG-O 2.03Å; C1121-L1127 WeakPolarHBondContact SG-CA 3.32Å; C1121-L1127 PolarHBondContact SG-N 3.19Å; C1121-L1127 VanDerWaalsContact SG-N 3.4Å; C1121-C1134 WeakPolarHBondContact CA-SG 3.46Å; C1121-C1134 HydrophobicContact CB-CB 3.81Å; C1121-C1134 WeakPolarHBondContact CB-SG 3.35Å; C1121-C1134 WeakPolarHBondContact SG-CA 3.25Å; C1121-C1134 WeakPolarHBondContact SG-CB 3.44Å; C1121-C1134 CovalentContact SG-SG 2.04Å; C1121-C1134 PolarHBondContact SG-SG 2.89Å
1122	V	85.5	Confident	83.2	Confident	44 Å²	44	62.7 Å²	62.7	27%	0.267	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-62	148.8	175.6	-61.9	0	0	0	0	111.7	Y1107 I1109 G1124 Y1125	Y1107-V1122 HydrophobicContact CD1-CG2 4.03Å; Y1107-V1122 PolarHBondContact O-N 2.85Å; I1109-V1122 HydrophobicContact CD1-CG1 4.18Å; I1109-V1122 HydrophobicContact CG1-CG1 4.2Å; V1122-G1124 PolarHBondContact O-N 3.21Å; V1122-G1124 VanDerWaalsContact O-N 3.09Å; V1122-Y1125 HydrophobicContact CG2-CD2 3.73Å; V1122-Y1125 HydrophobicContact CG2-CE2 4.2Å; V1122-Y1125 HydrophobicContact CG2-CG 4.46Å; V1122-Y1125 PolarHBondContact O-N 3.39Å
1123	P	84.3	Confident	82.9	Confident	137 Å²	137	62.2 Å²	62.2	89%	0.89	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	117.5	-177.1	-27.3	35.6	0	0	0	112.7
1124	G	79.7	Confident	82.9	Confident	32 Å²	32	60.4 Å²	60.4	33%	0.33	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	125.5	-21.7	-168.8	0	0	0	0	0	112.6	V1122 N1137	V1122-G1124 PolarHBondContact O-N 3.21Å; V1122-G1124 VanDerWaalsContact O-N 3.09Å; G1124-N1137 WeakPolarHBondContact O-CB 3.44Å; G1124-N1137 PolarHBondContact O-N 3.18Å; G1124-N1137 PolarHBondContact O-ND2 2.04Å
1125	Y	86.9	Confident	82.7	Confident	67 Å²	67	56.1 Å²	56.1	26%	0.263	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	158.2	-176	-63.6	-107.5	0	0	0	111.5	Y1107 V1122 C1134 I1135 D1136	Y1107-Y1125 HydrophobicContact CD1-CD1 4.19Å; Y1107-Y1125 HydrophobicContact CD1-CD2 4.07Å; Y1107-Y1125 AromaticContact CD1-CE1 3.65Å; Y1107-Y1125 HydrophobicContact CD1-CE1 3.65Å; Y1107-Y1125 AromaticContact CD1-CE2 3.55Å; Y1107-Y1125 HydrophobicContact CD1-CE2 3.55Å; Y1107-Y1125 HydrophobicContact CD1-CG 4.42Å; Y1107-Y1125 AromaticContact CD1-CZ 3.32Å; Y1107-Y1125 HydrophobicContact CD2-CD1 4.36Å; Y1107-Y1125 AromaticContact CD2-CE1 3.87Å; Y1107-Y1125 HydrophobicContact CD2-CE1 3.87Å; Y1107-Y1125 AromaticContact CE1-CE1 3.95Å; Y1107-Y1125 HydrophobicContact CE1-CE1 3.95Å; Y1107-Y1125 AromaticContact CE1-CE2 3.92Å; Y1107-Y1125 HydrophobicContact CE1-CE2 3.92Å; Y1107-Y1125 AromaticContact CE1-CZ 3.4Å; Y1107-Y1125 VanDerWaalsContact CE1-CZ 3.4Å; Y1107-Y1125 WeakPolarHBondContact CE1-OH 3.47Å; Y1107-Y1125 HydrophobicContact CE2-CE1 4.17Å; Y1107-Y1125 AromaticContact CG-CD1 3.91Å; Y1107-Y1125 HydrophobicContact CG-CD1 3.91Å; Y1107-Y1125 HydrophobicContact CG-CD2 4.46Å; Y1107-Y1125 AromaticContact CG-CE1 3.61Å; Y1107-Y1125 HydrophobicContact CG-CE1 3.61Å; Y1107-Y1125 HydrophobicContact CG-CE2 4.24Å; Y1107-Y1125 HydrophobicContact CG-CG 4.35Å; Y1107-Y1125 AromaticContact CG-CZ 3.83Å; Y1107-Y1125 AromaticContact CZ-CZ 3.98Å; V1122-Y1125 HydrophobicContact CG2-CD2 3.73Å; V1122-Y1125 HydrophobicContact CG2-CE2 4.2Å; V1122-Y1125 HydrophobicContact CG2-CG 4.46Å; V1122-Y1125 PolarHBondContact O-N 3.39Å; Y1125-C1134 HydrophobicContact CD1-CB 4.47Å; Y1125-I1135 CarbonylContact C-O 3.53Å; Y1125-I1135 VanDerWaalsContact CA-O 3.29Å; Y1125-I1135 WeakPolarHBondContact CA-O 3.02Å; Y1125-D1136 HydrophobicContact CD1-CB 4.2Å; Y1125-D1136 HydrophobicContact CE1-CB 4Å
1126	Q	81.3	Confident	82.7	Confident	94 Å²	94	58.1 Å²	58.1	44%	0.439	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	149.5	171.8	-78.5	176.6	28.7	0	0	109.7	C1121 C1134 I1135 N1137 A1140	C1121-Q1126 PolarHBondContact SG-O 2.03Å; Q1126-C1134 WeakPolarHBondContact O-CA 3.01Å; Q1126-I1135 HydrophobicContact CB-CG2 4.38Å; Q1126-I1135 PolarHBondContact N-O 3.09Å; Q1126-I1135 WeakPolarHBondContact O-CG2 3.22Å; Q1126-I1135 PolarHBondContact O-N 2.79Å; Q1126-N1137 WeakPolarHBondContact CG-OD1 3.48Å; Q1126-N1137 PolarHBondContact NE2-OD1 3.48Å; Q1126-A1140 HydrophobicContact CB-CB 4.36Å
