X2JEX4_DROME Loading...

No long nerve cord, isoform F

AlphaFold DB , UniProt , Accession X2JEX4, Species DROME (Drosophila melanogaster, Fruit fly), Gene nolo, Length 1,208 aa.

						>X2JEX4_DROME|X2JEX4|nolo
MSVNMNWTSPKIWAALFVTTLCLLDTQAAWAKKLNASQAFDDTWNTASDLENELEQQKRSKVQSAGGGGGAGGGPGQWSSWSDWSTCSRTCDGGIMHQMRRCGSPGSCRGESTRYRICNMQPCPEQQDFRSSQCSAYNDVPYDGTLYKWTPHYDYVEPCALTCRGHPAHLVEDISRETGDGNAEEAEHYDEQSVIVQLSARVQDGTRCRSGSLDMCIQGKCQRVGCDLKIGSTKKIDGCGVCGGDGNSCSQPLFNWEMAPMSQCSVTCGSGYKMSRPICRNRLTNADVDDTLCSVTNRPEASVEQCNTHSCPPRWIADDWSTCSRLCGHGYRERMVVCAEESNGIKTRVADIMCRTPKPPTQETCIIEECPHWEVEDWTGCSVSCGQGIQMRGVECKSTDGSLSAKCDPLTKPGSMQQCSTGIHCGGSLNKVGGTIIVGSSRSLNERSERQLDSSDADEDNEDENDEGDDVDDLESGQDTDDGEGLSYADQPLLYAHRTQSRLNQEAPDEPRTMHLMNGNSNNNFNRGEDESEGPSLDPTYIKDNEWSPCSVTCGEGIRRRTYNCKIFLEYSRTVATVNDSLCEGKKPHDEVERCVEDPCMLPSHGFDDQFPRDSIKVGVSEPGKTYVWREQGYTSCSASCLGGVEELIINCVREDNGRVVSPFLCSPETKPEARVRTCNDRPCPPRWNYSDYTPCSKSCGIGIKTREVQCIHEVTRGGDNTMVVPNSMCPQPPPADRQYCNVLDCPVRWEVGEWSKCSHTCGYGFKDRKVECKQIMAQEHKIERPESMCPSAKPADKKPCNVKPCPPEDPKPVIQINNSTHIQHDPKKTKITLKVGGAGLVFFGTQVKIKCPVKRYNRTKIKWSKDHKPLQRSRKYKVSKKGALRILDITFRDAGVYSCHAGLSSAEISIEVKAKPGQQIEELEQQETERLVREKSGTEALTSADMKSADGTGTSTAVGPNSHVNGSAQQHGSRRRQQQSERLQNGRERSRRPKSDGVQHADSSIMEDDLSQLVQSEDRIPQPASASSGGSRTRTLLAMPYFQALLSNLQLLWPLQRFKDSRGQHLLQGEALKFGIDLSGKDFDQDESERVPAEQLPPEVLHSPSDPEYHEPSKSGPEADVPHVPPHMPHARWETGAAASTTAVPSLPNDGFVYRWMLGEWSQCSQECGAAGSGLQCRPRQPSYVGIPHVIAVMPGPWACVDFIATS
					

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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	34.1	Very low	31.2	Very low	250 Å²	250	148 Å²	148	100%	1.232	79%	0.791	S	S	*	*				0	158.5	0	-70.6	176.4	172.3	0	0	108.4
2	S	23.8	Very low	32.2	Very low	111 Å²	111	147.9 Å²	147.9	78%	0.776	79%	0.788	S	S	*	*			trans	-80.1	-173.6	176.7	-48.6	0	0	0	0	112.2
3	V	27.7	Very low	32.3	Very low	124 Å²	124	149.8 Å²	149.8	75%	0.752	78%	0.778	S	S	*	*			trans	81.2	112.3	171	-158.5	0	0	0	0	111.1
4	N	26.4	Very low	32.8	Very low	143 Å²	143	145.9 Å²	145.9	77%	0.765	78%	0.778	S	S	*	*				60.4	150.2	65.9	-69.5	-40.1	0	0	0	112.2
5	M	28.3	Very low	33.3	Very low	147 Å²	147	141.3 Å²	141.3	72%	0.724	77%	0.769	S	S	*	*			cis	-132.7	152.9	-1.4	-99.8	121.9	70.8	0	0	106.8
6	N	27.6	Very low	33.9	Very low	129 Å²	129	137.7 Å²	137.7	69%	0.69	75%	0.748	S	S	*	*				68.4	147.1	56.9	-163	10.1	0	0	0	113.2
7	W	29.5	Very low	34.3	Very low	199 Å²	199	137.7 Å²	137.7	75%	0.754	74%	0.74	S	S	*	*			trans	73.8	139.1	-178	-55.5	78.6	0	0	0	115.4
8	T	28.2	Very low	34.9	Very low	103 Å²	103	136.1 Å²	136.1	63%	0.632	74%	0.735	S	S	*	*			cis	-163.2	156	-10.8	6.6	0	0	0	0	114.1
9	S	34.3	Very low	35.5	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	73%	0.73	S	S	*	*			trans	74.3	159.2	141.5	-69.1	0	0	0	0	121.2
10	P	46.8	Very low	35.9	Very low	115 Å²	115	132.2 Å²	132.2	75%	0.747	72%	0.721	S	S	*	*			trans	-112	-168.5	-156.1	42.2	-33.2	0	0	0	115
11	K	36.5	Very low	36.2	Very low	195 Å²	195	132.4 Å²	132.4	85%	0.848	72%	0.721	S	S	*	*			trans	94.5	37	177.5	-53.8	-177.7	178.4	-177.8	0	118
12	I	42.8	Very low	36.3	Very low	147 Å²	147	125.6 Å²	125.6	75%	0.754	70%	0.696	S	S	*	*	S	Bend	trans	-117.6	-30.9	168.8	-66.4	-178.3	0	0	0	113.9	A14	I12-A14 PolarHBondContact O-N 2.63Å
13	W	33.4	Very low	37	Very low	173 Å²	173	127.3 Å²	127.3	66%	0.655	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-87.4	0.6	-174.4	-93.6	68.9	0	0	0	116.9	A15 L16 F17	W13-A15 PolarHBondContact O-N 3.18Å; W13-L16 HydrophobicContact CD2-CB 4.15Å; W13-L16 HydrophobicContact CD2-CD1 3.88Å; W13-L16 HydrophobicContact CE3-CB 3.7Å; W13-L16 HydrophobicContact CE3-CD1 4.16Å; W13-L16 HydrophobicContact CG-CD1 4.47Å; W13-L16 HydrophobicContact CH2-CB 4.42Å; W13-L16 HydrophobicContact CH2-CD1 4.01Å; W13-L16 HydrophobicContact CZ2-CD1 3.7Å; W13-L16 HydrophobicContact CZ3-CB 3.86Å; W13-L16 HydrophobicContact CZ3-CD1 4.22Å; W13-L16 PolarHBondContact O-N 3.47Å; W13-F17 HydrophobicContact CE3-CD2 4.37Å
14	A	39.8	Very low	37.4	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-65.3	-8.7	175.8	0	0	0	0	0	114.2	I12	I12-A14 PolarHBondContact O-N 2.63Å
15	A	41.1	Very low	37.9	Very low	78 Å²	78	129 Å²	129	65%	0.645	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-103.6	-5.7	178.1	0	0	0	0	0	114.5	W13	W13-A15 PolarHBondContact O-N 3.18Å
16	L	42.2	Very low	38.4	Very low	83 Å²	83	128.3 Å²	128.3	44%	0.435	70%	0.704	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.5	-9.1	-174.6	-78.2	169.5	0	0	0	114.7	W13	W13-L16 HydrophobicContact CD2-CB 4.15Å; W13-L16 HydrophobicContact CD2-CD1 3.88Å; W13-L16 HydrophobicContact CE3-CB 3.7Å; W13-L16 HydrophobicContact CE3-CD1 4.16Å; W13-L16 HydrophobicContact CG-CD1 4.47Å; W13-L16 HydrophobicContact CH2-CB 4.42Å; W13-L16 HydrophobicContact CH2-CD1 4.01Å; W13-L16 HydrophobicContact CZ2-CD1 3.7Å; W13-L16 HydrophobicContact CZ3-CB 3.86Å; W13-L16 HydrophobicContact CZ3-CD1 4.22Å; W13-L16 PolarHBondContact O-N 3.47Å
17	F	40.7	Very low	38.8	Very low	138 Å²	138	130.5 Å²	130.5	61%	0.605	71%	0.711	S	S	*	*	S	Bend	trans	-87.9	-11.6	178	-110	-86	0	0	0	114.6	W13	W13-F17 HydrophobicContact CE3-CD2 4.37Å
18	V	45.3	Very low	39.1	Very low	108 Å²	108	125.6 Å²	125.6	66%	0.655	71%	0.713	S	S	*	*	S	Bend	trans	-89.2	-21.5	-174.8	-176.8	0	0	0	0	112.2
19	T	45.2	Very low	39.4	Very low	104 Å²	104	124.5 Å²	124.5	64%	0.638	71%	0.714	S	S	*	*	S	Bend	trans	-93.2	-13.2	-176.4	45.5	0	0	0	0	114.5
20	T	43.7	Very low	39.2	Very low	91 Å²	91	131.3 Å²	131.3	56%	0.558	72%	0.722	S	S	*	*	S	Bend	trans	-92.2	-13.5	177.2	40.8	0	0	0	0	114	C22	T20-C22 VanDerWaalsContact C-N 3.35Å; T20-C22 PolarHBondContact O-N 3.19Å
21	L	42.1	Very low	38.5	Very low	136 Å²	136	130.3 Å²	130.3	71%	0.712	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-2.7	-176.3	-86.5	165.7	0	0	0	115.5
22	C	37.8	Very low	38.4	Very low	107 Å²	107	130.3 Å²	130.3	72%	0.723	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	8.8	-177.7	-62.3	0	0	0	0	114.8	T20	T20-C22 VanDerWaalsContact C-N 3.35Å; T20-C22 PolarHBondContact O-N 3.19Å
23	L	38.4	Very low	38.2	Very low	148 Å²	148	133.2 Å²	133.2	78%	0.775	73%	0.731	S	S	*	*	S	Bend	trans	-134.6	21.9	-173.3	-80.3	174.4	0	0	0	115.2
24	L	35.4	Very low	38.3	Very low	164 Å²	164	132.6 Å²	132.6	86%	0.859	74%	0.739	S	S	*	*	S	Bend	trans	-127.1	17.5	171.7	-75.7	174.4	0	0	0	113.7	T26	L24-T26 PolarHBondContact O-N 2.8Å
25	D	36.9	Very low	37.9	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	73%	0.733	S	S	*	*			trans	-100.9	35.5	-173.6	-152.8	10.6	0	0	0	113.2
26	T	39.7	Very low	37.6	Very low	132 Å²	132	135 Å²	135	81%	0.81	74%	0.742	S	S	*	*	S	Bend	trans	-135.5	12.1	-173.7	50.9	0	0	0	0	115.3	L24	L24-T26 PolarHBondContact O-N 2.8Å
27	Q	35.7	Very low	37.5	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.822	75%	0.747	S	S	*	*	S	Bend	trans	-123	5.9	171.5	-69	-170	-14.8	0	0	114.5	A29	Q27-A29 PolarHBondContact O-N 3Å
28	A	34.8	Very low	37.5	Very low	96 Å²	96	134.8 Å²	134.8	79%	0.793	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	44.7	179.4	0	0	0	0	0	114.3
29	A	35	Very low	37	Very low	79 Å²	79	133.2 Å²	133.2	65%	0.653	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.6	-24.6	-174	0	0	0	0	0	116.4	Q27	Q27-A29 PolarHBondContact O-N 3Å
30	W	29.9	Very low	36.4	Very low	256 Å²	256	134.2 Å²	134.2	97%	0.97	74%	0.743	S	S	*	*	S	Bend	trans	-117.9	33.1	-172.8	-82.6	64.8	0	0	0	113.7
31	A	31.8	Very low	36.2	Very low	93 Å²	93	133.6 Å²	133.6	77%	0.769	74%	0.737	S	S	*	*			trans	-133.1	39.8	177.5	0	0	0	0	0	112.6
32	K	35.6	Very low	36	Very low	196 Å²	196	133.1 Å²	133.1	85%	0.852	74%	0.735	S	S	*	*			trans	-133.6	62.8	178.9	-73.1	-168.8	174.7	-176.9	0	113
33	K	37.4	Very low	36.1	Very low	207 Å²	207	132 Å²	132	90%	0.9	73%	0.725	S	S	*	*	S	Bend	trans	-155.4	19.8	160.2	-129.1	180	-177.3	-174.5	0	116.4
34	L	36.8	Very low	36	Very low	160 Å²	160	134 Å²	134	84%	0.838	72%	0.722	S	S	*	*	S	Bend	trans	-134	158.4	164	-73.8	172	0	0	0	107.9
35	N	31.1	Very low	36.1	Very low	120 Å²	120	131.6 Å²	131.6	64%	0.642	71%	0.71	S	S	*	*			trans	57.2	84.5	-171.6	-67.7	25.5	0	0	0	115	Q38	N35-Q38 PolarHBondContact ND2-OE1 2.95Å
36	A	33.5	Very low	36.5	Very low	102 Å²	102	128.5 Å²	128.5	84%	0.843	70%	0.696	S	S	*	*			trans	-95.9	-8	164.5	0	0	0	0	0	113.3
37	S	40.8	Very low	36.4	Very low	75 Å²	75	124.9 Å²	124.9	52%	0.524	68%	0.68	S	S	.	*	S	Bend	trans	-85.9	-3.6	-173.6	45.5	0	0	0	0	115.2
38	Q	39.7	Very low	36.7	Very low	143 Å²	143	120 Å²	120	67%	0.668	67%	0.665	S	S	*	*	S	Bend	trans	-119	21.5	-166.2	-150.9	163.1	27.9	0	0	113.8	N35	N35-Q38 PolarHBondContact ND2-OE1 2.95Å
39	A	36.3	Very low	37.2	Very low	74 Å²	74	120.4 Å²	120.4	61%	0.612	65%	0.654	S	S	*	*	S	Bend	trans	-117.1	0.6	-178.9	0	0	0	0	0	114	T43	A39-T43 PolarHBondContact O-OG1 3.48Å; A39-T43 VanDerWaalsContact O-OG1 3.1Å
40	F	32.5	Very low	37.5	Very low	125 Å²	125	122.1 Å²	122.1	55%	0.548	65%	0.652	S	S	.	*	S	Bend	trans	-97.1	-33.3	-173.5	-147.6	-100.3	0	0	0	113.1	D42 T43 W44	F40-D42 VanDerWaalsContact C-N 3.32Å; F40-D42 PolarHBondContact O-N 2.69Å; F40-T43 WeakPolarHBondContact CA-OG1 3Å; F40-T43 PolarHBondContact O-N 3.41Å; F40-T43 VanDerWaalsContact O-N 3.13Å; F40-T43 PolarHBondContact O-OG1 3.26Å; F40-T43 VanDerWaalsContact O-OG1 3.12Å; F40-W44 AromaticContact CE1-CD1 3.54Å; F40-W44 AromaticContact CE1-NE1 3.83Å; F40-W44 PolarHBondContact O-N 2.73Å
41	D	39.7	Very low	38.2	Very low	78 Å²	78	116.9 Å²	116.9	42%	0.417	64%	0.638	S	S	.	*	H	α-helix	trans	-57.9	-41.3	177.1	-73.8	-68.6	0	0	0	112.8	T43 N45	D41-T43 VanDerWaalsContact C-N 3.31Å; D41-T43 PolarHBondContact O-N 3.17Å; D41-N45 PolarHBondContact O-ND2 3.07Å
42	D	37	Very low	38.7	Very low	126 Å²	126	116.5 Å²	116.5	67%	0.674	62%	0.623	S	S	*	*	H	α-helix	trans	-72.1	-21.7	179.5	-77.6	-23.7	0	0	0	113	F40 T46	F40-D42 VanDerWaalsContact C-N 3.32Å; F40-D42 PolarHBondContact O-N 2.69Å; D42-T46 WeakPolarHBondContact O-CB 3.4Å; D42-T46 WeakPolarHBondContact O-CG2 3.24Å; D42-T46 PolarHBondContact O-OG1 2.7Å
43	T	40.1	Very low	39.3	Very low	84 Å²	84	112.7 Å²	112.7	52%	0.515	61%	0.608	S	S	.	*	H	α-helix	trans	-87.3	-28.2	-177.7	16.9	0	0	0	0	113.9	A39 F40 D41 T46	A39-T43 PolarHBondContact O-OG1 3.48Å; A39-T43 VanDerWaalsContact O-OG1 3.1Å; F40-T43 WeakPolarHBondContact CA-OG1 3Å; F40-T43 PolarHBondContact O-N 3.41Å; F40-T43 VanDerWaalsContact O-N 3.13Å; F40-T43 PolarHBondContact O-OG1 3.26Å; F40-T43 VanDerWaalsContact O-OG1 3.12Å; D41-T43 VanDerWaalsContact C-N 3.31Å; D41-T43 PolarHBondContact O-N 3.17Å; T43-T46 PolarHBondContact O-OG1 3.19Å
44	W	36.4	Very low	39.5	Very low	191 Å²	191	107.5 Å²	107.5	72%	0.723	59%	0.59	S	S	*	*	H	α-helix	trans	-84.6	-34.2	176.8	-102.4	94	0	0	0	113.8	F40	F40-W44 AromaticContact CE1-CD1 3.54Å; F40-W44 AromaticContact CE1-NE1 3.83Å; F40-W44 PolarHBondContact O-N 2.73Å
45	N	38.3	Very low	40.1	Very low	113 Å²	113	103.8 Å²	103.8	60%	0.604	57%	0.568	S	S	*	*	H	α-helix	trans	-68.9	-37.3	175.2	-72.8	-78.1	0	0	0	111.8	D41 A47	D41-N45 PolarHBondContact O-ND2 3.07Å; N45-A47 PolarHBondContact O-N 2.84Å