1127	L	80.7	Confident	82.4	Confident	73 Å²	73	57.7 Å²	57.7	38%	0.382	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	133.7	176	-165.6	72.2	0	0	0	110.1	C1119 C1121	C1119-L1127 HydrophobicContact CB-CD1 3.69Å; C1119-L1127 VanDerWaalsContact O-CD2 3.3Å; C1119-L1127 WeakPolarHBondContact O-CD2 3.29Å; C1121-L1127 WeakPolarHBondContact SG-CA 3.32Å; C1121-L1127 PolarHBondContact SG-N 3.19Å; C1121-L1127 VanDerWaalsContact SG-N 3.4Å
1128	M	77.8	Confident	81.8	Confident	18 Å²	18	62.5 Å²	62.5	9%	0.089	33%	0.33	C	S	.	.			trans	-73.6	164.3	176.6	-67.9	-174.7	55.5	0	0	112	D1130 G1131 H1133 I1135 L1146 F1148	M1128-D1130 PolarHBondContact O-N 3.05Å; M1128-G1131 PolarHBondContact O-N 3.3Å; M1128-H1133 HydrophobicContact CB-CB 4.29Å; M1128-H1133 WeakPolarHBondContact CB-O 3.27Å; M1128-H1133 HydrophobicContact CG-CB 4.2Å; M1128-H1133 WeakPolarHBondContact CG-O 3.3Å; M1128-H1133 PolarHBondContact N-O 2.84Å; M1128-H1133 HydrophobicContact SD-CB 3.66Å; M1128-I1135 HydrophobicContact CG-CB 3.83Å; M1128-I1135 HydrophobicContact CG-CG2 3.52Å; M1128-I1135 HydrophobicContact SD-CB 4.03Å; M1128-I1135 HydrophobicContact SD-CG2 4.36Å; M1128-L1146 HydrophobicContact CE-CB 3.9Å; M1128-L1146 WeakPolarHBondContact CE-O 3.28Å; M1128-F1148 HydrophobicContact CE-CB 3.91Å; M1128-F1148 HydrophobicContact CE-CD2 3.98Å; M1128-F1148 HydrophobicContact CE-CG 4.47Å; M1128-F1148 HydrophobicContact SD-CB 4.44Å; M1128-F1148 HydrophobicContact SD-CD2 3.86Å
1129	Y	70.5	Confident	81.1	Confident	188 Å²	188	67.2 Å²	67.2	74%	0.737	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-11	179.7	-82.5	-75.4	0	0	0	115	G1131 P1144	Y1129-G1131 VanDerWaalsContact C-N 3.32Å; Y1129-P1144 WeakPolarHBondContact CE2-O 3.5Å
1130	D	70	Confident	80.1	Confident	45 Å²	45	67.2 Å²	67.2	24%	0.241	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-7.9	171.4	56.4	38.8	0	0	0	113.9	M1128 Q1132 H1133 F1148	M1128-D1130 PolarHBondContact O-N 3.05Å; D1130-Q1132 PolarHBondContact O-N 3.45Å; D1130-Q1132 PolarHBondContact OD1-N 3.42Å; D1130-H1133 PolarHBondContact OD1-N 3.5Å; D1130-H1133 IonicContact OD1-ND1 3.21Å; D1130-H1133 PolarHBondContact OD1-ND1 2.85Å; D1130-H1133 IonicContact OD2-CE1 3.91Å; D1130-H1133 IonicContact OD2-CG 3.3Å; D1130-H1133 IonicContact OD2-ND1 3.88Å; D1130-H1133 PolarHBondContact OD2-ND1 3.17Å; D1130-F1148 WeakPolarHBondContact OD2-CB 3.4Å; D1130-F1148 PolarHBondContact OD2-N 3Å
1131	G	78.9	Confident	79.4	Confident	29 Å²	29	70 Å²	70	30%	0.299	35%	0.352	S	S	.	.	S	Bend	trans	72	9.3	-179.9	0	0	0	0	0	114.9	C1119 M1128 Y1129	C1119-G1131 WeakPolarHBondContact CB-O 3.08Å; C1119-G1131 PolarHBondContact SG-O 2.62Å; C1119-G1131 VanDerWaalsContact SG-O 3.38Å; M1128-G1131 PolarHBondContact O-N 3.3Å; Y1129-G1131 VanDerWaalsContact C-N 3.32Å
1132	Q	82.8	Confident	78.5	Confident	72 Å²	72	72.2 Å²	72.2	34%	0.336	37%	0.368	S	S	.	.	S	Bend	trans	-127	-43.3	-171.7	-74.1	171.6	26.5	0	0	113.3	P1102 D1104 F1117 D1130	P1102-Q1132 WeakPolarHBondContact O-CB 3.45Å; P1102-Q1132 WeakPolarHBondContact O-CG 3.45Å; D1104-Q1132 PolarHBondContact N-O 3.14Å; F1117-Q1132 HydrophobicContact CE2-CG 4.01Å; F1117-Q1132 HydrophobicContact CZ-CG 4.26Å; D1130-Q1132 PolarHBondContact O-N 3.45Å; D1130-Q1132 PolarHBondContact OD1-N 3.42Å
1133	H	81	Confident	77.3	Confident	41 Å²	41	75 Å²	75	19%	0.19	38%	0.378	C	S	.	.			trans	-91.9	148.9	-173.8	-61.2	90.4	0	0	0	112.7	M1128 D1130 F1148	M1128-H1133 HydrophobicContact CB-CB 4.29Å; M1128-H1133 WeakPolarHBondContact CB-O 3.27Å; M1128-H1133 HydrophobicContact CG-CB 4.2Å; M1128-H1133 WeakPolarHBondContact CG-O 3.3Å; M1128-H1133 PolarHBondContact N-O 2.84Å; M1128-H1133 HydrophobicContact SD-CB 3.66Å; D1130-H1133 PolarHBondContact OD1-N 3.5Å; D1130-H1133 IonicContact OD1-ND1 3.21Å; D1130-H1133 PolarHBondContact OD1-ND1 2.85Å; D1130-H1133 IonicContact OD2-CE1 3.91Å; D1130-H1133 IonicContact OD2-CG 3.3Å; D1130-H1133 IonicContact OD2-ND1 3.88Å; D1130-H1133 PolarHBondContact OD2-ND1 3.17Å; H1133-F1148 HydrophobicContact CB-CB 4.19Å; H1133-F1148 HydrophobicContact CB-CD2 4.14Å; H1133-F1148 HydrophobicContact CB-CG 4.17Å; H1133-F1148 AromaticContact CD2-CD1 3.51Å; H1133-F1148 AromaticContact CD2-CE1 3.74Å; H1133-F1148 AromaticContact CD2-CG 3.75Å; H1133-F1148 AromaticContact CE1-CD1 3.62Å; H1133-F1148 AromaticContact CE1-CG 3.92Å; H1133-F1148 AromaticContact CG-CD1 3.82Å; H1133-F1148 AromaticContact CG-CD2 3.99Å; H1133-F1148 AromaticContact CG-CG 3.58Å; H1133-F1148 VanDerWaalsContact ND1-CB 3.31Å; H1133-F1148 WeakPolarHBondContact ND1-CB 3.46Å; H1133-F1148 AromaticContact ND1-CD1 3.87Å; H1133-F1148 AromaticContact ND1-CG 3.69Å; H1133-F1148 AromaticContact NE2-CD1 3.35Å; H1133-F1148 WeakPolarHBondContact NE2-CD1 3.25Å; H1133-F1148 AromaticContact NE2-CE1 3.75Å; H1133-F1148 AromaticContact NE2-CG 3.94Å
1134	C	85.2	Confident	76	Confident	10 Å²	10	72.3 Å²	72.3	7%	0.068	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.5	-176.3	-74	0	0	0	0	111.1	D1104 Y1107 C1121 Y1125 Q1126	D1104-C1134 HydrophobicContact CB-CB 3.89Å; D1104-C1134 PolarHBondContact OD2-N 3.04Å; Y1107-C1134 PolarHBondContact O-SG 2.87Å; C1121-C1134 WeakPolarHBondContact CA-SG 3.46Å; C1121-C1134 HydrophobicContact CB-CB 3.81Å; C1121-C1134 WeakPolarHBondContact CB-SG 3.35Å; C1121-C1134 WeakPolarHBondContact SG-CA 3.25Å; C1121-C1134 WeakPolarHBondContact SG-CB 3.44Å; C1121-C1134 CovalentContact SG-SG 2.04Å; C1121-C1134 PolarHBondContact SG-SG 2.89Å; Y1125-C1134 HydrophobicContact CD1-CB 4.47Å; Q1126-C1134 WeakPolarHBondContact O-CA 3.01Å
1135	I	81.8	Confident	74.8	Confident	18 Å²	18	77 Å²	77	9%	0.092	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.5	-178	-177.5	164.9	0	0	0	110.4	Y1125 Q1126 M1128 R1139 A1140 L1146	Y1125-I1135 CarbonylContact C-O 3.53Å; Y1125-I1135 VanDerWaalsContact CA-O 3.29Å; Y1125-I1135 WeakPolarHBondContact CA-O 3.02Å; Q1126-I1135 HydrophobicContact CB-CG2 4.38Å; Q1126-I1135 PolarHBondContact N-O 3.09Å; Q1126-I1135 WeakPolarHBondContact O-CG2 3.22Å; Q1126-I1135 PolarHBondContact O-N 2.79Å; M1128-I1135 HydrophobicContact CG-CB 3.83Å; M1128-I1135 HydrophobicContact CG-CG2 3.52Å; M1128-I1135 HydrophobicContact SD-CB 4.03Å; M1128-I1135 HydrophobicContact SD-CG2 4.36Å; I1135-R1139 HydrophobicContact CD1-CB 4.06Å; I1135-R1139 HydrophobicContact CD1-CG 3.96Å; I1135-R1139 HydrophobicContact CG1-CB 3.77Å; I1135-R1139 HydrophobicContact CG1-CG 4.12Å; I1135-A1140 HydrophobicContact CG1-CB 4.42Å; I1135-A1140 HydrophobicContact CG2-CB 4.01Å; I1135-L1146 HydrophobicContact CD1-CB 4.27Å; I1135-L1146 HydrophobicContact CD1-CD1 3.47Å; I1135-L1146 VanDerWaalsContact CD1-CD1 3.47Å
1136	D	81.1	Confident	73.2	Confident	57 Å²	57	76.4 Å²	76.4	31%	0.305	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	144.4	175.4	157.8	-98.9	0	0	0	111.9	Y1125 E1138 R1139 A1140	Y1125-D1136 HydrophobicContact CD1-CB 4.2Å; Y1125-D1136 HydrophobicContact CE1-CB 4Å; D1136-E1138 VanDerWaalsContact C-N 3.28Å; D1136-E1138 PolarHBondContact O-N 3.43Å; D1136-E1138 WeakPolarHBondContact OD1-CA 3.35Å; D1136-E1138 WeakPolarHBondContact OD1-CB 3.05Å; D1136-E1138 PolarHBondContact OD1-N 3.19Å; D1136-R1139 HydrophobicContact CB-CB 4.31Å; D1136-R1139 CarbonylContact O-C 3.4Å; D1136-R1139 PolarHBondContact O-N 3.36Å; D1136-R1139 VanDerWaalsContact O-N 3.12Å; D1136-R1139 PolarHBondContact OD1-N 3.1Å; D1136-A1140 WeakPolarHBondContact O-CB 3.03Å; D1136-A1140 PolarHBondContact O-N 3.29Å
1137	N	80.1	Confident	71.8	Confident	47 Å²	47	77.4 Å²	77.4	25%	0.251	39%	0.386	S	S	.	.	H	α-helix	trans	-58.3	-30	-177.5	-90.8	-60.7	0	0	0	114.7	G1124 Q1126 K1141	G1124-N1137 WeakPolarHBondContact O-CB 3.44Å; G1124-N1137 PolarHBondContact O-N 3.18Å; G1124-N1137 PolarHBondContact O-ND2 2.04Å; Q1126-N1137 WeakPolarHBondContact CG-OD1 3.48Å; Q1126-N1137 PolarHBondContact NE2-OD1 3.48Å; N1137-K1141 VanDerWaalsContact O-CD 3.3Å; N1137-K1141 WeakPolarHBondContact O-CD 3.41Å; N1137-K1141 WeakPolarHBondContact O-CG 3.38Å; N1137-K1141 PolarHBondContact O-N 3.34Å