46	T	44.9	Very low	40.9	Very low	73 Å²	73	104.1 Å²	104.1	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-72.5	-22.5	-179.1	49.3	0	0	0	0	114.4	D42 T43 D49 L50	D42-T46 WeakPolarHBondContact O-CB 3.4Å; D42-T46 WeakPolarHBondContact O-CG2 3.24Å; D42-T46 PolarHBondContact O-OG1 2.7Å; T43-T46 PolarHBondContact O-OG1 3.19Å; T46-D49 PolarHBondContact O-N 3.3Å; T46-L50 WeakPolarHBondContact O-CB 3.47Å; T46-L50 PolarHBondContact O-N 3.41Å
47	A	38	Very low	41.6	Very low	55 Å²	55	105.8 Å²	105.8	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-64.3	-47.6	177.7	0	0	0	0	0	112.4	N45 D49 L50 E51	N45-A47 PolarHBondContact O-N 2.84Å; A47-D49 VanDerWaalsContact C-N 3.33Å; A47-D49 PolarHBondContact O-N 3.15Å; A47-L50 PolarHBondContact O-N 3.09Å; A47-E51 PolarHBondContact O-N 2.96Å; A47-E51 VanDerWaalsContact O-N 3.16Å
48	S	41.4	Very low	41.8	Very low	74 Å²	74	108 Å²	108	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-69.2	-30.3	179	-169.2	0	0	0	0	112.7	N52	S48-N52 PolarHBondContact O-N 2.9Å; S48-N52 PolarHBondContact O-ND2 3.36Å
49	D	44.1	Very low	42.1	Very low	105 Å²	105	110.2 Å²	110.2	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-75.3	-37.8	174.5	-80.5	-19.4	0	0	0	112.3	T46 A47 E51 N52 E53	T46-D49 PolarHBondContact O-N 3.3Å; A47-D49 VanDerWaalsContact C-N 3.33Å; A47-D49 PolarHBondContact O-N 3.15Å; D49-E51 VanDerWaalsContact C-N 3.34Å; D49-E51 PolarHBondContact O-N 2.97Å; D49-N52 WeakPolarHBondContact O-CB 3.46Å; D49-N52 PolarHBondContact O-N 3.12Å; D49-E53 PolarHBondContact O-N 2.57Å
50	L	41.6	Very low	42.5	Very low	115 Å²	115	111.4 Å²	111.4	60%	0.602	56%	0.562	S	S	*	*	H	α-helix	trans	-63.8	-37.9	174	-112.8	73.1	0	0	0	112.5	T46 A47 N52 E53 L54	T46-L50 WeakPolarHBondContact O-CB 3.47Å; T46-L50 PolarHBondContact O-N 3.41Å; A47-L50 PolarHBondContact O-N 3.09Å; L50-N52 VanDerWaalsContact C-N 3.32Å; L50-E53 PolarHBondContact O-N 2.87Å; L50-L54 WeakPolarHBondContact O-CB 3.23Å; L50-L54 PolarHBondContact O-N 2.86Å
51	E	44.3	Very low	43.1	Very low	145 Å²	145	114.5 Å²	114.5	68%	0.678	58%	0.575	S	S	*	*	H	α-helix	trans	-68.6	-34.7	177.5	-149	167.3	-146.1	0	0	111.2	A47 D49 L54 E55	A47-E51 PolarHBondContact O-N 2.96Å; A47-E51 VanDerWaalsContact O-N 3.16Å; D49-E51 VanDerWaalsContact C-N 3.34Å; D49-E51 PolarHBondContact O-N 2.97Å; E51-L54 PolarHBondContact O-N 2.96Å; E51-E55 PolarHBondContact O-N 2.88Å
52	N	44	Very low	43.5	Very low	85 Å²	85	116.1 Å²	116.1	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-66.4	-39.1	169.2	-86.5	-74.1	0	0	0	113.3	S48 D49 L50 Q56	S48-N52 PolarHBondContact O-N 2.9Å; S48-N52 PolarHBondContact O-ND2 3.36Å; D49-N52 WeakPolarHBondContact O-CB 3.46Å; D49-N52 PolarHBondContact O-N 3.12Å; L50-N52 VanDerWaalsContact C-N 3.32Å; N52-Q56 WeakPolarHBondContact O-CB 3.36Å; N52-Q56 VanDerWaalsContact O-CG 3.27Å; N52-Q56 WeakPolarHBondContact O-CG 3.39Å; N52-Q56 PolarHBondContact O-N 3.04Å; N52-Q56 PolarHBondContact O-NE2 2.93Å
53	E	46.9	Very low	43.7	Very low	116 Å²	116	119.2 Å²	119.2	54%	0.542	60%	0.598	S	S	.	*	H	α-helix	trans	-66.9	-38.7	173.8	-73.3	-150.5	129.6	0	0	111.9	D49 L50 Q56 Q57	D49-E53 PolarHBondContact O-N 2.57Å; L50-E53 PolarHBondContact O-N 2.87Å; E53-Q56 PolarHBondContact O-N 2.95Å; E53-Q57 WeakPolarHBondContact O-CG 3.38Å; E53-Q57 PolarHBondContact O-N 3.36Å
54	L	43.1	Very low	43.8	Very low	99 Å²	99	121.4 Å²	121.4	52%	0.518	62%	0.617	S	S	.	*	H	α-helix	trans	-67.9	-37.9	178.9	-165.3	67.2	0	0	0	112	L50 E51 K58	L50-L54 WeakPolarHBondContact O-CB 3.23Å; L50-L54 PolarHBondContact O-N 2.86Å; E51-L54 PolarHBondContact O-N 2.96Å; L54-K58 WeakPolarHBondContact O-CG 3.42Å; L54-K58 PolarHBondContact O-N 3.34Å; L54-K58 VanDerWaalsContact O-N 3.15Å
55	E	47.4	Very low	43.9	Very low	81 Å²	81	117 Å²	117	38%	0.379	62%	0.622	S	S	.	*	H	α-helix	trans	-67.8	-38.1	169.2	-85.8	-60.5	120.3	0	0	112.4	E51 Q57 K58 R59	E51-E55 PolarHBondContact O-N 2.88Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 3.26Å; E55-K58 PolarHBondContact O-N 2.98Å; E55-K58 VanDerWaalsContact OE1-CD 3.24Å; E55-K58 WeakPolarHBondContact OE1-CD 3.34Å; E55-K58 IonicContact OE1-NZ 3.47Å; E55-K58 PolarHBondContact OE1-NZ 3.4Å; E55-R59 WeakPolarHBondContact O-CB 3.34Å; E55-R59 PolarHBondContact O-N 3.34Å
56	Q	48.9	Very low	43.6	Very low	127 Å²	127	115.9 Å²	115.9	59%	0.593	64%	0.636	S	S	*	*	H	α-helix	trans	-63.3	-36.8	174.2	-77	177	65.3	0	0	112.7	N52 E53 R59 S60	N52-Q56 WeakPolarHBondContact O-CB 3.36Å; N52-Q56 VanDerWaalsContact O-CG 3.27Å; N52-Q56 WeakPolarHBondContact O-CG 3.39Å; N52-Q56 PolarHBondContact O-N 3.04Å; N52-Q56 PolarHBondContact O-NE2 2.93Å; E53-Q56 PolarHBondContact O-N 2.95Å; Q56-R59 PolarHBondContact O-N 2.9Å; Q56-S60 WeakPolarHBondContact O-CB 3.28Å; Q56-S60 PolarHBondContact O-N 3.45Å; Q56-S60 VanDerWaalsContact O-N 3.08Å; Q56-S60 PolarHBondContact O-OG 3.34Å
57	Q	47.2	Very low	43.1	Very low	137 Å²	137	116.5 Å²	116.5	64%	0.64	66%	0.657	S	S	*	*	H	α-helix	trans	-69.3	-30.9	173.8	-71.1	-171	32.6	0	0	113	E53 E55 S60	E53-Q57 WeakPolarHBondContact O-CG 3.38Å; E53-Q57 PolarHBondContact O-N 3.36Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 3.26Å; Q57-S60 PolarHBondContact O-OG 3.45Å
58	K	46.4	Very low	42.9	Very low	121 Å²	121	117.6 Å²	117.6	53%	0.526	67%	0.674	S	S	.	*	H	α-helix	trans	-72.9	-44.4	169.8	-67.8	172.5	-161.7	162	0	112.1	L54 E55 S60 K61	L54-K58 WeakPolarHBondContact O-CG 3.42Å; L54-K58 PolarHBondContact O-N 3.34Å; L54-K58 VanDerWaalsContact O-N 3.15Å; E55-K58 PolarHBondContact O-N 2.98Å; E55-K58 VanDerWaalsContact OE1-CD 3.24Å; E55-K58 WeakPolarHBondContact OE1-CD 3.34Å; E55-K58 IonicContact OE1-NZ 3.47Å; E55-K58 PolarHBondContact OE1-NZ 3.4Å; K58-S60 VanDerWaalsContact C-N 3.32Å; K58-S60 PolarHBondContact O-N 3.49Å; K58-K61 PolarHBondContact O-N 2.02Å
59	R	45	Very low	42.5	Very low	191 Å²	191	118.3 Å²	118.3	72%	0.721	69%	0.693	S	S	*	*	H	α-helix	trans	-64.6	-35.1	-175.9	-141.7	77.1	175.1	-145.1	-0.2	112.7	E55 Q56 K61	E55-R59 WeakPolarHBondContact O-CB 3.34Å; E55-R59 PolarHBondContact O-N 3.34Å; Q56-R59 PolarHBondContact O-N 2.9Å; R59-K61 PolarHBondContact O-N 2.89Å
60	S	45.5	Very low	42.2	Very low	98 Å²	98	117.3 Å²	117.3	69%	0.685	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-7	-177.7	49.1	0	0	0	0	115	Q56 Q57 K58	Q56-S60 WeakPolarHBondContact O-CB 3.28Å; Q56-S60 PolarHBondContact O-N 3.45Å; Q56-S60 VanDerWaalsContact O-N 3.08Å; Q56-S60 PolarHBondContact O-OG 3.34Å; Q57-S60 PolarHBondContact O-OG 3.45Å; K58-S60 VanDerWaalsContact C-N 3.32Å; K58-S60 PolarHBondContact O-N 3.49Å
61	K	45.3	Very low	42.1	Very low	191 Å²	191	116.9 Å²	116.9	83%	0.83	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-0.7	-179.9	-147.3	168.2	-174.2	174.4	0	115.2	K58 R59	K58-K61 PolarHBondContact O-N 2.02Å; R59-K61 PolarHBondContact O-N 2.89Å
62	V	47.9	Very low	42.2	Very low	111 Å²	111	113.7 Å²	113.7	67%	0.673	73%	0.727	S	S	*	*	S	Bend	trans	-132.1	57.1	-177.9	-163.4	0	0	0	0	112.7
63	Q	41	Very low	42	Very low	191 Å²	191	112.9 Å²	112.9	89%	0.893	74%	0.738	S	S	*	*			trans	-166.6	86.8	155	-112.2	148.7	92.7	0	0	111.9
64	S	42.7	Very low	42	Very low	131 Å²	131	108.9 Å²	108.9	92%	0.916	73%	0.728	S	S	*	*			trans	-147	57.7	169.1	-155.5	0	0	0	0	111.3
65	A	37.8	Very low	42.4	Very low	99 Å²	99	109.9 Å²	109.9	82%	0.818	74%	0.741	S	S	*	*	S	Bend	trans	-157.7	135.2	170.4	0	0	0	0	0	109.8
66	G	32.9	Very low	42.9	Very low	88 Å²	88	106.7 Å²	106.7	91%	0.907	73%	0.73	S	S	*	*			trans	87.3	128.6	-178.8	0	0	0	0	0	113.5
67	G	33.4	Very low	43.9	Very low	87 Å²	87	106.1 Å²	106.1	90%	0.897	73%	0.727	S	S	*	*			trans	-158.4	178.9	177.7	0	0	0	0	0	111.7
68	G	33.2	Very low	45.6	Very low	77 Å²	77	102.5 Å²	102.5	79%	0.794	71%	0.708	S	S	*	*			trans	150.7	145	174.4	0	0	0	0	0	113.5
69	G	34.2	Very low	47.4	Very low	89 Å²	89	99.4 Å²	99.4	92%	0.918	70%	0.701	S	S	*	*			trans	79.8	104.5	171.2	0	0	0	0	0	114.9
70	G	38.4	Very low	49.3	Very low	85 Å²	85	95.1 Å²	95.1	88%	0.876	70%	0.701	S	S	*	*			trans	-108.1	158.1	173.8	0	0	0	0	0	113.2
71	A	37.7	Very low	51.2	Low	105 Å²	105	93.9 Å²	93.9	87%	0.868	68%	0.681	S	S	*	*			trans	-138.3	136.4	159.6	0	0	0	0	0	108.2	G73	A71-G73 PolarHBondContact O-N 2.99Å
72	G	48	Very low	53.4	Low	79 Å²	79	87.3 Å²	87.3	81%	0.814	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-74.2	126.3	-171	0	0	0	0	0	113.3
73	G	38.8	Very low	55.3	Low	67 Å²	67	89 Å²	89	69%	0.691	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-89.9	116.8	166	0	0	0	0	0	110.9	A71	A71-G73 PolarHBondContact O-N 2.99Å
74	G	46.4	Very low	57.5	Low	33 Å²	33	83.2 Å²	83.2	34%	0.34	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-72	163	174.7	0	0	0	0	0	113.1	G76 Q77	G74-G76 PolarHBondContact O-N 2.03Å; G74-G76 VanDerWaalsContact O-N 3.13Å; G74-Q77 PolarHBondContact O-N 3.34Å
75	P	51.5	Low	59.7	Low	119 Å²	119	78.3 Å²	78.3	77%	0.773	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	119.8	176.3	25.6	-33.7	0	0	0	109.9
76	G	59.3	Low	62.1	Low	15 Å²	15	79.7 Å²	79.7	16%	0.155	60%	0.598	C	S	.	*	T	Hydrogen-bonded Turn	trans	88.2	11.7	-175.2	0	0	0	0	0	116.8	G74 S107 C108	G74-G76 PolarHBondContact O-N 2.03Å; G74-G76 VanDerWaalsContact O-N 3.13Å; G76-S107 WeakPolarHBondContact CA-OG 3.47Å; G76-C108 PolarHBondContact O-SG 2.77Å
77	Q	69.9	Low	64.8	Low	114 Å²	114	76.7 Å²	76.7	53%	0.533	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-81.1	143.3	163.4	-83.6	178	-37.2	0	0	112.3	G74 G103 C108	G74-Q77 PolarHBondContact O-N 3.34Å; Q77-G103 PolarHBondContact O-N 2.87Å; Q77-C108 VanDerWaalsContact C-SG 3.57Å; Q77-C108 PolarHBondContact O-SG 2.82Å
78	W	82.6	Confident	67.3	Low	62 Å²	62	74.6 Å²	74.6	24%	0.235	54%	0.535	C	S	.	.	B	Isolated β-bridge	trans	-71.5	149.7	166.5	-70	109.6	0	0	0	110.5	R100 C102 C108 R109 G110	W78-R100 VanDerWaalsContact CD1-NH1 3.34Å; W78-R100 HydrophobicContact CD2-CG 4.01Å; W78-R100 HydrophobicContact CE3-CB 4.29Å; W78-R100 HydrophobicContact CE3-CG 3.6Å; W78-R100 HydrophobicContact CG-CG 4.43Å; W78-R100 HydrophobicContact CZ3-CG 4.13Å; W78-R100 WeakPolarHBondContact CZ3-O 3.41Å; W78-C102 HydrophobicContact CE3-CB 3.86Å; W78-C102 HydrophobicContact CH2-CB 4.17Å; W78-C102 HydrophobicContact CZ3-CB 3.65Å; W78-C108 HydrophobicContact CD2-CB 3.66Å; W78-C108 HydrophobicContact CE3-CB 4.22Å; W78-C108 HydrophobicContact CG-CB 4.06Å; W78-C108 HydrophobicContact CH2-CB 4.11Å; W78-C108 HydrophobicContact CZ2-CB 3.52Å; W78-C108 HydrophobicContact CZ3-CB 4.44Å; W78-R109 PolarHBondContact NE1-O 3.26Å; W78-G110 VanDerWaalsContact CZ2-O 3.25Å; W78-G110 WeakPolarHBondContact CZ2-O 3.22Å
79	S	84.3	Confident	69.5	Low	55 Å²	55	71.8 Å²	71.8	39%	0.385	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-61.2	168.9	160.4	71.3	0	0	0	0	111.4	R100 R101	S79-R100 WeakPolarHBondContact OG-CA 3.49Å; S79-R101 PolarHBondContact N-O 3Å; S79-R101 PolarHBondContact OG-N 3.01Å; S79-R101 PolarHBondContact OG-O 2.89Å