1138	E	75.6	Confident	70.2	Confident	145 Å²	145	79 Å²	79	68%	0.678	39%	0.391	S	S	*	.	H	α-helix	trans	-81.4	-35.8	176.9	-52.3	-159.8	147	0	0	111.1	D1136 K1141 S1142	D1136-E1138 VanDerWaalsContact C-N 3.28Å; D1136-E1138 PolarHBondContact O-N 3.43Å; D1136-E1138 WeakPolarHBondContact OD1-CA 3.35Å; D1136-E1138 WeakPolarHBondContact OD1-CB 3.05Å; D1136-E1138 PolarHBondContact OD1-N 3.19Å; E1138-K1141 PolarHBondContact O-N 2.93Å; E1138-S1142 PolarHBondContact O-N 2.8Å; E1138-S1142 PolarHBondContact O-OG 3.24Å
1139	R	73.7	Confident	68.7	Low	162 Å²	162	87.4 Å²	87.4	61%	0.611	42%	0.421	S	S	*	.	H	α-helix	trans	-67.1	-38.4	171.8	-153.7	-176.2	-155.3	166.3	8.8	112.6	I1135 D1136 S1142 H1143	I1135-R1139 HydrophobicContact CD1-CB 4.06Å; I1135-R1139 HydrophobicContact CD1-CG 3.96Å; I1135-R1139 HydrophobicContact CG1-CB 3.77Å; I1135-R1139 HydrophobicContact CG1-CG 4.12Å; D1136-R1139 HydrophobicContact CB-CB 4.31Å; D1136-R1139 CarbonylContact O-C 3.4Å; D1136-R1139 PolarHBondContact O-N 3.36Å; D1136-R1139 VanDerWaalsContact O-N 3.12Å; D1136-R1139 PolarHBondContact OD1-N 3.1Å; R1139-S1142 WeakPolarHBondContact CA-OG 3.23Å; R1139-S1142 PolarHBondContact O-N 2.9Å; R1139-S1142 PolarHBondContact O-OG 3.23Å; R1139-S1142 VanDerWaalsContact O-OG 3.05Å; R1139-H1143 PolarHBondContact O-N 2.79Å
1140	A	70	Confident	67	Low	10 Å²	10	81.5 Å²	81.5	8%	0.083	42%	0.418	C	S	.	.	H	α-helix	trans	-63.1	-43.4	175.4	0	0	0	0	0	112	Q1126 I1135 D1136 S1142 H1143	Q1126-A1140 HydrophobicContact CB-CB 4.36Å; I1135-A1140 HydrophobicContact CG1-CB 4.42Å; I1135-A1140 HydrophobicContact CG2-CB 4.01Å; D1136-A1140 WeakPolarHBondContact O-CB 3.03Å; D1136-A1140 PolarHBondContact O-N 3.29Å; A1140-S1142 VanDerWaalsContact C-N 3.34Å; A1140-S1142 PolarHBondContact O-N 3.14Å; A1140-H1143 CarbonylContact O-C 3.48Å; A1140-H1143 PolarHBondContact O-N 3.03Å
1141	K	73.4	Confident	65.4	Low	154 Å²	154	91.5 Å²	91.5	67%	0.67	45%	0.452	S	S	*	.	H	α-helix	trans	-63	-36.8	175.8	-72.7	164.7	-168.1	167.3	0	113.2	N1137 E1138	N1137-K1141 VanDerWaalsContact O-CD 3.3Å; N1137-K1141 WeakPolarHBondContact O-CD 3.41Å; N1137-K1141 WeakPolarHBondContact O-CG 3.38Å; N1137-K1141 PolarHBondContact O-N 3.34Å; E1138-K1141 PolarHBondContact O-N 2.93Å
1142	S	69.2	Low	63.1	Low	74 Å²	74	94 Å²	94	52%	0.517	48%	0.477	S	S	.	.	H	α-helix	trans	-83.4	-23.2	-178.7	52.5	0	0	0	0	113.7	E1138 R1139 A1140	E1138-S1142 PolarHBondContact O-N 2.8Å; E1138-S1142 PolarHBondContact O-OG 3.24Å; R1139-S1142 WeakPolarHBondContact CA-OG 3.23Å; R1139-S1142 PolarHBondContact O-N 2.9Å; R1139-S1142 PolarHBondContact O-OG 3.23Å; R1139-S1142 VanDerWaalsContact O-OG 3.05Å; A1140-S1142 VanDerWaalsContact C-N 3.34Å; A1140-S1142 PolarHBondContact O-N 3.14Å
1143	H	59.9	Low	60.8	Low	102 Å²	102	95.9 Å²	95.9	47%	0.472	49%	0.494	S	S	.	.			trans	-140	67.1	-175.7	-63.8	78.7	0	0	0	111.6	R1139 A1140 N1145 L1146	R1139-H1143 PolarHBondContact O-N 2.79Å; A1140-H1143 CarbonylContact O-C 3.48Å; A1140-H1143 PolarHBondContact O-N 3.03Å; H1143-N1145 PolarHBondContact O-N 3.07Å; H1143-N1145 VanDerWaalsContact O-N 3.14Å; H1143-L1146 HydrophobicContact CB-CD1 3.52Å; H1143-L1146 HydrophobicContact CB-CG 3.89Å; H1143-L1146 PolarHBondContact O-N 2.93Å
1144	P	56.4	Low	58.5	Low	81 Å²	81	103.4 Å²	103.4	53%	0.526	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.6	-174.8	24.7	-35	0	0	0	113.9	Y1129	Y1129-P1144 WeakPolarHBondContact CE2-O 3.5Å
1145	N	54.4	Low	55.8	Low	129 Å²	129	106.5 Å²	106.5	69%	0.69	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	20.3	-177.6	-61.1	-19.2	0	0	0	113.6	H1143 I1147	H1143-N1145 PolarHBondContact O-N 3.07Å; H1143-N1145 VanDerWaalsContact O-N 3.14Å; N1145-I1147 PolarHBondContact O-N 3.02Å
1146	L	54.1	Low	53.4	Low	55 Å²	55	111.6 Å²	111.6	29%	0.288	59%	0.592	S	S	.	*			trans	-70.1	129.9	175.4	-93.6	168	0	0	0	111.3	M1128 I1135 H1143	M1128-L1146 HydrophobicContact CE-CB 3.9Å; M1128-L1146 WeakPolarHBondContact CE-O 3.28Å; I1135-L1146 HydrophobicContact CD1-CB 4.27Å; I1135-L1146 HydrophobicContact CD1-CD1 3.47Å; I1135-L1146 VanDerWaalsContact CD1-CD1 3.47Å; H1143-L1146 HydrophobicContact CB-CD1 3.52Å; H1143-L1146 HydrophobicContact CB-CG 3.89Å; H1143-L1146 PolarHBondContact O-N 2.93Å
1147	I	50.9	Low	51	Low	115 Å²	115	112.6 Å²	112.6	59%	0.59	60%	0.603	S	S	*	*			trans	-126.4	127.6	173.6	-54.3	172.2	0	0	0	106.8	N1145	N1145-I1147 PolarHBondContact O-N 3.02Å
1148	F	47.7	Very low	48.6	Very low	107 Å²	107	116.9 Å²	116.9	47%	0.469	63%	0.625	S	S	.	*			trans	-80.7	128.7	-179.3	-137.4	-97.4	0	0	0	109.6	M1128 D1130 H1133	M1128-F1148 HydrophobicContact CE-CB 3.91Å; M1128-F1148 HydrophobicContact CE-CD2 3.98Å; M1128-F1148 HydrophobicContact CE-CG 4.47Å; M1128-F1148 HydrophobicContact SD-CB 4.44Å; M1128-F1148 HydrophobicContact SD-CD2 3.86Å; D1130-F1148 WeakPolarHBondContact OD2-CB 3.4Å; D1130-F1148 PolarHBondContact OD2-N 3Å; H1133-F1148 HydrophobicContact CB-CB 4.19Å; H1133-F1148 HydrophobicContact CB-CD2 4.14Å; H1133-F1148 HydrophobicContact CB-CG 4.17Å; H1133-F1148 AromaticContact CD2-CD1 3.51Å; H1133-F1148 AromaticContact CD2-CE1 3.74Å; H1133-F1148 AromaticContact CD2-CG 3.75Å; H1133-F1148 AromaticContact CE1-CD1 3.62Å; H1133-F1148 AromaticContact CE1-CG 3.92Å; H1133-F1148 AromaticContact CG-CD1 3.82Å; H1133-F1148 AromaticContact CG-CD2 3.99Å; H1133-F1148 AromaticContact CG-CG 3.58Å; H1133-F1148 VanDerWaalsContact ND1-CB 3.31Å; H1133-F1148 WeakPolarHBondContact ND1-CB 3.46Å; H1133-F1148 AromaticContact ND1-CD1 3.87Å; H1133-F1148 AromaticContact ND1-CG 3.69Å; H1133-F1148 AromaticContact NE2-CD1 3.35Å; H1133-F1148 WeakPolarHBondContact NE2-CD1 3.25Å; H1133-F1148 AromaticContact NE2-CE1 3.75Å; H1133-F1148 AromaticContact NE2-CG 3.94Å
1149	R	45.5	Very low	46.3	Very low	195 Å²	195	112.6 Å²	112.6	74%	0.736	61%	0.614	S	S	*	*			trans	-118.3	116.1	168	-77.3	-178	167.2	178.3	-4.5	107
1150	G	34.8	Very low	44.3	Very low	64 Å²	64	111 Å²	111	66%	0.66	62%	0.623	S	S	*	*			trans	-63.1	146.7	-159.1	0	0	0	0	0	116
1151	R	36.3	Very low	42.3	Very low	254 Å²	254	120.3 Å²	120.3	96%	0.958	66%	0.656	S	S	*	*	S	Bend	trans	48.2	100.1	167	-66.8	-174.6	177.7	177.9	-0.3	117.1
1152	G	31.6	Very low	40.3	Very low	81 Å²	81	117.8 Å²	117.8	84%	0.835	65%	0.649	S	S	*	*	S	Bend	trans	144.3	-31.3	147.3	0	0	0	0	0	115.9
1153	T	34.1	Very low	38.6	Very low	113 Å²	113	116.9 Å²	116.9	69%	0.693	64%	0.64	S	S	*	*			trans	-100.9	138.6	-170.8	47.8	0	0	0	0	113.1	G1155	T1153-G1155 PolarHBondContact O-N 3.29Å
1154	K	32.8	Very low	37.3	Very low	199 Å²	199	116.1 Å²	116.1	87%	0.865	64%	0.639	S	S	*	*			trans	-52.8	132.5	151.7	-68.5	174.9	-179.6	172.5	0	106.8	V1156	K1154-V1156 PolarHBondContact O-N 2.88Å
1155	G	28	Very low	36	Very low	75 Å²	75	118.4 Å²	118.4	77%	0.773	65%	0.652	S	S	*	*			trans	-56.3	95.8	-172.6	0	0	0	0	0	112.9	T1153 S1157	T1153-G1155 PolarHBondContact O-N 3.29Å; G1155-S1157 PolarHBondContact O-N 3.39Å; G1155-S1157 VanDerWaalsContact O-N 3.1Å
1156	V	31.9	Very low	35.1	Very low	124 Å²	124	118.3 Å²	118.3	75%	0.752	66%	0.656	S	S	*	*			trans	-70.8	103.1	162.2	177.7	0	0	0	0	105.1	K1154 I1158	K1154-V1156 PolarHBondContact O-N 2.88Å; V1156-I1158 PolarHBondContact O-N 2.69Å; V1156-I1158 VanDerWaalsContact O-N 3.1Å
1157	S	31.3	Very low	34.1	Very low	79 Å²	79	121.6 Å²	121.6	55%	0.552	67%	0.674	S	S	*	*			trans	-54.9	116.4	172.7	52.2	0	0	0	0	109.1	G1155 A1159	G1155-S1157 PolarHBondContact O-N 3.39Å; G1155-S1157 VanDerWaalsContact O-N 3.1Å; S1157-A1159 PolarHBondContact O-N 3.14Å
1158	I	28.1	Very low	33.3	Very low	136 Å²	136	126.2 Å²	126.2	70%	0.697	69%	0.69	S	S	*	*			trans	-75.1	54.1	153.6	-48.8	180	0	0	0	107.2	V1156	V1156-I1158 PolarHBondContact O-N 2.69Å; V1156-I1158 VanDerWaalsContact O-N 3.1Å