80	S	83.4	Confident	71.9	Confident	102 Å²	102	73.5 Å²	73.5	71%	0.713	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-50.9	153.4	154.8	43.9	0	0	0	0	110.9
81	W	87.5	Confident	73.9	Confident	71 Å²	71	70.5 Å²	70.5	27%	0.269	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-64.9	144.1	164.6	-66.2	104	0	0	0	109.4	Q98 M99 R100 R114	W81-Q98 HydrophobicContact CB-CB 4.45Å; W81-Q98 HydrophobicContact CE3-CB 3.9Å; W81-Q98 WeakPolarHBondContact CZ3-O 2.85Å; W81-M99 CarbonylContact C-O 3.59Å; W81-M99 WeakPolarHBondContact CA-O 3.48Å; W81-R100 HydrophobicContact CD2-CB 4.25Å; W81-R100 HydrophobicContact CD2-CG 4.18Å; W81-R100 HydrophobicContact CE3-CB 3.89Å; W81-R100 HydrophobicContact CE3-CG 3.74Å; W81-R100 HydrophobicContact CH2-CG 3.87Å; W81-R100 VanDerWaalsContact CH2-NE 3.31Å; W81-R100 HydrophobicContact CZ2-CG 4.29Å; W81-R100 VanDerWaalsContact CZ2-NE 3.31Å; W81-R100 HydrophobicContact CZ3-CB 4.22Å; W81-R100 HydrophobicContact CZ3-CG 3.57Å; W81-R114 HydrophobicContact CD2-CG 4.27Å; W81-R114 HydrophobicContact CE3-CG 3.95Å; W81-R114 HydrophobicContact CH2-CB 3.71Å; W81-R114 HydrophobicContact CH2-CG 3.72Å; W81-R114 HydrophobicContact CZ2-CB 4.26Å; W81-R114 HydrophobicContact CZ2-CG 4.05Å; W81-R114 HydrophobicContact CZ3-CB 3.99Å; W81-R114 HydrophobicContact CZ3-CG 3.67Å
82	S	89.7	Confident	75.7	Confident	53 Å²	53	67.7 Å²	67.7	37%	0.371	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-58.2	169.7	163.6	67.2	0	0	0	0	111	Q98 M99	S82-Q98 VanDerWaalsContact O-CG 3.27Å; S82-Q98 WeakPolarHBondContact O-CG 3.37Å; S82-Q98 PolarHBondContact O-NE2 2.88Å; S82-M99 PolarHBondContact N-O 2.91Å; S82-M99 PolarHBondContact OG-N 3.25Å
83	D	89.4	Confident	77.2	Confident	147 Å²	147	64 Å²	64	79%	0.786	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-61.5	160.2	156.8	-70.2	-62.1	0	0	0	111.3	Q98	D83-Q98 WeakPolarHBondContact O-CG 3.24Å
84	W	87	Confident	79.4	Confident	70 Å²	70	60.8 Å²	60.8	27%	0.265	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-68.7	141.5	177.7	-69	95.7	0	0	0	110.7	M96 H97 Q98 R114 R116	W84-M96 HydrophobicContact CB-CG 4.48Å; W84-M96 HydrophobicContact CB-SD 3.74Å; W84-M96 HydrophobicContact CD2-SD 4.43Å; W84-M96 HydrophobicContact CE3-CG 4Å; W84-M96 HydrophobicContact CG-SD 4.15Å; W84-M96 WeakPolarHBondContact CZ3-O 3.41Å; W84-H97 WeakPolarHBondContact CA-O 3.31Å; W84-Q98 HydrophobicContact CB-CG 4.23Å; W84-Q98 HydrophobicContact CD2-CB 4.44Å; W84-Q98 VanDerWaalsContact CD2-CD 3.47Å; W84-Q98 HydrophobicContact CD2-CG 3.48Å; W84-Q98 VanDerWaalsContact CD2-CG 3.48Å; W84-Q98 VanDerWaalsContact CE2-OE1 3.27Å; W84-Q98 HydrophobicContact CE3-CB 4.18Å; W84-Q98 HydrophobicContact CE3-CG 3.64Å; W84-Q98 HydrophobicContact CG-CG 3.75Å; W84-Q98 HydrophobicContact CH2-CG 4.5Å; W84-Q98 HydrophobicContact CZ2-CG 4.38Å; W84-Q98 HydrophobicContact CZ3-CB 4.25Å; W84-Q98 HydrophobicContact CZ3-CG 4.14Å; W84-R114 HydrophobicContact CH2-CG 3.92Å; W84-R114 HydrophobicContact CZ3-CG 4.33Å; W84-R116 VanDerWaalsContact CD1-CZ 3.42Å; W84-R116 VanDerWaalsContact CD1-NH2 3.28Å; W84-R116 HydrophobicContact CD2-CG 4.18Å; W84-R116 VanDerWaalsContact CD2-NE 3.28Å; W84-R116 HydrophobicContact CE3-CG 3.78Å; W84-R116 HydrophobicContact CH2-CB 3.87Å; W84-R116 HydrophobicContact CH2-CG 3.78Å; W84-R116 HydrophobicContact CZ2-CB 4.47Å; W84-R116 HydrophobicContact CZ2-CG 4.16Å; W84-R116 HydrophobicContact CZ3-CB 3.99Å; W84-R116 HydrophobicContact CZ3-CG 3.58Å
85	S	89.3	Confident	81.4	Confident	28 Å²	28	59.4 Å²	59.4	20%	0.196	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-58.6	166.4	168.8	73.6	0	0	0	0	111.5	M96 H97	S85-M96 WeakPolarHBondContact O-CB 3.23Å; S85-M96 WeakPolarHBondContact OG-CA 3.46Å; S85-M96 WeakPolarHBondContact OG-CB 3.42Å; S85-H97 PolarHBondContact N-O 2.61Å; S85-H97 PolarHBondContact OG-N 2.84Å; S85-H97 PolarHBondContact OG-ND1 2.86Å
86	T	87.8	Confident	83.1	Confident	127 Å²	127	54.9 Å²	54.9	78%	0.779	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-52.5	154.4	156.2	44.3	0	0	0	0	110.6	M96	T86-M96 WeakPolarHBondContact O-CB 3.41Å
87	C	88.4	Confident	84.5	Confident	25 Å²	25	57.3 Å²	57.3	17%	0.169	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-73.3	136	171.6	-162.1	0	0	0	0	109.1	R89 M96 C118 N119	C87-R89 WeakPolarHBondContact CB-O 3Å; C87-R89 PolarHBondContact O-N 3.29Å; C87-R89 PolarHBondContact SG-O 2.95Å; C87-M96 HydrophobicContact CB-CE 3.81Å; C87-C118 HydrophobicContact CB-CB 3.94Å; C87-C118 WeakPolarHBondContact CB-SG 3.5Å; C87-C118 WeakPolarHBondContact SG-CB 3.36Å; C87-C118 CovalentContact SG-SG 2.03Å; C87-C118 PolarHBondContact SG-SG 2.92Å; C87-N119 WeakPolarHBondContact CB-ND2 3.08Å
88	S	86.1	Confident	85.5	Confident	43 Å²	43	52.5 Å²	52.5	30%	0.301	30%	0.296	S	S	.	.	S	Bend	trans	-60.4	-20.3	175.3	41.3	0	0	0	0	113.9	I95 D204	S88-I95 WeakPolarHBondContact CB-O 3.46Å; S88-I95 PolarHBondContact N-O 3.34Å; S88-I95 PolarHBondContact OG-N 2.89Å; S88-I95 PolarHBondContact OG-O 3.39Å; S88-D204 WeakPolarHBondContact CB-O 3.44Å; S88-D204 PolarHBondContact OG-O 2.96Å
89	R	79.9	Confident	85.6	Confident	18 Å²	18	54.4 Å²	54.4	7%	0.068	31%	0.309	C	S	.	.			trans	-136	147.5	176.4	-59.2	176	70.7	-154.7	9.3	110.4	C87 C91 D92 G93 N119 F129	C87-R89 WeakPolarHBondContact CB-O 3Å; C87-R89 PolarHBondContact O-N 3.29Å; C87-R89 PolarHBondContact SG-O 2.95Å; R89-C91 WeakPolarHBondContact CB-O 3.15Å; R89-D92 IonicContact CZ-OD2 2.69Å; R89-D92 VanDerWaalsContact CZ-OD2 3.27Å; R89-D92 PolarHBondContact NH1-O 2.97Å; R89-D92 IonicContact NH1-OD2 3.56Å; R89-D92 PolarHBondContact NH1-OD2 3.11Å; R89-D92 IonicContact NH2-OD2 3.53Å; R89-D92 PolarHBondContact NH2-OD2 3.3Å; R89-G93 WeakPolarHBondContact CD-O 3.32Å; R89-G93 PolarHBondContact NH1-O 2.78Å; R89-N119 PolarHBondContact O-ND2 2.68Å; R89-F129 HydrophobicContact CG-CD1 4.12Å; R89-F129 HydrophobicContact CG-CD2 4.08Å; R89-F129 HydrophobicContact CG-CE1 4.03Å; R89-F129 HydrophobicContact CG-CE2 4Å; R89-F129 HydrophobicContact CG-CG 4.14Å; R89-F129 HydrophobicContact CG-CZ 3.97Å
90	T	83.5	Confident	85.7	Confident	125 Å²	125	54.2 Å²	54.2	77%	0.767	30%	0.299	S	S	*	.	S	Bend	trans	-80.7	-19.6	174.9	44.7	0	0	0	0	113.1	N119	T90-N119 WeakPolarHBondContact O-CB 3.04Å
91	C	81.1	Confident	85.7	Confident	22 Å²	22	59.6 Å²	59.6	15%	0.149	30%	0.304	C	S	.	.	S	Bend	trans	-156.6	176.7	-176.9	53.4	0	0	0	0	111.6	R89 G93 N119 Q121 C123	R89-C91 WeakPolarHBondContact CB-O 3.15Å; C91-G93 PolarHBondContact O-N 2.72Å; C91-G93 VanDerWaalsContact O-N 3.07Å; C91-N119 CarbonylContact C-O 3.47Å; C91-N119 VanDerWaalsContact C-O 3.25Å; C91-N119 WeakPolarHBondContact CA-O 3.41Å; C91-Q121 CarbonylContact C-O 3.58Å; C91-Q121 WeakPolarHBondContact CB-O 3.44Å; C91-C123 VanDerWaalsContact C-SG 3.54Å; C91-C123 HydrophobicContact CB-CB 3.9Å; C91-C123 WeakPolarHBondContact CB-SG 3.24Å; C91-C123 WeakPolarHBondContact SG-CA 3.49Å; C91-C123 WeakPolarHBondContact SG-CB 3.09Å; C91-C123 CovalentContact SG-SG 2.03Å; C91-C123 PolarHBondContact SG-SG 3.29Å
92	D	76.6	Confident	85.5	Confident	47 Å²	47	58 Å²	58	25%	0.251	30%	0.303	S	S	.	.	S	Bend	trans	54.8	16.9	-177.5	178.8	62	0	0	0	115.7	R89 N119 Q121 R207	R89-D92 IonicContact CZ-OD2 2.69Å; R89-D92 VanDerWaalsContact CZ-OD2 3.27Å; R89-D92 PolarHBondContact NH1-O 2.97Å; R89-D92 IonicContact NH1-OD2 3.56Å; R89-D92 PolarHBondContact NH1-OD2 3.11Å; R89-D92 IonicContact NH2-OD2 3.53Å; R89-D92 PolarHBondContact NH2-OD2 3.3Å; D92-N119 PolarHBondContact N-O 2.95Å; D92-Q121 PolarHBondContact N-O 2.85Å; D92-R207 VanDerWaalsContact CG-NH2 3.32Å; D92-R207 PolarHBondContact O-NH2 2.87Å; D92-R207 IonicContact OD1-CZ 3.79Å; D92-R207 IonicContact OD1-NE 2.76Å; D92-R207 IonicContact OD1-NH2 2.82Å; D92-R207 PolarHBondContact OD1-NH2 3.18Å; D92-R207 IonicContact OD2-CZ 2.61Å; D92-R207 IonicContact OD2-NE 2.96Å; D92-R207 PolarHBondContact OD2-NE 3.02Å; D92-R207 IonicContact OD2-NH2 2.7Å; D92-R207 PolarHBondContact OD2-NH2 3.17Å
93	G	79.6	Confident	84.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.317	C	S	.	.			trans	82.7	106.9	-179.7	0	0	0	0	0	112.1	R89 C91 C118 N119 M120 M215	R89-G93 WeakPolarHBondContact CD-O 3.32Å; R89-G93 PolarHBondContact NH1-O 2.78Å; C91-G93 PolarHBondContact O-N 2.72Å; C91-G93 VanDerWaalsContact O-N 3.07Å; G93-C118 WeakPolarHBondContact CA-O 3.39Å; G93-N119 PolarHBondContact N-O 3.27Å; G93-M120 WeakPolarHBondContact CA-SD 3.04Å; G93-M215 VanDerWaalsContact O-CE 3.25Å; G93-M215 WeakPolarHBondContact O-CE 3.44Å
94	G	84.4	Confident	83.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-175.2	162	0	0	0	0	0	110.7	I117 C118	G94-I117 CarbonylContact O-C 3.56Å; G94-I117 WeakPolarHBondContact O-CA 3.06Å; G94-I117 WeakPolarHBondContact O-CG2 3.32Å; G94-C118 PolarHBondContact N-O 3.41Å; G94-C118 PolarHBondContact O-N 3.31Å; G94-C118 PolarHBondContact O-SG 2.95Å
95	I	88.3	Confident	82.9	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	156	166.4	72.1	178.1	0	0	0	111.9	S88 Y115 R116 D204 M215 I217	S88-I95 WeakPolarHBondContact CB-O 3.46Å; S88-I95 PolarHBondContact N-O 3.34Å; S88-I95 PolarHBondContact OG-N 2.89Å; S88-I95 PolarHBondContact OG-O 3.39Å; I95-Y115 HydrophobicContact CD1-CD1 3.48Å; I95-Y115 VanDerWaalsContact CD1-CD1 3.48Å; I95-Y115 HydrophobicContact CD1-CE1 3.97Å; I95-Y115 HydrophobicContact CD1-CG 4.29Å; I95-Y115 HydrophobicContact CG1-CD1 4.36Å; I95-R116 CarbonylContact C-O 3.43Å; I95-R116 VanDerWaalsContact CA-O 3.27Å; I95-R116 WeakPolarHBondContact CA-O 3.35Å; I95-D204 HydrophobicContact CD1-CB 3.72Å; I95-D204 HydrophobicContact CG1-CB 4.49Å; I95-M215 HydrophobicContact CG2-SD 3.57Å; I95-M215 VanDerWaalsContact CG2-SD 3.57Å; I95-I217 HydrophobicContact CD1-CB 4.48Å; I95-I217 HydrophobicContact CD1-CD1 4.03Å; I95-I217 HydrophobicContact CD1-CG1 3.89Å; I95-I217 HydrophobicContact CD1-CG2 4.08Å; I95-I217 HydrophobicContact CG2-CD1 4.33Å
96	M	87.6	Confident	81.8	Confident	24 Å²	24	59.3 Å²	59.3	12%	0.118	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.7	161.8	56.2	174.9	60.3	0	0	109.7	W84 S85 T86 C87 Y115 R116 C118	W84-M96 HydrophobicContact CB-CG 4.48Å; W84-M96 HydrophobicContact CB-SD 3.74Å; W84-M96 HydrophobicContact CD2-SD 4.43Å; W84-M96 HydrophobicContact CE3-CG 4Å; W84-M96 HydrophobicContact CG-SD 4.15Å; W84-M96 WeakPolarHBondContact CZ3-O 3.41Å; S85-M96 WeakPolarHBondContact O-CB 3.23Å; S85-M96 WeakPolarHBondContact OG-CA 3.46Å; S85-M96 WeakPolarHBondContact OG-CB 3.42Å; T86-M96 WeakPolarHBondContact O-CB 3.41Å; C87-M96 HydrophobicContact CB-CE 3.81Å; M96-Y115 WeakPolarHBondContact O-CA 3.23Å; M96-R116 HydrophobicContact CG-CG 3.58Å; M96-R116 PolarHBondContact N-O 3.5Å; M96-R116 PolarHBondContact O-N 2.91Å; M96-R116 HydrophobicContact SD-CG 4.3Å; M96-R116 VanDerWaalsContact SD-CZ 3.52Å; M96-R116 PolarHBondContact SD-NE 2.91Å; M96-R116 PolarHBondContact SD-NH2 3.12Å; M96-C118 HydrophobicContact CE-CB 3.77Å; M96-C118 HydrophobicContact CG-CB 4.25Å; M96-C118 PolarHBondContact N-SG 3.09Å; M96-C118 VanDerWaalsContact N-SG 3.42Å; M96-C118 HydrophobicContact SD-CB 4.46Å