1159	A	28.2	Very low	32.5	Very low	55 Å²	55	127.2 Å²	127.2	46%	0.455	70%	0.701	S	S	.	*			trans	-84.4	109.1	162.6	0	0	0	0	0	105.6	S1157 R1161	S1157-A1159 PolarHBondContact O-N 3.14Å; A1159-R1161 PolarHBondContact O-N 3.13Å
1160	T	31.7	Very low	31.7	Very low	129 Å²	129	126.3 Å²	126.3	79%	0.791	71%	0.705	S	S	*	*			trans	-40.4	127.7	136.1	34.4	0	0	0	0	108.2	L1162	T1160-L1162 PolarHBondContact O-N 3Å
1161	R	28.4	Very low	31.5	Very low	206 Å²	206	129.1 Å²	129.1	78%	0.777	71%	0.709	S	S	*	*	S	Bend	trans	-32.7	121.6	-172.7	-74.4	171.3	160.4	178.5	-10.4	113.3	D942 A1159	D942-R1161 IonicContact OD2-NH2 3.22Å; A1159-R1161 PolarHBondContact O-N 3.13Å
1162	L	31.8	Very low	31	Very low	101 Å²	101	124.9 Å²	124.9	53%	0.529	70%	0.698	S	S	.	*			trans	179.3	100.6	155	-97.7	153.1	0	0	0	106.1	D951 Q952 T1160	D951-L1162 WeakPolarHBondContact O-CD2 3.26Å; Q952-L1162 HydrophobicContact CG-CD2 4.08Å; T1160-L1162 PolarHBondContact O-N 3Å
1163	T	33	Very low	30.9	Very low	54 Å²	54	130.7 Å²	130.7	33%	0.331	70%	0.696	S	S	.	*				50.5	126.9	61.3	49.5	0	0	0	0	113.7	K948 D951	K948-T1163 HydrophobicContact CB-CG2 4.23Å; K948-T1163 HydrophobicContact CD-CG2 4.08Å; K948-T1163 HydrophobicContact CG-CG2 4.16Å; D951-T1163 PolarHBondContact O-OG1 3Å
1164	N	32.7	Very low	30.5	Very low	86 Å²	86	135.9 Å²	135.9	46%	0.46	71%	0.705	S	S	.	*			cis	-151	169.6	-9.6	-150.6	8.3	0	0	0	111.4	K948	K948-N1164 VanDerWaalsContact CB-ND2 3.34Å; K948-N1164 WeakPolarHBondContact CB-ND2 3.25Å; K948-N1164 PolarHBondContact O-ND2 2.86Å
1165	T	28.5	Very low	30.6	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	70%	0.695	S	S	*	*			trans	-78.1	133.9	176.7	50	0	0	0	0	112.7
1166	T	35.9	Very low	30.7	Very low	127 Å²	127	138.5 Å²	138.5	78%	0.779	70%	0.699	S	S	*	*			trans	-118.9	120.5	163.3	46	0	0	0	0	112.1
1167	N	33.3	Very low	30.5	Very low	125 Å²	125	141.1 Å²	141.1	67%	0.668	70%	0.7	S	S	*	*			trans	20.8	133.7	142.9	-52.7	-46	0	0	0	119.4
1168	F	33.2	Very low	30.4	Very low	211 Å²	211	143.8 Å²	143.8	93%	0.925	71%	0.707	S	S	*	*				-146	147	100	-115.4	-78	0	0	0	112.5
1169	N	30.6	Very low	30.5	Very low	129 Å²	129	142.4 Å²	142.4	69%	0.69	70%	0.701	S	S	*	*			trans	-88.9	175.8	-179.7	-81.2	-67.5	0	0	0	112
1170	Q	30	Very low	30.5	Very low	176 Å²	176	147.9 Å²	147.9	82%	0.822	72%	0.715	S	S	*	*			trans	85.6	119.1	157.2	-62.7	170.2	7.9	0	0	119.2
1171	T	29.2	Very low	30.5	Very low	122 Å²	122	152.8 Å²	152.8	75%	0.748	72%	0.719	S	S	*	*			trans	63.6	112.5	143.5	52.6	0	0	0	0	119.3
1172	K	27.8	Very low	30.6	Very low	165 Å²	165	147.3 Å²	147.3	72%	0.717	71%	0.712	S	S	*	*				87.1	127.1	65.9	-169.4	-172.1	-172.6	179.9	0	112.1
1173	Y	28.1	Very low	30.6	Very low	203 Å²	203	150.4 Å²	150.4	80%	0.796	73%	0.728	S	S	*	*			trans	87.8	109.3	-179.5	-62.8	-76.9	0	0	0	118.9
1174	Y	25.3	Very low	30.4	Very low	223 Å²	223	155.6 Å²	155.6	88%	0.875	75%	0.749	S	S	*	*			trans	-64.2	177.3	147.3	-67.8	-91.6	0	0	0	111.1
1175	P	35.2	Very low	30.6	Very low	101 Å²	101	156.8 Å²	156.8	66%	0.656	76%	0.761	S	S	*	*				-132.7	178.6	-54.5	38.8	-24.6	0	0	0	110.8
1176	R	29.8	Very low	30.5	Very low	228 Å²	228	157 Å²	157	86%	0.86	76%	0.756	S	S	*	*			trans	175.1	124.9	137.1	-100.2	157.4	-170.4	-154.8	3	117.1
1177	K	29.2	Very low	30.2	Very low	179 Å²	179	157.8 Å²	157.8	78%	0.778	75%	0.754	S	S	*	*				56.1	121.9	122.4	-78.6	-170.4	173.6	-172.5	0	122.3
1178	L	28.9	Very low	30	Very low	134 Å²	134	161.3 Å²	161.3	70%	0.702	76%	0.763	S	S	*	*				95.7	122.5	124.3	-71	170	0	0	0	122
1179	N	29.2	Very low	29.7	Very low	108 Å²	108	162.7 Å²	162.7	58%	0.578	76%	0.764	S	S	*	*				90.8	102.7	127.4	-80.3	-18.9	0	0	0	122.5
1180	K	28.9	Very low	29.7	Very low	170 Å²	170	161.9 Å²	161.9	74%	0.739	77%	0.768	S	S	*	*				83.5	144.1	112	-76.3	177.7	-178.3	-177.6	0	120.8
1181	R	31.5	Very low	29.6	Very low	232 Å²	232	160.5 Å²	160.5	88%	0.875	77%	0.766	S	S	*	*			trans	75.3	144.5	158.8	-71.5	165.5	174.9	177.4	-3.9	116.2