97	H	88	Confident	81.1	Confident	65 Å²	65	56.8 Å²	56.8	30%	0.301	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.8	-172	65.9	-95.7	0	0	0	112.9	W84 S85 T113 R114 Y115	W84-H97 WeakPolarHBondContact CA-O 3.31Å; S85-H97 PolarHBondContact N-O 2.61Å; S85-H97 PolarHBondContact OG-N 2.84Å; S85-H97 PolarHBondContact OG-ND1 2.86Å; H97-T113 HydrophobicContact CB-CG2 4.15Å; H97-R114 CarbonylContact C-O 3.58Å; H97-R114 WeakPolarHBondContact CA-O 3.44Å; H97-Y115 HydrophobicContact CB-CD1 3.67Å; H97-Y115 HydrophobicContact CB-CE1 3.66Å
98	Q	90.7	Very high	80.6	Confident	13 Å²	13	56.7 Å²	56.7	6%	0.061	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.4	167.8	-87.9	-179.6	-26.6	0	0	109.3	W81 S82 D83 W84 T113 R114	W81-Q98 HydrophobicContact CB-CB 4.45Å; W81-Q98 HydrophobicContact CE3-CB 3.9Å; W81-Q98 WeakPolarHBondContact CZ3-O 2.85Å; S82-Q98 VanDerWaalsContact O-CG 3.27Å; S82-Q98 WeakPolarHBondContact O-CG 3.37Å; S82-Q98 PolarHBondContact O-NE2 2.88Å; D83-Q98 WeakPolarHBondContact O-CG 3.24Å; W84-Q98 HydrophobicContact CB-CG 4.23Å; W84-Q98 HydrophobicContact CD2-CB 4.44Å; W84-Q98 VanDerWaalsContact CD2-CD 3.47Å; W84-Q98 HydrophobicContact CD2-CG 3.48Å; W84-Q98 VanDerWaalsContact CD2-CG 3.48Å; W84-Q98 VanDerWaalsContact CE2-OE1 3.27Å; W84-Q98 HydrophobicContact CE3-CB 4.18Å; W84-Q98 HydrophobicContact CE3-CG 3.64Å; W84-Q98 HydrophobicContact CG-CG 3.75Å; W84-Q98 HydrophobicContact CH2-CG 4.5Å; W84-Q98 HydrophobicContact CZ2-CG 4.38Å; W84-Q98 HydrophobicContact CZ3-CB 4.25Å; W84-Q98 HydrophobicContact CZ3-CG 4.14Å; Q98-T113 CarbonylContact O-C 3.52Å; Q98-T113 VanDerWaalsContact O-CA 3.26Å; Q98-T113 WeakPolarHBondContact O-CA 3.46Å; Q98-T113 WeakPolarHBondContact O-CG2 3.37Å; Q98-R114 HydrophobicContact CB-CG 3.93Å; Q98-R114 PolarHBondContact N-O 3.12Å; Q98-R114 PolarHBondContact O-N 3.02Å
99	M	85.4	Confident	79.9	Confident	103 Å²	103	66.1 Å²	66.1	51%	0.507	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154.1	177.8	-60.1	-168.3	-172	0	0	111.4	W81 S82 S112 T113	W81-M99 CarbonylContact C-O 3.59Å; W81-M99 WeakPolarHBondContact CA-O 3.48Å; S82-M99 PolarHBondContact N-O 2.91Å; S82-M99 PolarHBondContact OG-N 3.25Å; M99-S112 CarbonylContact C-O 3.55Å; M99-S112 WeakPolarHBondContact CA-O 3.27Å; M99-T113 HydrophobicContact CG-CG2 4.37Å
100	R	86.6	Confident	79.5	Confident	50 Å²	50	68 Å²	68	19%	0.189	40%	0.396	C	S	.	.			trans	-140.9	140.7	168.2	58.2	-179.6	-178.7	171.1	-1.2	109.9	W78 S79 W81 E111 S112	W78-R100 VanDerWaalsContact CD1-NH1 3.34Å; W78-R100 HydrophobicContact CD2-CG 4.01Å; W78-R100 HydrophobicContact CE3-CB 4.29Å; W78-R100 HydrophobicContact CE3-CG 3.6Å; W78-R100 HydrophobicContact CG-CG 4.43Å; W78-R100 HydrophobicContact CZ3-CG 4.13Å; W78-R100 WeakPolarHBondContact CZ3-O 3.41Å; S79-R100 WeakPolarHBondContact OG-CA 3.49Å; W81-R100 HydrophobicContact CD2-CB 4.25Å; W81-R100 HydrophobicContact CD2-CG 4.18Å; W81-R100 HydrophobicContact CE3-CB 3.89Å; W81-R100 HydrophobicContact CE3-CG 3.74Å; W81-R100 HydrophobicContact CH2-CG 3.87Å; W81-R100 VanDerWaalsContact CH2-NE 3.31Å; W81-R100 HydrophobicContact CZ2-CG 4.29Å; W81-R100 VanDerWaalsContact CZ2-NE 3.31Å; W81-R100 HydrophobicContact CZ3-CB 4.22Å; W81-R100 HydrophobicContact CZ3-CG 3.57Å; R100-E111 PolarHBondContact NE-O 3.2Å; R100-E111 PolarHBondContact NH2-O 3.22Å; R100-S112 WeakPolarHBondContact CG-O 3.34Å; R100-S112 PolarHBondContact N-O 3.14Å
101	R	82.6	Confident	79.1	Confident	216 Å²	216	69 Å²	69	82%	0.815	39%	0.391	S	S	*	.			trans	-96.2	139.8	-178.6	-63.1	179.7	-179.5	170.9	-0.3	109.4	S79	S79-R101 PolarHBondContact N-O 3Å; S79-R101 PolarHBondContact OG-N 3.01Å; S79-R101 PolarHBondContact OG-O 2.89Å
102	C	84	Confident	79.1	Confident	37 Å²	37	70.8 Å²	70.8	25%	0.25	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-88.6	127.1	174	179.6	0	0	0	0	109.3	W78 S104 C108	W78-C102 HydrophobicContact CE3-CB 3.86Å; W78-C102 HydrophobicContact CH2-CB 4.17Å; W78-C102 HydrophobicContact CZ3-CB 3.65Å; C102-S104 PolarHBondContact O-N 2.67Å; C102-S104 VanDerWaalsContact O-N 3.17Å; C102-S104 PolarHBondContact SG-O 3.36Å; C102-C108 WeakPolarHBondContact CA-SG 3.47Å; C102-C108 HydrophobicContact CB-CB 3.82Å; C102-C108 WeakPolarHBondContact CB-SG 3.5Å; C102-C108 WeakPolarHBondContact SG-CB 3.34Å; C102-C108 CovalentContact SG-SG 2.02Å; C102-C108 PolarHBondContact SG-SG 3.38Å
103	G	75.4	Confident	79.5	Confident	63 Å²	63	69.4 Å²	69.4	65%	0.649	40%	0.398	S	S	*	.	S	Bend	trans	-68.9	-9.3	-178	0	0	0	0	0	114.9	Q77	Q77-G103 PolarHBondContact O-N 2.87Å
104	S	70.1	Confident	79.7	Confident	42 Å²	42	74.2 Å²	74.2	29%	0.294	42%	0.416	S	S	.	.	S	Bend	trans	-153.1	107.8	178.3	-51.8	0	0	0	0	109.8	C102 G106 S107	C102-S104 PolarHBondContact O-N 2.67Å; C102-S104 VanDerWaalsContact O-N 3.17Å; C102-S104 PolarHBondContact SG-O 3.36Å; S104-G106 PolarHBondContact O-N 3.17Å; S104-S107 PolarHBondContact O-N 2.93Å; S104-S107 VanDerWaalsContact O-N 3.14Å
105	P	64.5	Low	79.9	Confident	135 Å²	135	76.8 Å²	76.8	88%	0.877	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	128.8	-174.5	-30.1	36.1	0	0	0	113.3
106	G	66.3	Low	79.7	Confident	86 Å²	86	81.9 Å²	81.9	89%	0.887	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-10.7	179.2	0	0	0	0	0	116.6	S104	S104-G106 PolarHBondContact O-N 3.17Å
107	S	73.4	Confident	79.5	Confident	73 Å²	73	82.1 Å²	82.1	51%	0.51	45%	0.446	S	S	.	.			trans	-97.8	-12.5	-175.9	-169	0	0	0	0	115.4	G76 S104	G76-S107 WeakPolarHBondContact CA-OG 3.47Å; S104-S107 PolarHBondContact O-N 2.93Å; S104-S107 VanDerWaalsContact O-N 3.14Å
108	C	77.6	Confident	79.4	Confident	24 Å²	24	79.7 Å²	79.7	16%	0.162	44%	0.437	C	S	.	.			trans	-92.8	138.3	-179.7	-49.3	0	0	0	0	112.3	G76 Q77 W78 C102	G76-C108 PolarHBondContact O-SG 2.77Å; Q77-C108 VanDerWaalsContact C-SG 3.57Å; Q77-C108 PolarHBondContact O-SG 2.82Å; W78-C108 HydrophobicContact CD2-CB 3.66Å; W78-C108 HydrophobicContact CE3-CB 4.22Å; W78-C108 HydrophobicContact CG-CB 4.06Å; W78-C108 HydrophobicContact CH2-CB 4.11Å; W78-C108 HydrophobicContact CZ2-CB 3.52Å; W78-C108 HydrophobicContact CZ3-CB 4.44Å; C102-C108 WeakPolarHBondContact CA-SG 3.47Å; C102-C108 HydrophobicContact CB-CB 3.82Å; C102-C108 WeakPolarHBondContact CB-SG 3.5Å; C102-C108 WeakPolarHBondContact SG-CB 3.34Å; C102-C108 CovalentContact SG-SG 2.02Å; C102-C108 PolarHBondContact SG-SG 3.38Å
109	R	72.1	Confident	79.1	Confident	241 Å²	241	82.6 Å²	82.6	91%	0.909	45%	0.453	S	S	*	.			trans	-104.1	140.7	-177.6	-153	175.9	-170.8	-177.3	3	112.3	W78	W78-R109 PolarHBondContact NE1-O 3.26Å
110	G	70.8	Confident	78.7	Confident	57 Å²	57	80.9 Å²	80.9	59%	0.588	44%	0.444	S	S	*	.	S	Bend	trans	95.1	-178.7	-174.3	0	0	0	0	0	113.1	W78	W78-G110 VanDerWaalsContact CZ2-O 3.25Å; W78-G110 WeakPolarHBondContact CZ2-O 3.22Å
111	E	75.7	Confident	78.4	Confident	145 Å²	145	86 Å²	86	68%	0.678	47%	0.47	S	S	*	.			trans	-81.2	145.8	-172.9	-64.7	170.2	173	0	0	112.8	R100 T113	R100-E111 PolarHBondContact NE-O 3.2Å; R100-E111 PolarHBondContact NH2-O 3.22Å; E111-T113 VanDerWaalsContact C-N 3.34Å
112	S	81.5	Confident	78	Confident	60 Å²	60	81 Å²	81	42%	0.42	47%	0.466	S	S	.	.	S	Bend	trans	-78.9	-17.5	175.6	57.6	0	0	0	0	113.8	M99 R100	M99-S112 CarbonylContact C-O 3.55Å; M99-S112 WeakPolarHBondContact CA-O 3.27Å; R100-S112 WeakPolarHBondContact CG-O 3.34Å; R100-S112 PolarHBondContact N-O 3.14Å
113	T	84.4	Confident	77.5	Confident	19 Å²	19	80.7 Å²	80.7	12%	0.117	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.2	-176.6	-49.6	0	0	0	0	108.2	H97 Q98 M99 E111 Y115	H97-T113 HydrophobicContact CB-CG2 4.15Å; Q98-T113 CarbonylContact O-C 3.52Å; Q98-T113 VanDerWaalsContact O-CA 3.26Å; Q98-T113 WeakPolarHBondContact O-CA 3.46Å; Q98-T113 WeakPolarHBondContact O-CG2 3.37Å; M99-T113 HydrophobicContact CG-CG2 4.37Å; E111-T113 VanDerWaalsContact C-N 3.34Å; T113-Y115 HydrophobicContact CG2-CE1 4.22Å; T113-Y115 HydrophobicContact CG2-CE2 3.96Å
114	R	85	Confident	77.5	Confident	101 Å²	101	84.2 Å²	84.2	38%	0.381	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	154.1	171.3	69.5	175	-177.9	177.1	-1.8	111.1	W81 W84 H97 Q98	W81-R114 HydrophobicContact CD2-CG 4.27Å; W81-R114 HydrophobicContact CE3-CG 3.95Å; W81-R114 HydrophobicContact CH2-CB 3.71Å; W81-R114 HydrophobicContact CH2-CG 3.72Å; W81-R114 HydrophobicContact CZ2-CB 4.26Å; W81-R114 HydrophobicContact CZ2-CG 4.05Å; W81-R114 HydrophobicContact CZ3-CB 3.99Å; W81-R114 HydrophobicContact CZ3-CG 3.67Å; W84-R114 HydrophobicContact CH2-CG 3.92Å; W84-R114 HydrophobicContact CZ3-CG 4.33Å; H97-R114 CarbonylContact C-O 3.58Å; H97-R114 WeakPolarHBondContact CA-O 3.44Å; Q98-R114 HydrophobicContact CB-CG 3.93Å; Q98-R114 PolarHBondContact N-O 3.12Å; Q98-R114 PolarHBondContact O-N 3.02Å
115	Y	87.8	Confident	77.3	Confident	53 Å²	53	88.1 Å²	88.1	21%	0.208	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.4	-173.1	-59.3	-85.3	0	0	0	111.4	I95 M96 H97 T113 I217 Q218	I95-Y115 HydrophobicContact CD1-CD1 3.48Å; I95-Y115 VanDerWaalsContact CD1-CD1 3.48Å; I95-Y115 HydrophobicContact CD1-CE1 3.97Å; I95-Y115 HydrophobicContact CD1-CG 4.29Å; I95-Y115 HydrophobicContact CG1-CD1 4.36Å; M96-Y115 WeakPolarHBondContact O-CA 3.23Å; H97-Y115 HydrophobicContact CB-CD1 3.67Å; H97-Y115 HydrophobicContact CB-CE1 3.66Å; T113-Y115 HydrophobicContact CG2-CE1 4.22Å; T113-Y115 HydrophobicContact CG2-CE2 3.96Å; Y115-I217 HydrophobicContact CD1-CG2 3.83Å; Y115-I217 HydrophobicContact CD2-CG2 3.64Å; Y115-I217 HydrophobicContact CE1-CG2 3.69Å; Y115-I217 HydrophobicContact CE2-CG2 3.52Å; Y115-I217 HydrophobicContact CG-CD1 4.32Å; Y115-I217 HydrophobicContact CG-CG2 3.8Å; Y115-Q218 WeakPolarHBondContact OH-CG 3.33Å; Y115-Q218 PolarHBondContact OH-NE2 2.88Å
116	R	84.4	Confident	77.1	Confident	113 Å²	113	91.4 Å²	91.4	43%	0.426	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.5	165.1	70.5	179.6	176.5	172	0.4	110.3	W84 I95 M96	W84-R116 VanDerWaalsContact CD1-CZ 3.42Å; W84-R116 VanDerWaalsContact CD1-NH2 3.28Å; W84-R116 HydrophobicContact CD2-CG 4.18Å; W84-R116 VanDerWaalsContact CD2-NE 3.28Å; W84-R116 HydrophobicContact CE3-CG 3.78Å; W84-R116 HydrophobicContact CH2-CB 3.87Å; W84-R116 HydrophobicContact CH2-CG 3.78Å; W84-R116 HydrophobicContact CZ2-CB 4.47Å; W84-R116 HydrophobicContact CZ2-CG 4.16Å; W84-R116 HydrophobicContact CZ3-CB 3.99Å; W84-R116 HydrophobicContact CZ3-CG 3.58Å; I95-R116 CarbonylContact C-O 3.43Å; I95-R116 VanDerWaalsContact CA-O 3.27Å; I95-R116 WeakPolarHBondContact CA-O 3.35Å; M96-R116 HydrophobicContact CG-CG 3.58Å; M96-R116 PolarHBondContact N-O 3.5Å; M96-R116 PolarHBondContact O-N 2.91Å; M96-R116 HydrophobicContact SD-CG 4.3Å; M96-R116 VanDerWaalsContact SD-CZ 3.52Å; M96-R116 PolarHBondContact SD-NE 2.91Å; M96-R116 PolarHBondContact SD-NH2 3.12Å
117	I	83.5	Confident	76.9	Confident	28 Å²	28	93.3 Å²	93.3	14%	0.144	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	145.8	173.9	-49.5	-175.8	0	0	0	109.2	G94 M120 M215 V224 I230	G94-I117 CarbonylContact O-C 3.56Å; G94-I117 WeakPolarHBondContact O-CA 3.06Å; G94-I117 WeakPolarHBondContact O-CG2 3.32Å; I117-M120 HydrophobicContact CG2-CG 3.84Å; I117-M120 HydrophobicContact CG2-SD 3.45Å; I117-M120 WeakPolarHBondContact CG2-SD 3.45Å; I117-M215 HydrophobicContact CD1-SD 4.04Å; I117-M215 HydrophobicContact CG1-SD 4.03Å; I117-M215 HydrophobicContact CG2-CE 3.98Å; I117-M215 HydrophobicContact CG2-SD 4.25Å; I117-V224 HydrophobicContact CD1-CB 4.26Å; I117-V224 HydrophobicContact CD1-CG1 3.43Å; I117-V224 VanDerWaalsContact CD1-CG1 3.43Å; I117-V224 HydrophobicContact CD1-CG2 3.73Å; I117-I230 HydrophobicContact CD1-CG1 4Å; I117-I230 HydrophobicContact CG1-CD1 4.01Å; I117-I230 HydrophobicContact CG1-CG1 3.78Å
118	C	86.5	Confident	76.8	Confident	15 Å²	15	92.3 Å²	92.3	10%	0.101	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	161.1	-179	44.5	0	0	0	0	111	C87 G93 G94 M96 M120	C87-C118 HydrophobicContact CB-CB 3.94Å; C87-C118 WeakPolarHBondContact CB-SG 3.5Å; C87-C118 WeakPolarHBondContact SG-CB 3.36Å; C87-C118 CovalentContact SG-SG 2.03Å; C87-C118 PolarHBondContact SG-SG 2.92Å; G93-C118 WeakPolarHBondContact CA-O 3.39Å; G94-C118 PolarHBondContact N-O 3.41Å; G94-C118 PolarHBondContact O-N 3.31Å; G94-C118 PolarHBondContact O-SG 2.95Å; M96-C118 HydrophobicContact CE-CB 3.77Å; M96-C118 HydrophobicContact CG-CB 4.25Å; M96-C118 PolarHBondContact N-SG 3.09Å; M96-C118 VanDerWaalsContact N-SG 3.42Å; M96-C118 HydrophobicContact SD-CB 4.46Å; C118-M120 PolarHBondContact O-N 2.03Å
119	N	84.5	Confident	77.1	Confident	74 Å²	74	93 Å²	93	40%	0.396	47%	0.467	S	S	.	.			trans	55.2	46	172.3	-60.3	-6.3	0	0	0	114.8	C87 R89 T90 C91 D92 G93 Q121	C87-N119 WeakPolarHBondContact CB-ND2 3.08Å; R89-N119 PolarHBondContact O-ND2 2.68Å; T90-N119 WeakPolarHBondContact O-CB 3.04Å; C91-N119 CarbonylContact C-O 3.47Å; C91-N119 VanDerWaalsContact C-O 3.25Å; C91-N119 WeakPolarHBondContact CA-O 3.41Å; D92-N119 PolarHBondContact N-O 2.95Å; G93-N119 PolarHBondContact N-O 3.27Å; N119-Q121 PolarHBondContact O-N 2.04Å; N119-Q121 VanDerWaalsContact O-N 3.14Å
120	M	77.1	Confident	77.8	Confident	67 Å²	67	81.5 Å²	81.5	33%	0.33	42%	0.424	S	S	.	.			trans	-72.2	6.8	-178.9	-75.1	-64.3	-48.3	0	0	115.6	G93 I117 C118 L213 L228	G93-M120 WeakPolarHBondContact CA-SD 3.04Å; I117-M120 HydrophobicContact CG2-CG 3.84Å; I117-M120 HydrophobicContact CG2-SD 3.45Å; I117-M120 WeakPolarHBondContact CG2-SD 3.45Å; C118-M120 PolarHBondContact O-N 2.03Å; M120-L213 HydrophobicContact CE-CD2 4.16Å; M120-L228 HydrophobicContact CE-CD2 3.79Å; M120-L228 HydrophobicContact CG-CD1 4.23Å; M120-L228 HydrophobicContact SD-CD2 4.37Å
121	Q	79.4	Confident	78.6	Confident	157 Å²	157	80.8 Å²	80.8	73%	0.734	41%	0.41	S	S	*	.	S	Bend	trans	-78.2	141.4	175.8	-63.7	-174.7	2.9	0	0	109.6	C91 D92 N119	C91-Q121 CarbonylContact C-O 3.58Å; C91-Q121 WeakPolarHBondContact CB-O 3.44Å; D92-Q121 PolarHBondContact N-O 2.85Å; N119-Q121 PolarHBondContact O-N 2.04Å; N119-Q121 VanDerWaalsContact O-N 3.14Å
122	P	73.7	Confident	79.2	Confident	112 Å²	112	76.2 Å²	76.2	73%	0.727	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-59	145.3	179.7	26.1	-34.9	0	0	0	111.3
123	C	74.9	Confident	79.6	Confident	30 Å²	30	74 Å²	74	20%	0.203	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-69.1	146.2	172.3	-64	0	0	0	0	110.4	C91 E125	C91-C123 VanDerWaalsContact C-SG 3.54Å; C91-C123 HydrophobicContact CB-CB 3.9Å; C91-C123 WeakPolarHBondContact CB-SG 3.24Å; C91-C123 WeakPolarHBondContact SG-CA 3.49Å; C91-C123 WeakPolarHBondContact SG-CB 3.09Å; C91-C123 CovalentContact SG-SG 2.03Å; C91-C123 PolarHBondContact SG-SG 3.29Å; C123-E125 WeakPolarHBondContact CB-O 3.27Å; C123-E125 PolarHBondContact O-N 3.37Å
124	P	74.1	Confident	79.9	Confident	136 Å²	136	73 Å²	73	88%	0.883	37%	0.371	S	S	*	.	S	Bend	trans	-66.3	-27.1	177.9	27.4	-34.5	0	0	0	112.5
125	E	65.8	Low	80.1	Confident	124 Å²	124	70.4 Å²	70.4	58%	0.579	37%	0.368	S	S	*	.	S	Bend	trans	-113.8	143.8	167.3	-66.5	174.3	-166.5	0	0	109.3	C123 Q127	C123-E125 WeakPolarHBondContact CB-O 3.27Å; C123-E125 PolarHBondContact O-N 3.37Å; E125-Q127 HydrophobicContact CB-CG 4.13Å; E125-Q127 PolarHBondContact O-N 2.75Å; E125-Q127 PolarHBondContact OE2-NE2 3.24Å
126	Q	60.4	Low	80.1	Confident	204 Å²	204	71.2 Å²	71.2	95%	0.953	39%	0.386	S	S	*	.			trans	-81.2	50.6	-176.9	-61.1	-172.9	21	0	0	112.9	D128	Q126-D128 PolarHBondContact O-N 3.06Å
127	Q	61.4	Low	80.3	Confident	126 Å²	126	68.6 Å²	68.6	59%	0.589	38%	0.376	S	S	*	.			trans	-75.5	113.3	178.2	-59.8	-169.5	17.2	0	0	110.9	E125 F129	E125-Q127 HydrophobicContact CB-CG 4.13Å; E125-Q127 PolarHBondContact O-N 2.75Å; E125-Q127 PolarHBondContact OE2-NE2 3.24Å; Q127-F129 PolarHBondContact O-N 3.19Å
128	D	73.3	Confident	80.4	Confident	53 Å²	53	69.4 Å²	69.4	28%	0.283	38%	0.381	S	S	.	.			trans	-69.8	123.9	169.6	169.7	38.3	0	0	0	110.6	Q126 R130 S131 S132 Y153	Q126-D128 PolarHBondContact O-N 3.06Å; D128-R130 PolarHBondContact O-N 2.86Å; D128-R130 PolarHBondContact OD1-N 2.86Å; D128-R130 WeakPolarHBondContact OD2-CB 3Å; D128-R130 PolarHBondContact OD2-N 3.38Å; D128-S131 VanDerWaalsContact O-CB 3.27Å; D128-S131 WeakPolarHBondContact O-CB 3.24Å; D128-S131 PolarHBondContact O-N 3.32Å; D128-S131 VanDerWaalsContact O-N 3.11Å; D128-S131 PolarHBondContact OD2-N 3.48Å; D128-S132 PolarHBondContact O-N 2.9Å; D128-S132 VanDerWaalsContact O-N 3.1Å; D128-Y153 PolarHBondContact OD2-OH 2.96Å
129	F	83.1	Confident	80.2	Confident	37 Å²	37	75.5 Å²	75.5	16%	0.162	41%	0.413	C	S	.	.	H	α-helix	trans	-69.8	-18.5	-179.1	-169.4	-112.6	0	0	0	113.2	R89 Q127 S132 Q133 Q203 T206	R89-F129 HydrophobicContact CG-CD1 4.12Å; R89-F129 HydrophobicContact CG-CD2 4.08Å; R89-F129 HydrophobicContact CG-CE1 4.03Å; R89-F129 HydrophobicContact CG-CE2 4Å; R89-F129 HydrophobicContact CG-CG 4.14Å; R89-F129 HydrophobicContact CG-CZ 3.97Å; Q127-F129 PolarHBondContact O-N 3.19Å; F129-S132 WeakPolarHBondContact CA-OG 3.3Å; F129-S132 PolarHBondContact O-OG 2.99Å; F129-S132 VanDerWaalsContact O-OG 3.05Å; F129-Q133 WeakPolarHBondContact O-CG 3.13Å; F129-Q133 PolarHBondContact O-NE2 3.34Å; F129-Q203 HydrophobicContact CE1-CB 4.07Å; F129-Q203 HydrophobicContact CZ-CB 4.45Å; F129-T206 HydrophobicContact CD1-CG2 4.49Å; F129-T206 WeakPolarHBondContact CD1-OG1 3.15Å
130	R	87.1	Confident	80.2	Confident	0 Å²	0	74 Å²	74	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-76.5	-40.1	169.1	-158.9	-175.4	-163.2	112	-3.7	110.7	D128 S132 Q133 C134 P151 P158 A160 L161 T206 R207	D128-R130 PolarHBondContact O-N 2.86Å; D128-R130 PolarHBondContact OD1-N 2.86Å; D128-R130 WeakPolarHBondContact OD2-CB 3Å; D128-R130 PolarHBondContact OD2-N 3.38Å; R130-S132 PolarHBondContact O-N 2.63Å; R130-Q133 WeakPolarHBondContact O-CB 3.44Å; R130-Q133 PolarHBondContact O-N 2.96Å; R130-Q133 VanDerWaalsContact O-N 3.17Å; R130-C134 PolarHBondContact O-N 2.85Å; R130-P151 HydrophobicContact CB-CB 4.08Å; R130-P151 HydrophobicContact CG-CB 3.98Å; R130-P158 PolarHBondContact NH1-O 2.88Å; R130-P158 PolarHBondContact NH2-O 2.95Å; R130-A160 PolarHBondContact NH2-O 3.23Å; R130-L161 HydrophobicContact CG-CD1 4.39Å; R130-T206 HydrophobicContact CB-CG2 3.96Å; R130-T206 HydrophobicContact CG-CG2 4.21Å; R130-R207 PolarHBondContact NH1-O 3.46Å
131	S	87.2	Confident	80.4	Confident	42 Å²	42	73.8 Å²	73.8	29%	0.294	41%	0.41	S	S	.	.	H	α-helix	trans	-56.9	-45.8	172.4	-161.7	0	0	0	0	112.5	D128 Q133 C134 S135	D128-S131 VanDerWaalsContact O-CB 3.27Å; D128-S131 WeakPolarHBondContact O-CB 3.24Å; D128-S131 PolarHBondContact O-N 3.32Å; D128-S131 VanDerWaalsContact O-N 3.11Å; D128-S131 PolarHBondContact OD2-N 3.48Å; S131-Q133 PolarHBondContact O-N 3.33Å; S131-C134 PolarHBondContact O-N 3.23Å; S131-C134 VanDerWaalsContact O-N 3.09Å; S131-S135 PolarHBondContact O-N 2.68Å; S131-S135 PolarHBondContact O-OG 2.86Å
132	S	87.7	Confident	80.4	Confident	49 Å²	49	71.1 Å²	71.1	34%	0.343	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-25.8	177.7	62.9	0	0	0	0	114	D128 F129 R130 S135	D128-S132 PolarHBondContact O-N 2.9Å; D128-S132 VanDerWaalsContact O-N 3.1Å; F129-S132 WeakPolarHBondContact CA-OG 3.3Å; F129-S132 PolarHBondContact O-OG 2.99Å; F129-S132 VanDerWaalsContact O-OG 3.05Å; R130-S132 PolarHBondContact O-N 2.63Å; S132-S135 WeakPolarHBondContact CA-OG 3.48Å; S132-S135 PolarHBondContact O-OG 3.41Å
133	Q	90.5	Very high	80.6	Confident	13 Å²	13	73.1 Å²	73.1	6%	0.061	40%	0.398	C	S	.	.	H	α-helix	trans	-78.7	-34.4	173.6	-72.1	168.5	74.1	0	0	112.3	F129 R130 S131 Y137 L161 Q203 T206	F129-Q133 WeakPolarHBondContact O-CG 3.13Å; F129-Q133 PolarHBondContact O-NE2 3.34Å; R130-Q133 WeakPolarHBondContact O-CB 3.44Å; R130-Q133 PolarHBondContact O-N 2.96Å; R130-Q133 VanDerWaalsContact O-N 3.17Å; S131-Q133 PolarHBondContact O-N 3.33Å; Q133-Y137 WeakPolarHBondContact O-CD2 3.46Å; Q133-L161 HydrophobicContact CB-CD1 3.71Å; Q133-L161 HydrophobicContact CB-CD2 4.11Å; Q133-Q203 HydrophobicContact CG-CG 4.32Å; Q133-T206 PolarHBondContact NE2-OG1 3.2Å
134	C	89.8	Confident	80.7	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-67.9	-47.7	171.2	-71.3	0	0	0	0	111.1	R130 S131 A136 Y137 W149 C163	R130-C134 PolarHBondContact O-N 2.85Å; S131-C134 PolarHBondContact O-N 3.23Å; S131-C134 VanDerWaalsContact O-N 3.09Å; C134-A136 PolarHBondContact O-N 2.72Å; C134-A136 VanDerWaalsContact O-N 3.12Å; C134-Y137 PolarHBondContact O-N 3.22Å; C134-W149 HydrophobicContact CB-CB 3.91Å; C134-W149 WeakPolarHBondContact O-CB 3.5Å; C134-C163 WeakPolarHBondContact CA-SG 3.43Å; C134-C163 HydrophobicContact CB-CB 3.85Å; C134-C163 WeakPolarHBondContact CB-SG 3.29Å; C134-C163 WeakPolarHBondContact SG-CB 3.43Å; C134-C163 CovalentContact SG-SG 2.04Å; C134-C163 PolarHBondContact SG-SG 2.65Å
135	S	89.1	Confident	80.9	Confident	46 Å²	46	70.8 Å²	70.8	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-65.1	-18.8	-175.5	65	0	0	0	0	114.2	S131 S132 Y137 N138	S131-S135 PolarHBondContact O-N 2.68Å; S131-S135 PolarHBondContact O-OG 2.86Å; S132-S135 WeakPolarHBondContact CA-OG 3.48Å; S132-S135 PolarHBondContact O-OG 3.41Å; S135-Y137 PolarHBondContact O-N 3.08Å; S135-N138 VanDerWaalsContact O-CB 3.29Å; S135-N138 WeakPolarHBondContact O-CB 3.37Å; S135-N138 PolarHBondContact O-N 2.94Å; S135-N138 PolarHBondContact O-ND2 3.37Å
136	A	88.8	Confident	81.8	Confident	69 Å²	69	68.8 Å²	68.8	57%	0.57	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.1	172	0	0	0	0	0	113.7	C134	C134-A136 PolarHBondContact O-N 2.72Å; C134-A136 VanDerWaalsContact O-N 3.12Å