1182	S	30.2	Very low	29.5	Very low	90 Å²	90	163.1 Å²	163.1	63%	0.629	77%	0.767	S	S	*	*			cis	-174.2	157.6	-17.4	48.3	0	0	0	0	111.7
1183	L	32	Very low	29.6	Very low	167 Å²	167	159.8 Å²	159.8	87%	0.874	77%	0.765	S	S	*	*			trans	78.7	123.8	154.4	-70.3	155.1	0	0	0	119.8
1184	Q	29.9	Very low	29.8	Very low	163 Å²	163	156.1 Å²	156.1	76%	0.762	76%	0.764	S	S	*	*			trans	-55.8	173.7	149.5	-79.4	174.4	-21	0	0	112.1
1185	P	35.5	Very low	30.1	Very low	110 Å²	110	152 Å²	152	71%	0.714	76%	0.757	S	S	*	*			cis	-145.7	156.3	29	39.2	-17.5	0	0	0	121.1
1186	I	26.9	Very low	30.1	Very low	134 Å²	134	153.7 Å²	153.7	69%	0.687	76%	0.759	S	S	*	*				24.7	130.2	121.6	-27.2	164.6	0	0	0	119.1
1187	I	28.9	Very low	30.3	Very low	143 Å²	143	149.7 Å²	149.7	73%	0.733	75%	0.753	S	S	*	*				156	118	121.9	-79.6	177	0	0	0	113.3
1188	K	30.3	Very low	30.4	Very low	199 Å²	199	147 Å²	147	87%	0.865	75%	0.748	S	S	*	*			trans	36	137.3	146.9	-58.8	-178.4	179	-179.3	0	122.7
1189	Y	26.7	Very low	30.7	Very low	240 Å²	240	147.1 Å²	147.1	94%	0.941	75%	0.749	S	S	*	*			trans	-57.1	146.6	161.6	-81.2	-97	0	0	0	114.1
1190	S	30.6	Very low	31.1	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	75%	0.752	S	S	*	*			trans	-146.2	113.9	150.7	-170	0	0	0	0	111.6
1191	L	26.7	Very low	31.4	Very low	147 Å²	147	149.8 Å²	149.8	77%	0.77	75%	0.752	S	S	*	*			trans	26	136.2	150.1	-71.5	167.6	0	0	0	122.7
1192	K	28.9	Very low	31.5	Very low	177 Å²	177	144.8 Å²	144.8	77%	0.77	74%	0.742	S	S	*	*			trans	86.7	93.9	143.8	-73.6	174.2	178.6	-178.8	0	121.1
1193	S	28.6	Very low	31.7	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	75%	0.745	S	S	*	*				73	146.3	115.4	66.4	0	0	0	0	122.5
1194	T	32	Very low	31.8	Very low	126 Å²	126	146.4 Å²	146.4	77%	0.773	74%	0.739	S	S	*	*			trans	66.3	140.6	157.9	45.7	0	0	0	0	118.1
1195	N	33.2	Very low	31.9	Very low	137 Å²	137	148.7 Å²	148.7	73%	0.733	75%	0.747	S	S	*	*			cis	-166.8	-175.9	-18.1	-143.1	-5.4	0	0	0	108.9
1196	L	33.7	Very low	31.6	Very low	135 Å²	135	151.3 Å²	151.3	71%	0.707	75%	0.749	S	S	*	*			trans	76.8	126.7	163	-61.5	132.6	0	0	0	116.1
1197	I	34.3	Very low	31.9	Very low	144 Å²	144	154.5 Å²	154.5	74%	0.738	75%	0.754	S	S	*	*				85.9	130.1	61.2	-82.4	173.4	0	0	0	111.2
1198	D	32.7	Very low	32.1	Very low	124 Å²	124	155.3 Å²	155.3	66%	0.663	75%	0.752	S	S	*	*			cis	-169.1	-163.7	0	-138.9	-36.2	0	0	0	112
1199	L	35	Very low	32.1	Very low	136 Å²	136	153 Å²	153	71%	0.712	75%	0.749	S	S	*	*			trans	80.6	114.7	157.3	-64.6	124.6	0	0	0	117
1200	H	36.1	Very low	32.3	Very low	140 Å²	140	151 Å²	151	65%	0.648	75%	0.748	S	S	*	*				79.5	145.6	72.6	-78.4	-16.3	0	0	0	113.8
1201	R	35	Very low	32.1	Very low	194 Å²	194	154.3 Å²	154.3	73%	0.732	75%	0.752	S	S	*	*			cis	-164.2	142	12.1	-127	168.1	-171.2	-175	2.1	114.3
1202	N	33.8	Very low	32.6	Very low	127 Å²	127	152.7 Å²	152.7	68%	0.679	75%	0.75	S	S	*	*			trans	60.4	158	130	-79.5	37.8	0	0	0	126.6
1203	N	35.6	Very low	32.6	Very low	130 Å²	130	148.1 Å²	148.1	70%	0.695	75%	0.745	S	S	*	*			trans	84.4	109.1	157.1	-61.7	-16.1	0	0	0	117
1204	H	33.1	Very low	32.7	Very low	160 Å²	160	151.7 Å²	151.7	74%	0.741	76%	0.756	S	S	*	*				85.4	123.3	66.1	-92	-60.2	0	0	0	114.2
1205	F	32.5	Very low	32.6	Very low	212 Å²	212	150.2 Å²	150.2	93%	0.93	75%	0.751	S	S	*	*				-169.5	154.8	122.2	-108.6	-71.1	0	0	0	112.8
1206	H	29.6	Very low	32.5	Very low	165 Å²	165	147.9 Å²	147.9	76%	0.764	75%	0.745	S	S	*	*			trans	-117	142.1	-177.1	-98.3	-75.8	0	0	0	112.1
1207	Y	32.4	Very low	32.3	Very low	201 Å²	201	151.8 Å²	151.8	79%	0.788	75%	0.751	S	S	*	*			trans	-151.4	114.9	149.7	-102.8	-93.1	0	0	0	108.1
1208	K	33.9	Very low	32.1	Very low	160 Å²	160	155.5 Å²	155.5	70%	0.696	76%	0.757	S	S	*	*				65.1	109.9	87.6	-77.6	178.5	177.9	173.9	0	113.9
1209	N	28.9	Very low	32.1	Very low	149 Å²	149	156.1 Å²	156.1	80%	0.797	76%	0.756	S	S	*	*				75.3	116.1	80.8	-90	5.9	0	0	0	115.3
1210	Q	32.2	Very low	32	Very low	198 Å²	198	158.5 Å²	158.5	93%	0.925	76%	0.756	S	S	*	*				-178.5	158.9	120.8	-99	164	4.8	0	0	114.4
1211	Q	27	Very low	31.8	Very low	182 Å²	182	159.9 Å²	159.9	85%	0.85	76%	0.76	S	S	*	*			trans	-111.7	-154	172.4	-45.9	167.8	-47.4	0	0	107.7
1212	P	35.7	Very low	31.6	Very low	113 Å²	113	158.9 Å²	158.9	73%	0.734	76%	0.762	S	S	*	*			cis	-137.8	-169.8	-21.9	31.6	-8.5	0	0	0	114.9
1213	A	28.7	Very low	31.4	Very low	82 Å²	82	159.4 Å²	159.4	68%	0.678	76%	0.764	S	S	*	*			trans	105.6	149.7	133.2	0	0	0	0	0	122.4
1214	L	32	Very low	31.2	Very low	171 Å²	171	158.2 Å²	158.2	90%	0.895	77%	0.765	S	S	*	*			trans	72.2	146.6	167.4	-57.7	156.5	0	0	0	117.1
1215	S	28.8	Very low	31.1	Very low	95 Å²	95	158 Å²	158	66%	0.664	77%	0.769	S	S	*	*			cis	-166.7	147.3	-22.2	177.8	0	0	0	0	112.7
1216	S	31.3	Very low	31.2	Very low	88 Å²	88	156.7 Å²	156.7	62%	0.615	76%	0.763	S	S	*	*			trans	62.5	116.3	146.2	53	0	0	0	0	124.6
1217	R	28.9	Very low	31.3	Very low	216 Å²	216	151.7 Å²	151.7	82%	0.815	76%	0.756	S	S	*	*			trans	63.8	125	130.5	-57.4	176	-170.2	174	4.6	121.2
1218	Y	31.7	Very low	31.5	Very low	222 Å²	222	148.7 Å²	148.7	87%	0.871	75%	0.753	S	S	*	*				171.3	172.9	111.5	-90.9	-68.8	0	0	0	109.8
1219	H	31.3	Very low	31.9	Very low	138 Å²	138	145.8 Å²	145.8	64%	0.639	75%	0.751	S	S	*	*				-146.8	171.3	-99.2	-165.5	-92.9	0	0	0	110.8
1220	Y	32.5	Very low	32	Very low	186 Å²	186	145.3 Å²	145.3	73%	0.729	75%	0.748	S	S	*	*			trans	79.1	123.6	-178.7	-65.3	-102.6	0	0	0	115
1221	K	32.1	Very low	32.1	Very low	168 Å²	168	142.9 Å²	142.9	73%	0.73	75%	0.747	S	S	*	*				85.1	136.7	55.8	-75.8	177.2	178	174.2	0	112
1222	K	31	Very low	32.2	Very low	174 Å²	174	141 Å²	141	76%	0.757	74%	0.741	S	S	*	*			cis	-164.9	158.1	19.6	-147.3	-170.4	172	-169.2	0	113.1
1223	L	30.4	Very low	32.1	Very low	138 Å²	138	143.4 Å²	143.4	72%	0.723	75%	0.746	S	S	*	*			trans	77.4	129.8	164.3	-55.6	158.8	0	0	0	116.2
1224	S	30.9	Very low	32.1	Very low	104 Å²	104	145.2 Å²	145.2	73%	0.727	75%	0.749	S	S	*	*			cis	82.7	130.8	21.3	-47.5	0	0	0	0	115
1225	L	31.9	Very low	32.3	Very low	156 Å²	156	142 Å²	142	82%	0.817	74%	0.738	S	S	*	*			cis	-134.2	147.4	9.9	-76.8	96.6	0	0	0	110.8
1226	K	33.2	Very low	32.6	Very low	185 Å²	185	147.9 Å²	147.9	80%	0.804	75%	0.746	S	S	*	*				47.4	135.7	86.3	-69.3	-162.1	167	-140.3	0	115.9
1227	G	32.3	Very low	32.8	Very low	60 Å²	60	151 Å²	151	62%	0.619	76%	0.756	S	S	*	*			cis	107	118	18.6	0	0	0	0	0	109.3
1228	D	36.4	Very low	33.1	Very low	137 Å²	137	151.1 Å²	151.1	73%	0.733	78%	0.78	S	S	*	*				147.3	-179.6	81.4	-79.7	-44.4	0	0	0	106.6
1229	P	41.7	Very low	33.2	Very low	99 Å²	99	147.6 Å²	147.6	64%	0.643	78%	0.775	S	S	*	*				-138.5	-160.3	-50	41.6	-23.7	0	0	0	113.5
1230	D	32	Very low	33.2	Very low	140 Å²	140	148.1 Å²	148.1	75%	0.749	78%	0.783	S	S	*	*			trans	64.1	106.4	150.1	-62.4	-17.8	0	0	0	123.1
1231	V	33.3	Very low	33.3	Very low	147 Å²	147	146 Å²	146	89%	0.891	79%	0.786	S	S	*	*			trans	-137.9	130.5	133	177	0	0	0	0	109.7
1232	I	30.5	Very low	33.4	Very low	143 Å²	143	144.7 Å²	144.7	73%	0.733	79%	0.789	S	S	*	*			trans	-92.1	145.2	174.9	-61.5	158.8	0	0	0	109.4
1233	I	34.2	Very low	33.5	Very low	163 Å²	163	142.9 Å²	142.9	84%	0.836	79%	0.791	S	S	*	*			trans	178.6	141.9	140.2	-95.2	153.7	0	0	0	111.6
1234	T	28.1	Very low	33.7	Very low	120 Å²	120	143.2 Å²	143.2	74%	0.736	80%	0.795	S	S	*	*			trans	-112	-172.2	172.5	64.7	0	0	0	0	108.9
1235	P	36.3	Very low	33.9	Very low	103 Å²	103	146 Å²	146	67%	0.669	80%	0.8	S	S	*	*			cis	-133.2	-154.3	-11.5	26.3	0.3	0	0	0	111.6
1236	R	34.5	Very low	34.1	Very low	218 Å²	218	145.2 Å²	145.2	82%	0.823	80%	0.799	S	S	*	*			trans	95.4	123.8	151.6	-70.8	177.8	173.9	177.7	-3.3	120.3
1237	N	36.4	Very low	34.1	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	80%	0.798	S	S	*	*			trans	63.7	97.7	143	-58.1	25.9	0	0	0	117.3
1238	V	34.1	Very low	34.3	Very low	219 Å²	219	149.4 Å²	149.4	100%	1.327	82%	0.815	S	S	*	*			trans	-80.3	0	151.6	-177.8	0	0	0	0	108.5

Retrieved 1,238 of 1,238 residues in 603.3 ms (Link to these results)

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