137	Y	88.2	Confident	83	Confident	59 Å²	59	60.4 Å²	60.4	23%	0.231	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	4.7	175.2	-65.1	-92.4	0	0	0	113.4	Q133 C134 S135 D139 V140 W149 L161 L198	Q133-Y137 WeakPolarHBondContact O-CD2 3.46Å; C134-Y137 PolarHBondContact O-N 3.22Å; S135-Y137 PolarHBondContact O-N 3.08Å; Y137-D139 VanDerWaalsContact C-N 3.3Å; Y137-D139 PolarHBondContact O-N 3.36Å; Y137-V140 PolarHBondContact O-N 2.83Å; Y137-V140 VanDerWaalsContact O-N 3.14Å; Y137-W149 VanDerWaalsContact C-CD1 3.45Å; Y137-W149 PolarHBondContact O-NE1 2.86Å; Y137-L161 HydrophobicContact CE2-CD2 3.8Å; Y137-L198 HydrophobicContact CD1-CD1 4.41Å; Y137-L198 HydrophobicContact CD2-CB 4.27Å; Y137-L198 HydrophobicContact CD2-CD1 3.68Å; Y137-L198 HydrophobicContact CE1-CB 4.47Å; Y137-L198 HydrophobicContact CE2-CB 4.13Å; Y137-L198 HydrophobicContact CE2-CD1 4.35Å; Y137-L198 HydrophobicContact CG-CD1 3.71Å
138	N	85.8	Confident	84.3	Confident	44 Å²	44	59.6 Å²	59.6	24%	0.235	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-39.4	-177.3	-74.9	-7.3	0	0	0	112.7	S135 V140 L146 Y147 W149	S135-N138 VanDerWaalsContact O-CB 3.29Å; S135-N138 WeakPolarHBondContact O-CB 3.37Å; S135-N138 PolarHBondContact O-N 2.94Å; S135-N138 PolarHBondContact O-ND2 3.37Å; N138-V140 PolarHBondContact O-N 3.23Å; N138-L146 WeakPolarHBondContact O-CD2 3.42Å; N138-Y147 WeakPolarHBondContact CA-O 3.36Å; N138-Y147 PolarHBondContact OD1-O 2.91Å; N138-W149 PolarHBondContact OD1-N 2.86Å
139	D	82.3	Confident	85	Confident	144 Å²	144	57.4 Å²	57.4	77%	0.77	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	2.8	-179.2	-51.9	-55.9	0	0	0	112.8	Y137	Y137-D139 VanDerWaalsContact C-N 3.3Å; Y137-D139 PolarHBondContact O-N 3.36Å
140	V	84.6	Confident	85.3	Confident	43 Å²	43	57.6 Å²	57.6	26%	0.261	33%	0.333	S	S	.	.	S	Bend	trans	-105.1	115.1	-178.6	-175.5	0	0	0	0	109.5	Y137 N138 Y142	Y137-V140 PolarHBondContact O-N 2.83Å; Y137-V140 VanDerWaalsContact O-N 3.14Å; N138-V140 PolarHBondContact O-N 3.23Å; V140-Y142 PolarHBondContact O-N 3.31Å
141	P	81.8	Confident	85.3	Confident	62 Å²	62	59.2 Å²	59.2	40%	0.403	34%	0.343	S	S	.	.			trans	-74.1	116.1	-175.1	28.1	-33.9	0	0	0	112.1	T145 L146	P141-T145 CarbonylContact C-O 3.53Å; P141-T145 WeakPolarHBondContact CA-O 3.21Å; P141-L146 HydrophobicContact CB-CD2 4.07Å; P141-L146 HydrophobicContact CB-CG 4.48Å
142	Y	79.4	Confident	85.4	Confident	100 Å²	100	60.3 Å²	60.3	39%	0.392	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-91.4	127.8	174.4	-174.6	-96	0	0	0	110.1	V140 G144 T145 Y147 W149 V196	V140-Y142 PolarHBondContact O-N 3.31Å; Y142-G144 PolarHBondContact O-N 3.15Å; Y142-G144 VanDerWaalsContact O-N 3.1Å; Y142-T145 PolarHBondContact N-O 3.41Å; Y142-T145 PolarHBondContact O-N 3.01Å; Y142-T145 PolarHBondContact O-OG1 3.5Å; Y142-T145 VanDerWaalsContact O-OG1 3.12Å; Y142-Y147 HydrophobicContact CD1-CE2 4.2Å; Y142-W149 HydrophobicContact CD1-CH2 4.26Å; Y142-W149 HydrophobicContact CD1-CZ2 4.5Å; Y142-W149 HydrophobicContact CD2-CZ2 4.48Å; Y142-W149 HydrophobicContact CG-CH2 4.12Å; Y142-W149 HydrophobicContact CG-CZ2 4.01Å; Y142-V196 HydrophobicContact CE1-CG2 3.85Å; Y142-V196 HydrophobicContact CE2-CG1 3.73Å; Y142-V196 HydrophobicContact CE2-CG2 4.36Å
143	D	77.8	Confident	85.1	Confident	154 Å²	154	60.3 Å²	60.3	82%	0.824	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	40.1	-170.2	-152.9	21.7	0	0	0	113.8	T145	D143-T145 VanDerWaalsContact C-N 3.32Å; D143-T145 PolarHBondContact O-N 2.02Å
144	G	77.2	Confident	84.5	Confident	65 Å²	65	62.3 Å²	62.3	67%	0.67	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	3.5	-179.9	0	0	0	0	0	116	Y142	Y142-G144 PolarHBondContact O-N 3.15Å; Y142-G144 VanDerWaalsContact O-N 3.1Å
145	T	78.2	Confident	83.9	Confident	52 Å²	52	70.7 Å²	70.7	32%	0.319	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-124.9	145.2	179.8	49.1	0	0	0	0	112.3	P141 Y142 D143 Y147	P141-T145 CarbonylContact C-O 3.53Å; P141-T145 WeakPolarHBondContact CA-O 3.21Å; Y142-T145 PolarHBondContact N-O 3.41Å; Y142-T145 PolarHBondContact O-N 3.01Å; Y142-T145 PolarHBondContact O-OG1 3.5Å; Y142-T145 VanDerWaalsContact O-OG1 3.12Å; D143-T145 VanDerWaalsContact C-N 3.32Å; D143-T145 PolarHBondContact O-N 2.02Å; T145-Y147 WeakPolarHBondContact O-CD2 3.05Å; T145-Y147 WeakPolarHBondContact OG1-CE2 3.48Å; T145-Y147 PolarHBondContact OG1-OH 3.36Å
146	L	84	Confident	83.6	Confident	82 Å²	82	74.5 Å²	74.5	43%	0.429	40%	0.402	S	S	.	.			trans	-84.1	139.4	176.7	-68.1	168.7	0	0	0	110.3	N138 P141 A168	N138-L146 WeakPolarHBondContact O-CD2 3.42Å; P141-L146 HydrophobicContact CB-CD2 4.07Å; P141-L146 HydrophobicContact CB-CG 4.48Å; L146-A168 HydrophobicContact CB-CB 4.02Å; L146-A168 WeakPolarHBondContact O-CB 3.23Å; L146-A168 PolarHBondContact O-N 3.17Å
147	Y	86.2	Confident	83.4	Confident	29 Å²	29	76.4 Å²	76.4	11%	0.114	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	141	-178.4	-72.6	-92.1	0	0	0	110.6	N138 Y142 T145 W149 H166 P167 V194	N138-Y147 WeakPolarHBondContact CA-O 3.36Å; N138-Y147 PolarHBondContact OD1-O 2.91Å; Y142-Y147 HydrophobicContact CD1-CE2 4.2Å; T145-Y147 WeakPolarHBondContact O-CD2 3.05Å; T145-Y147 WeakPolarHBondContact OG1-CE2 3.48Å; T145-Y147 PolarHBondContact OG1-OH 3.36Å; Y147-W149 HydrophobicContact CD2-CZ2 4.16Å; Y147-W149 HydrophobicContact CG-CZ2 4.2Å; Y147-W149 VanDerWaalsContact O-CD1 3.28Å; Y147-W149 PolarHBondContact O-N 2.85Å; Y147-H166 CarbonylContact C-O 3.48Å; Y147-H166 WeakPolarHBondContact CA-O 3.45Å; Y147-P167 HydrophobicContact CD1-CB 4.49Å; Y147-P167 HydrophobicContact CD1-CG 4.31Å; Y147-P167 HydrophobicContact CE1-CB 4.29Å; Y147-P167 HydrophobicContact CE1-CG 3.86Å; Y147-V194 HydrophobicContact CD1-CG2 3.87Å; Y147-V194 HydrophobicContact CE1-CG1 4.32Å; Y147-V194 HydrophobicContact CE1-CG2 3.57Å; Y147-V194 HydrophobicContact CE2-CG2 4.32Å; Y147-V194 HydrophobicContact CG-CG2 4.38Å
148	K	87.7	Confident	83.3	Confident	109 Å²	109	74.2 Å²	74.2	47%	0.474	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106	166.2	-172.8	171.1	-179.8	177.3	0	108.1	H166 V171	K148-H166 PolarHBondContact N-O 3.17Å; K148-H166 PolarHBondContact O-N 3.25Å; K148-V171 HydrophobicContact CB-CG2 4.41Å; K148-V171 HydrophobicContact CD-CG1 3.97Å; K148-V171 HydrophobicContact CD-CG2 4.24Å
149	W	89	Confident	83.6	Confident	6 Å²	6	72.3 Å²	72.3	2%	0.023	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	131.9	-175.2	-62.6	99.9	0	0	0	112.2	C134 Y137 N138 Y142 Y147 C163 G165 V194 V196 L198	C134-W149 HydrophobicContact CB-CB 3.91Å; C134-W149 WeakPolarHBondContact O-CB 3.5Å; Y137-W149 VanDerWaalsContact C-CD1 3.45Å; Y137-W149 PolarHBondContact O-NE1 2.86Å; N138-W149 PolarHBondContact OD1-N 2.86Å; Y142-W149 HydrophobicContact CD1-CH2 4.26Å; Y142-W149 HydrophobicContact CD1-CZ2 4.5Å; Y142-W149 HydrophobicContact CD2-CZ2 4.48Å; Y142-W149 HydrophobicContact CG-CH2 4.12Å; Y142-W149 HydrophobicContact CG-CZ2 4.01Å; Y147-W149 HydrophobicContact CD2-CZ2 4.16Å; Y147-W149 HydrophobicContact CG-CZ2 4.2Å; Y147-W149 VanDerWaalsContact O-CD1 3.28Å; Y147-W149 PolarHBondContact O-N 2.85Å; W149-C163 HydrophobicContact CB-CB 4.26Å; W149-C163 HydrophobicContact CD2-CB 4.44Å; W149-C163 HydrophobicContact CE3-CB 3.76Å; W149-G165 VanDerWaalsContact CE3-N 3.29Å; W149-V194 HydrophobicContact CH2-CG2 3.82Å; W149-V194 HydrophobicContact CZ3-CG2 4.04Å; W149-V196 HydrophobicContact CH2-CB 4.03Å; W149-V196 HydrophobicContact CH2-CG2 3.81Å; W149-V196 HydrophobicContact CZ3-CB 3.9Å; W149-V196 HydrophobicContact CZ3-CG2 3.91Å; W149-L198 HydrophobicContact CD2-CD1 3.72Å; W149-L198 HydrophobicContact CE3-CD1 3.91Å; W149-L198 HydrophobicContact CE3-CD2 4.44Å; W149-L198 HydrophobicContact CE3-CG 4.46Å; W149-L198 HydrophobicContact CG-CD1 4.01Å; W149-L198 HydrophobicContact CH2-CD2 3.94Å; W149-L198 HydrophobicContact CZ2-CD2 4.01Å; W149-L198 HydrophobicContact CZ3-CD1 4.43Å; W149-L198 HydrophobicContact CZ3-CD2 4.15Å
150	T	88.1	Confident	84	Confident	41 Å²	41	65.6 Å²	65.6	25%	0.252	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.6	177.7	58.6	0	0	0	0	110.3	H152 C163 R164 H166	T150-H152 PolarHBondContact O-N 3.36Å; T150-C163 CarbonylContact O-C 3.51Å; T150-C163 WeakPolarHBondContact O-CA 3.41Å; T150-C163 WeakPolarHBondContact O-CB 3.24Å; T150-R164 PolarHBondContact N-O 3.02Å; T150-R164 PolarHBondContact O-N 3.43Å; T150-R164 PolarHBondContact OG1-O 2.98Å; T150-H166 PolarHBondContact OG1-CE1 2.77Å
151	P	88.3	Confident	84.3	Confident	35 Å²	35	63.8 Å²	63.8	23%	0.227	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.1	-174.2	27.8	-33.4	0	0	0	112.5	R130 Y153	R130-P151 HydrophobicContact CB-CB 4.08Å; R130-P151 HydrophobicContact CG-CB 3.98Å; P151-Y153 HydrophobicContact CB-CE2 4.2Å; P151-Y153 HydrophobicContact CG-CE2 4.44Å
152	H	88.8	Confident	84.8	Confident	64 Å²	64	61.5 Å²	61.5	30%	0.296	32%	0.32	S	S	.	.			trans	-107.7	125.1	173.3	-170.9	99.5	0	0	0	110.1	T150 D154 T162 R164 I195	T150-H152 PolarHBondContact O-N 3.36Å; H152-D154 PolarHBondContact O-N 3.21Å; H152-T162 HydrophobicContact CB-CG2 4.09Å; H152-T162 PolarHBondContact N-O 2.8Å; H152-T162 VanDerWaalsContact O-O 3.05Å; H152-R164 HydrophobicContact CB-CB 4.45Å; H152-I195 HydrophobicContact CB-CG2 4.41Å
153	Y	81.4	Confident	85.4	Confident	49 Å²	49	56.7 Å²	56.7	19%	0.192	30%	0.301	C	S	.	.			trans	-97.2	88.2	-175.9	-70.2	-89	0	0	0	111.7	D128 P151 Y155 S210	D128-Y153 PolarHBondContact OD2-OH 2.96Å; P151-Y153 HydrophobicContact CB-CE2 4.2Å; P151-Y153 HydrophobicContact CG-CE2 4.44Å; Y153-Y155 WeakPolarHBondContact O-CD2 3.22Å; Y153-Y155 WeakPolarHBondContact O-CE2 3.32Å; Y153-Y155 PolarHBondContact O-N 3.29Å; Y153-S210 WeakPolarHBondContact CE2-OG 3.42Å
154	D	78.3	Confident	86	Confident	55 Å²	55	51.4 Å²	51.4	29%	0.294	27%	0.27	S	S	.	.			trans	-63.9	129.8	166.8	-170.4	-20.7	0	0	0	110	H152 V156 E157 P158	H152-D154 PolarHBondContact O-N 3.21Å; D154-V156 WeakPolarHBondContact OD1-CA 3.03Å; D154-V156 VanDerWaalsContact OD1-CB 3.31Å; D154-V156 WeakPolarHBondContact OD1-CB 2.99Å; D154-V156 PolarHBondContact OD1-N 2.8Å; D154-E157 PolarHBondContact OD1-N 2.04Å; D154-P158 WeakPolarHBondContact O-CA 3.06Å; D154-P158 WeakPolarHBondContact O-CB 3.36Å
155	Y	77.4	Confident	86.5	Confident	176 Å²	176	48.3 Å²	48.3	69%	0.69	24%	0.238	S	C	*	.	S	Bend	trans	-81.5	-22.2	178.9	-71.9	-97.1	0	0	0	113.5	Y153 R209	Y153-Y155 WeakPolarHBondContact O-CD2 3.22Å; Y153-Y155 WeakPolarHBondContact O-CE2 3.32Å; Y153-Y155 PolarHBondContact O-N 3.29Å; Y155-R209 PolarHBondContact O-NH1 3.21Å
156	V	81.8	Confident	86.9	Confident	127 Å²	127	48.5 Å²	48.5	77%	0.77	24%	0.235	S	C	*	.	S	Bend	trans	-81.2	-52.9	178.4	-173.8	0	0	0	0	110.3	D154 P158	D154-V156 WeakPolarHBondContact OD1-CA 3.03Å; D154-V156 VanDerWaalsContact OD1-CB 3.31Å; D154-V156 WeakPolarHBondContact OD1-CB 2.99Å; D154-V156 PolarHBondContact OD1-N 2.8Å; V156-P158 WeakPolarHBondContact O-CD 3.47Å
157	E	84.4	Confident	86.7	Confident	109 Å²	109	45 Å²	45	51%	0.509	22%	0.217	S	C	.	.	S	Bend	trans	-112.7	62.7	175.9	-60.4	-148.9	154.8	0	0	112.9	D154 C159 A160	D154-E157 PolarHBondContact OD1-N 2.04Å; E157-C159 PolarHBondContact O-N 2.78Å; E157-A160 HydrophobicContact CB-CB 4.13Å; E157-A160 PolarHBondContact O-N 2.72Å
158	P	86.5	Confident	85.7	Confident	12 Å²	12	45.3 Å²	45.3	8%	0.078	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-1.4	-172.2	28.5	-38	0	0	0	115.3	R130 D154 V156 C208 C216 C221	R130-P158 PolarHBondContact NH1-O 2.88Å; R130-P158 PolarHBondContact NH2-O 2.95Å; D154-P158 WeakPolarHBondContact O-CA 3.06Å; D154-P158 WeakPolarHBondContact O-CB 3.36Å; V156-P158 WeakPolarHBondContact O-CD 3.47Å; P158-C208 HydrophobicContact CB-CB 4.25Å; P158-C208 WeakPolarHBondContact CB-O 3.4Å; P158-C216 PolarHBondContact O-SG 2.95Å; P158-C221 HydrophobicContact CG-CB 4.07Å
159	C	91.9	Very high	84.6	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.027	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	4.1	177.1	-61.7	0	0	0	0	114.3	E157 R201 V202 C216 G219 K220 C221	E157-C159 PolarHBondContact O-N 2.78Å; C159-R201 CarbonylContact O-C 3.57Å; C159-R201 VanDerWaalsContact O-CA 3.29Å; C159-R201 WeakPolarHBondContact O-CA 3.43Å; C159-V202 HydrophobicContact CB-CG2 4.35Å; C159-V202 PolarHBondContact O-N 3.46Å; C159-C216 WeakPolarHBondContact CA-SG 3.46Å; C159-C216 HydrophobicContact CB-CB 3.71Å; C159-C216 WeakPolarHBondContact CB-SG 3.48Å; C159-C216 WeakPolarHBondContact SG-CA 3.33Å; C159-C216 WeakPolarHBondContact SG-CB 3.43Å; C159-C216 CovalentContact SG-SG 2.03Å; C159-C216 PolarHBondContact SG-SG 3.33Å; C159-G219 WeakPolarHBondContact CB-O 3.34Å; C159-K220 VanDerWaalsContact SG-C 3.55Å; C159-C221 VanDerWaalsContact SG-CA 3.57Å; C159-C221 PolarHBondContact SG-N 3.15Å
160	A	90.9	Very high	83.1	Confident	4 Å²	4	49 Å²	49	3%	0.033	25%	0.246	C	C	.	.	S	Bend	trans	-74.5	147.4	161.5	0	0	0	0	0	110.3	R130 E157 T162 Q197	R130-A160 PolarHBondContact NH2-O 3.23Å; E157-A160 HydrophobicContact CB-CB 4.13Å; E157-A160 PolarHBondContact O-N 2.72Å; A160-T162 PolarHBondContact O-N 2.84Å; A160-Q197 HydrophobicContact CB-CG 4.23Å; A160-Q197 VanDerWaalsContact CB-NE2 3.3Å
161	L	91.6	Very high	81.5	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	74.2	173.2	-174.3	65.1	0	0	0	109.4	R130 Q133 Y137 Q197 L198 S199 V202	R130-L161 HydrophobicContact CG-CD1 4.39Å; Q133-L161 HydrophobicContact CB-CD1 3.71Å; Q133-L161 HydrophobicContact CB-CD2 4.11Å; Y137-L161 HydrophobicContact CE2-CD2 3.8Å; L161-Q197 CarbonylContact O-C 3.54Å; L161-L198 HydrophobicContact CD2-CB 4.48Å; L161-L198 PolarHBondContact O-N 3.39Å; L161-S199 WeakPolarHBondContact CB-OG 3.08Å; L161-S199 PolarHBondContact N-O 3.38Å; L161-S199 PolarHBondContact O-N 3.01Å; L161-V202 HydrophobicContact CB-CG1 4.08Å; L161-V202 HydrophobicContact CD1-CG1 4.05Å
162	T	91.3	Very high	79.5	Confident	13 Å²	13	55.3 Å²	55.3	8%	0.08	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	127.8	169.6	-43	0	0	0	0	109.2	H152 A160 I195 V196	H152-T162 HydrophobicContact CB-CG2 4.09Å; H152-T162 PolarHBondContact N-O 2.8Å; H152-T162 VanDerWaalsContact O-O 3.05Å; A160-T162 PolarHBondContact O-N 2.84Å; T162-I195 HydrophobicContact CG2-CG2 3.72Å; T162-V196 WeakPolarHBondContact CA-O 3.45Å
163	C	92.6	Very high	77.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.7	-179	-55.7	0	0	0	0	109.8	C134 W149 T150 I195 V196 L198	C134-C163 WeakPolarHBondContact CA-SG 3.43Å; C134-C163 HydrophobicContact CB-CB 3.85Å; C134-C163 WeakPolarHBondContact CB-SG 3.29Å; C134-C163 WeakPolarHBondContact SG-CB 3.43Å; C134-C163 CovalentContact SG-SG 2.04Å; C134-C163 PolarHBondContact SG-SG 2.65Å; W149-C163 HydrophobicContact CB-CB 4.26Å; W149-C163 HydrophobicContact CD2-CB 4.44Å; W149-C163 HydrophobicContact CE3-CB 3.76Å; T150-C163 CarbonylContact O-C 3.51Å; T150-C163 WeakPolarHBondContact O-CA 3.41Å; T150-C163 WeakPolarHBondContact O-CB 3.24Å; C163-I195 WeakPolarHBondContact O-CA 3.46Å; C163-V196 PolarHBondContact N-O 2.91Å; C163-V196 PolarHBondContact O-N 2.84Å; C163-L198 HydrophobicContact CB-CD1 3.77Å; C163-L198 HydrophobicContact CB-CG 4.21Å
164	R	91.3	Very high	75.7	Confident	43 Å²	43	61.1 Å²	61.1	16%	0.162	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.3	171.7	176.2	175.9	167.9	175.4	-9.8	108.3	T150 H152 H166 Y189 D190 S193 V194 I195	T150-R164 PolarHBondContact N-O 3.02Å; T150-R164 PolarHBondContact O-N 3.43Å; T150-R164 PolarHBondContact OG1-O 2.98Å; H152-R164 HydrophobicContact CB-CB 4.45Å; R164-H166 VanDerWaalsContact CD-CE1 3.48Å; R164-H166 WeakPolarHBondContact CD-CE1 3.17Å; R164-H166 PolarHBondContact NE-CE1 3.27Å; R164-H166 PolarHBondContact NE-NE2 3.01Å; R164-H166 PolarHBondContact NH2-NE2 3.21Å; R164-Y189 PolarHBondContact NH2-O 3.16Å; R164-D190 IonicContact CZ-OD1 2.69Å; R164-D190 IonicContact CZ-OD2 3.28Å; R164-D190 IonicContact NE-OD1 3.13Å; R164-D190 IonicContact NH1-OD1 3.6Å; R164-D190 PolarHBondContact NH1-OD1 2.9Å; R164-D190 IonicContact NH1-OD2 2.68Å; R164-D190 PolarHBondContact NH1-OD2 2.81Å; R164-D190 VanDerWaalsContact NH2-CA 3.34Å; R164-D190 IonicContact NH2-OD1 2.61Å; R164-D190 PolarHBondContact NH2-OD1 2.75Å; R164-D190 IonicContact NH2-OD2 2.7Å; R164-D190 PolarHBondContact NH2-OD2 3.34Å; R164-S193 PolarHBondContact NE-OG 3.49Å; R164-V194 CarbonylContact C-O 3.58Å; R164-V194 WeakPolarHBondContact CA-O 3.45Å; R164-I195 HydrophobicContact CB-CG1 4.28Å; R164-I195 HydrophobicContact CG-CG1 4.29Å
165	G	87	Confident	74	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.8	178.1	0	0	0	0	0	111	W149 S193 V194	W149-G165 VanDerWaalsContact CE3-N 3.29Å; G165-S193 CarbonylContact O-C 3.54Å; G165-S193 VanDerWaalsContact O-CA 3.29Å; G165-S193 WeakPolarHBondContact O-CA 3.49Å; G165-S193 WeakPolarHBondContact O-CB 3.22Å; G165-V194 PolarHBondContact N-O 2.71Å; G165-V194 PolarHBondContact O-N 2.89Å
166	H	86.8	Confident	72.3	Confident	55 Å²	55	65.8 Å²	65.8	26%	0.255	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.5	169.8	-59.1	88.1	0	0	0	109.4	Y147 K148 T150 R164 A168 Y189	Y147-H166 CarbonylContact C-O 3.48Å; Y147-H166 WeakPolarHBondContact CA-O 3.45Å; K148-H166 PolarHBondContact N-O 3.17Å; K148-H166 PolarHBondContact O-N 3.25Å; T150-H166 PolarHBondContact OG1-CE1 2.77Å; R164-H166 VanDerWaalsContact CD-CE1 3.48Å; R164-H166 WeakPolarHBondContact CD-CE1 3.17Å; R164-H166 PolarHBondContact NE-CE1 3.27Å; R164-H166 PolarHBondContact NE-NE2 3.01Å; R164-H166 PolarHBondContact NH2-NE2 3.21Å; H166-A168 PolarHBondContact O-N 3.43Å; H166-Y189 PolarHBondContact NE2-O 3.4Å
167	P	79.6	Confident	70.2	Confident	10 Å²	10	68 Å²	68	7%	0.065	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	125.2	-172.9	-21.3	30.1	0	0	0	112	Y147 H169 L170 Q192	Y147-P167 HydrophobicContact CD1-CB 4.49Å; Y147-P167 HydrophobicContact CD1-CG 4.31Å; Y147-P167 HydrophobicContact CE1-CB 4.29Å; Y147-P167 HydrophobicContact CE1-CG 3.86Å; P167-H169 VanDerWaalsContact CB-CE1 3.42Å; P167-H169 WeakPolarHBondContact CB-CE1 3.15Å; P167-H169 PolarHBondContact O-N 3.14Å; P167-H169 VanDerWaalsContact O-N 3.17Å; P167-L170 HydrophobicContact CB-CD1 4.33Å; P167-L170 HydrophobicContact CB-CG 4.48Å; P167-L170 HydrophobicContact CG-CD1 4.23Å; P167-L170 PolarHBondContact O-N 3.37Å; P167-Q192 HydrophobicContact CG-CB 4.45Å
168	A	65.9	Low	68	Low	34 Å²	34	68.6 Å²	68.6	28%	0.281	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.3	-170.2	0	0	0	0	0	113.3	L146 H166 L170 V171	L146-A168 HydrophobicContact CB-CB 4.02Å; L146-A168 WeakPolarHBondContact O-CB 3.23Å; L146-A168 PolarHBondContact O-N 3.17Å; H166-A168 PolarHBondContact O-N 3.43Å; A168-L170 PolarHBondContact O-N 3.1Å; A168-V171 WeakPolarHBondContact O-CB 3.34Å; A168-V171 PolarHBondContact O-N 3.38Å
169	H	63.2	Low	65.8	Low	121 Å²	121	72.5 Å²	72.5	56%	0.56	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-68.3	-10.1	177.3	58.5	-99.6	0	0	0	114.4	P167	P167-H169 VanDerWaalsContact CB-CE1 3.42Å; P167-H169 WeakPolarHBondContact CB-CE1 3.15Å; P167-H169 PolarHBondContact O-N 3.14Å; P167-H169 VanDerWaalsContact O-N 3.17Å
170	L	58.6	Low	63.1	Low	72 Å²	72	79.1 Å²	79.1	38%	0.377	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-98.6	3.2	171.4	-61.1	176	0	0	0	112.5	P167 A168 I174 Q192	P167-L170 HydrophobicContact CB-CD1 4.33Å; P167-L170 HydrophobicContact CB-CG 4.48Å; P167-L170 HydrophobicContact CG-CD1 4.23Å; P167-L170 PolarHBondContact O-N 3.37Å; A168-L170 PolarHBondContact O-N 3.1Å; L170-I174 WeakPolarHBondContact O-CD1 3.49Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-Q192 HydrophobicContact CD1-CG 4.49Å
171	V	54.3	Low	60.8	Low	50 Å²	50	82.2 Å²	82.2	30%	0.303	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-22.8	-176.8	-175	0	0	0	0	112.1	K148 A168	K148-V171 HydrophobicContact CB-CG2 4.41Å; K148-V171 HydrophobicContact CD-CG1 3.97Å; K148-V171 HydrophobicContact CD-CG2 4.24Å; A168-V171 WeakPolarHBondContact O-CB 3.34Å; A168-V171 PolarHBondContact O-N 3.38Å
172	E	46.3	Very low	58	Low	158 Å²	158	88.7 Å²	88.7	74%	0.738	49%	0.493	S	S	*	.	S	Bend	trans	-78.6	-35.3	-178.4	-61.4	-166	142.9	0	0	112.7	I174 S175	E172-I174 PolarHBondContact O-N 3.39Å; E172-S175 PolarHBondContact O-OG 3.13Å
173	D	42.9	Very low	55.7	Low	138 Å²	138	92.7 Å²	92.7	74%	0.738	53%	0.528	S	S	*	.	S	Bend	trans	-63.1	-25.9	175	-73.9	-35.7	0	0	0	112.9	S175	D173-S175 VanDerWaalsContact C-N 3.26Å; D173-S175 PolarHBondContact O-N 3.12Å
174	I	48	Very low	53.3	Low	97 Å²	97	100.9 Å²	100.9	50%	0.497	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.4	47.2	-176.7	-39.9	175.3	0	0	0	110.9	L170 E172 Y189	L170-I174 WeakPolarHBondContact O-CD1 3.49Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; E172-I174 PolarHBondContact O-N 3.39Å; I174-Y189 HydrophobicContact CD1-CE1 3.77Å; I174-Y189 WeakPolarHBondContact CD1-OH 3.32Å
175	S	40.7	Very low	50.8	Low	97 Å²	97	105.8 Å²	105.8	68%	0.678	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	3.8	178	66	0	0	0	0	114.6	E172 D173	E172-S175 PolarHBondContact O-OG 3.13Å; D173-S175 VanDerWaalsContact C-N 3.26Å; D173-S175 PolarHBondContact O-N 3.12Å
176	R	43.7	Very low	48.8	Very low	233 Å²	233	109.1 Å²	109.1	88%	0.879	62%	0.619	S	S	*	*	S	Bend	trans	-133.2	0.8	-179.4	-96.7	-173.7	69	128.2	-5	118.1
177	E	36.5	Very low	46.7	Very low	174 Å²	174	114.8 Å²	114.8	81%	0.813	65%	0.645	S	S	*	*	S	Bend	trans	-130.8	153.5	167.2	-66.9	-158.8	153.6	0	0	112.3
178	T	39.3	Very low	45	Very low	120 Å²	120	120.9 Å²	120.9	74%	0.736	67%	0.673	S	S	*	*			trans	48.7	86	176.5	50	0	0	0	0	117.6	D180	T178-D180 PolarHBondContact O-N 3.43Å
179	G	38.6	Very low	44	Very low	94 Å²	94	124.5 Å²	124.5	97%	0.969	68%	0.68	S	S	*	*			trans	-81.7	59.2	140.3	0	0	0	0	0	111.9
180	D	36.3	Very low	43.3	Very low	144 Å²	144	122.2 Å²	122.2	77%	0.77	67%	0.672	S	S	*	*	S	Bend	trans	-153.1	145.8	155.3	-153	-9.4	0	0	0	110.5	T178	T178-D180 PolarHBondContact O-N 3.43Å
181	G	41.7	Very low	43	Very low	69 Å²	69	126.5 Å²	126.5	71%	0.711	69%	0.69	S	S	*	*			trans	-109.3	105.4	-161.5	0	0	0	0	0	114.8
182	N	32.5	Very low	43.1	Very low	140 Å²	140	129.9 Å²	129.9	75%	0.749	70%	0.702	S	S	*	*			trans	-100.2	124.3	163.7	-93.8	-56	0	0	0	111.2	E184	N182-E184 PolarHBondContact O-N 3.36Å
183	A	44.4	Very low	44.3	Very low	98 Å²	98	123.1 Å²	123.1	81%	0.81	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	22	-163.8	0	0	0	0	0	115.8
184	E	41	Very low	46.3	Very low	172 Å²	172	118.5 Å²	118.5	80%	0.804	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-15.3	-174.7	-62.4	-167.9	155.3	0	0	114.2	N182 A186	N182-E184 PolarHBondContact O-N 3.36Å; E184-A186 VanDerWaalsContact C-N 3.28Å; E184-A186 PolarHBondContact O-N 2.84Å
185	E	40.2	Very low	48.2	Very low	146 Å²	146	118.1 Å²	118.1	68%	0.682	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-79.6	-7.6	176.3	-66.5	-167.2	136.3	0	0	114	E187 H188	E185-E187 PolarHBondContact O-N 3.26Å; E185-H188 PolarHBondContact O-N 3.44Å
186	A	43.2	Very low	50.4	Low	70 Å²	70	114.3 Å²	114.3	58%	0.579	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-62.3	-25.2	-175.6	0	0	0	0	0	114.3	E184	E184-A186 VanDerWaalsContact C-N 3.28Å; E184-A186 PolarHBondContact O-N 2.84Å
187	E	44.4	Very low	52.7	Low	174 Å²	174	108.1 Å²	108.1	81%	0.813	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-83.3	-12.3	-175	-61	-157.1	159.8	0	0	114.5	E185	E185-E187 PolarHBondContact O-N 3.26Å
188	H	42.3	Very low	55.1	Low	137 Å²	137	101.4 Å²	101.4	63%	0.634	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-23.9	176.1	-161.1	28	0	0	0	113.3	E185 D190	E185-H188 PolarHBondContact O-N 3.44Å; H188-D190 PolarHBondContact O-N 3.48Å
189	Y	45.4	Very low	57.5	Low	111 Å²	111	97.1 Å²	97.1	44%	0.435	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	9.6	179.2	-68.4	-82.2	0	0	0	114.5	R164 H166 I174	R164-Y189 PolarHBondContact NH2-O 3.16Å; H166-Y189 PolarHBondContact NE2-O 3.4Å; I174-Y189 HydrophobicContact CD1-CE1 3.77Å; I174-Y189 WeakPolarHBondContact CD1-OH 3.32Å
190	D	49	Very low	59.7	Low	73 Å²	73	96.8 Å²	96.8	39%	0.39	53%	0.533	S	S	.	.	S	Bend	trans	-88.4	-42.2	172.3	-113.3	-69.4	0	0	0	113.1	R164 H188 Q192 S193	R164-D190 IonicContact CZ-OD1 2.69Å; R164-D190 IonicContact CZ-OD2 3.28Å; R164-D190 IonicContact NE-OD1 3.13Å; R164-D190 IonicContact NH1-OD1 3.6Å; R164-D190 PolarHBondContact NH1-OD1 2.9Å; R164-D190 IonicContact NH1-OD2 2.68Å; R164-D190 PolarHBondContact NH1-OD2 2.81Å; R164-D190 VanDerWaalsContact NH2-CA 3.34Å; R164-D190 IonicContact NH2-OD1 2.61Å; R164-D190 PolarHBondContact NH2-OD1 2.75Å; R164-D190 IonicContact NH2-OD2 2.7Å; R164-D190 PolarHBondContact NH2-OD2 3.34Å; H188-D190 PolarHBondContact O-N 3.48Å; D190-Q192 VanDerWaalsContact C-N 3.29Å; D190-Q192 PolarHBondContact O-N 2.69Å; D190-S193 PolarHBondContact O-N 2.94Å; D190-S193 PolarHBondContact O-OG 3.46Å
191	E	51.4	Low	62.3	Low	162 Å²	162	96.9 Å²	96.9	76%	0.757	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.1	-170.8	-66.9	-166.7	118.3	0	0	114.4
192	Q	57.8	Low	64.6	Low	120 Å²	120	93.7 Å²	93.7	56%	0.561	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.3	173.3	-108.3	73.2	11.2	0	0	114.1	P167 L170 D190	P167-Q192 HydrophobicContact CG-CB 4.45Å; L170-Q192 HydrophobicContact CD1-CG 4.49Å; D190-Q192 VanDerWaalsContact C-N 3.29Å; D190-Q192 PolarHBondContact O-N 2.69Å
193	S	71.1	Confident	67.3	Low	17 Å²	17	92.4 Å²	92.4	12%	0.119	48%	0.479	C	S	.	.			trans	-96.9	134.8	-172.5	76.7	0	0	0	0	112.6	R164 G165 D190	R164-S193 PolarHBondContact NE-OG 3.49Å; G165-S193 CarbonylContact O-C 3.54Å; G165-S193 VanDerWaalsContact O-CA 3.29Å; G165-S193 WeakPolarHBondContact O-CA 3.49Å; G165-S193 WeakPolarHBondContact O-CB 3.22Å; D190-S193 PolarHBondContact O-N 2.94Å; D190-S193 PolarHBondContact O-OG 3.46Å
194	V	83.8	Confident	69.4	Low	40 Å²	40	89.5 Å²	89.5	24%	0.242	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	122.7	-176.4	-64.4	0	0	0	0	110.9	Y147 W149 R164 G165 V196	Y147-V194 HydrophobicContact CD1-CG2 3.87Å; Y147-V194 HydrophobicContact CE1-CG1 4.32Å; Y147-V194 HydrophobicContact CE1-CG2 3.57Å; Y147-V194 HydrophobicContact CE2-CG2 4.32Å; Y147-V194 HydrophobicContact CG-CG2 4.38Å; W149-V194 HydrophobicContact CH2-CG2 3.82Å; W149-V194 HydrophobicContact CZ3-CG2 4.04Å; R164-V194 CarbonylContact C-O 3.58Å; R164-V194 WeakPolarHBondContact CA-O 3.45Å; G165-V194 PolarHBondContact N-O 2.71Å; G165-V194 PolarHBondContact O-N 2.89Å; V194-V196 HydrophobicContact CB-CG2 4.06Å; V194-V196 HydrophobicContact CG2-CG2 4.05Å
195	I	88.1	Confident	71.5	Confident	89 Å²	89	81.3 Å²	81.3	46%	0.456	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	112.6	174.8	-60.3	164.2	0	0	0	108.1	H152 T162 C163 R164	H152-I195 HydrophobicContact CB-CG2 4.41Å; T162-I195 HydrophobicContact CG2-CG2 3.72Å; C163-I195 WeakPolarHBondContact O-CA 3.46Å; R164-I195 HydrophobicContact CB-CG1 4.28Å; R164-I195 HydrophobicContact CG-CG1 4.29Å
196	V	88.7	Confident	73.8	Confident	18 Å²	18	74.4 Å²	74.4	11%	0.109	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.2	-170.6	-173.5	0	0	0	0	110.6	Y142 W149 T162 C163 V194 L198	Y142-V196 HydrophobicContact CE1-CG2 3.85Å; Y142-V196 HydrophobicContact CE2-CG1 3.73Å; Y142-V196 HydrophobicContact CE2-CG2 4.36Å; W149-V196 HydrophobicContact CH2-CB 4.03Å; W149-V196 HydrophobicContact CH2-CG2 3.81Å; W149-V196 HydrophobicContact CZ3-CB 3.9Å; W149-V196 HydrophobicContact CZ3-CG2 3.91Å; T162-V196 WeakPolarHBondContact CA-O 3.45Å; C163-V196 PolarHBondContact N-O 2.91Å; C163-V196 PolarHBondContact O-N 2.84Å; V194-V196 HydrophobicContact CB-CG2 4.06Å; V194-V196 HydrophobicContact CG2-CG2 4.05Å; V196-L198 HydrophobicContact CB-CD2 4.12Å; V196-L198 HydrophobicContact CG1-CD2 3.83Å; V196-L198 PolarHBondContact O-N 3.28Å
197	Q	90.1	Very high	75.9	Confident	103 Å²	103	73.2 Å²	73.2	48%	0.481	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	92.6	167.5	-175	176.4	16.6	0	0	109.2	A160 L161 S199	A160-Q197 HydrophobicContact CB-CG 4.23Å; A160-Q197 VanDerWaalsContact CB-NE2 3.3Å; L161-Q197 CarbonylContact O-C 3.54Å; Q197-S199 VanDerWaalsContact C-N 3.3Å; Q197-S199 WeakPolarHBondContact CG-O 3.27Å
198	L	88.5	Confident	77.9	Confident	32 Å²	32	65 Å²	65	17%	0.168	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-24.7	179.7	-59.3	-178.1	0	0	0	112.3	Y137 W149 L161 C163 V196	Y137-L198 HydrophobicContact CD1-CD1 4.41Å; Y137-L198 HydrophobicContact CD2-CB 4.27Å; Y137-L198 HydrophobicContact CD2-CD1 3.68Å; Y137-L198 HydrophobicContact CE1-CB 4.47Å; Y137-L198 HydrophobicContact CE2-CB 4.13Å; Y137-L198 HydrophobicContact CE2-CD1 4.35Å; Y137-L198 HydrophobicContact CG-CD1 3.71Å; W149-L198 HydrophobicContact CD2-CD1 3.72Å; W149-L198 HydrophobicContact CE3-CD1 3.91Å; W149-L198 HydrophobicContact CE3-CD2 4.44Å; W149-L198 HydrophobicContact CE3-CG 4.46Å; W149-L198 HydrophobicContact CG-CD1 4.01Å; W149-L198 HydrophobicContact CH2-CD2 3.94Å; W149-L198 HydrophobicContact CZ2-CD2 4.01Å; W149-L198 HydrophobicContact CZ3-CD1 4.43Å; W149-L198 HydrophobicContact CZ3-CD2 4.15Å; L161-L198 HydrophobicContact CD2-CB 4.48Å; L161-L198 PolarHBondContact O-N 3.39Å; C163-L198 HydrophobicContact CB-CD1 3.77Å; C163-L198 HydrophobicContact CB-CG 4.21Å; V196-L198 HydrophobicContact CB-CD2 4.12Å; V196-L198 HydrophobicContact CG1-CD2 3.83Å; V196-L198 PolarHBondContact O-N 3.28Å
199	S	89.8	Confident	79.8	Confident	31 Å²	31	62.4 Å²	62.4	22%	0.217	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	152.7	171	108	0	0	0	0	113.6	L161 Q197 R201	L161-S199 WeakPolarHBondContact CB-OG 3.08Å; L161-S199 PolarHBondContact N-O 3.38Å; L161-S199 PolarHBondContact O-N 3.01Å; Q197-S199 VanDerWaalsContact C-N 3.3Å; Q197-S199 WeakPolarHBondContact CG-O 3.27Å; S199-R201 PolarHBondContact O-N 3.26Å; S199-R201 VanDerWaalsContact OG-C 3.31Å; S199-R201 PolarHBondContact OG-N 3.04Å; S199-R201 VanDerWaalsContact OG-N 3.16Å; S199-R201 PolarHBondContact OG-O 2.89Å
200	A	84.4	Confident	81.2	Confident	86 Å²	86	61.1 Å²	61.1	71%	0.711	31%	0.314	S	S	*	.	S	Bend	trans	-69.6	-13.7	176.5	0	0	0	0	0	114.1
201	R	90.6	Very high	82.1	Confident	147 Å²	147	62 Å²	62	56%	0.555	34%	0.339	S	S	*	.			trans	-155.3	132.2	175	64.5	-174.8	-178.2	109.9	3.9	113.1	C159 S199 D204	C159-R201 CarbonylContact O-C 3.57Å; C159-R201 VanDerWaalsContact O-CA 3.29Å; C159-R201 WeakPolarHBondContact O-CA 3.43Å; S199-R201 PolarHBondContact O-N 3.26Å; S199-R201 VanDerWaalsContact OG-C 3.31Å; S199-R201 PolarHBondContact OG-N 3.04Å; S199-R201 VanDerWaalsContact OG-N 3.16Å; S199-R201 PolarHBondContact OG-O 2.89Å; R201-D204 IonicContact NH1-OD2 2.65Å
202	V	90.3	Very high	83.4	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-63.1	157.7	163.3	-57.8	0	0	0	0	110.7	C159 L161 T206 C216	C159-V202 HydrophobicContact CB-CG2 4.35Å; C159-V202 PolarHBondContact O-N 3.46Å; L161-V202 HydrophobicContact CB-CG1 4.08Å; L161-V202 HydrophobicContact CD1-CG1 4.05Å; V202-T206 HydrophobicContact CB-CG2 4.18Å; V202-T206 HydrophobicContact CG1-CG2 4.5Å; V202-T206 HydrophobicContact CG2-CG2 4.12Å; V202-C216 HydrophobicContact CG2-CB 3.45Å; V202-C216 VanDerWaalsContact CG2-CB 3.45Å
203	Q	88.8	Confident	84.4	Confident	113 Å²	113	52.3 Å²	52.3	53%	0.528	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-59.3	136.3	173.6	-65.5	-175.5	14.4	0	0	110.8	F129 Q133 G205 T206	F129-Q203 HydrophobicContact CE1-CB 4.07Å; F129-Q203 HydrophobicContact CZ-CB 4.45Å; Q133-Q203 HydrophobicContact CG-CG 4.32Å; Q203-G205 PolarHBondContact O-N 3.42Å; Q203-T206 WeakPolarHBondContact O-CB 3.48Å; Q203-T206 PolarHBondContact O-N 3.43Å; Q203-T206 VanDerWaalsContact O-N 3.08Å; Q203-T206 PolarHBondContact O-OG1 2.82Å
204	D	89.1	Confident	85.2	Confident	37 Å²	37	53 Å²	53	20%	0.198	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	123.7	-174.6	-63.6	-37.2	0	0	0	110.6	S88 I95 R201 C216 Q218	S88-D204 WeakPolarHBondContact CB-O 3.44Å; S88-D204 PolarHBondContact OG-O 2.96Å; I95-D204 HydrophobicContact CD1-CB 3.72Å; I95-D204 HydrophobicContact CG1-CB 4.49Å; R201-D204 IonicContact NH1-OD2 2.65Å; D204-C216 CarbonylContact C-O 3.56Å; D204-C216 WeakPolarHBondContact CA-O 3.39Å; D204-Q218 WeakPolarHBondContact OD1-CA 3.38Å; D204-Q218 PolarHBondContact OD1-N 2.02Å
205	G	84.6	Confident	85.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	109.3	-9.5	-170.7	0	0	0	0	0	114.7	Q203 C216	Q203-G205 PolarHBondContact O-N 3.42Å; G205-C216 PolarHBondContact N-O 3.21Å
206	T	88.8	Confident	85.5	Confident	1 Å²	1	47 Å²	47	1%	0.006	27%	0.269	C	S	.	.			trans	-62.3	139.6	167.7	-51.1	0	0	0	0	110.5	F129 R130 Q133 V202 Q203 C216	F129-T206 HydrophobicContact CD1-CG2 4.49Å; F129-T206 WeakPolarHBondContact CD1-OG1 3.15Å; R130-T206 HydrophobicContact CB-CG2 3.96Å; R130-T206 HydrophobicContact CG-CG2 4.21Å; Q133-T206 PolarHBondContact NE2-OG1 3.2Å; V202-T206 HydrophobicContact CB-CG2 4.18Å; V202-T206 HydrophobicContact CG1-CG2 4.5Å; V202-T206 HydrophobicContact CG2-CG2 4.12Å; Q203-T206 WeakPolarHBondContact O-CB 3.48Å; Q203-T206 PolarHBondContact O-N 3.43Å; Q203-T206 VanDerWaalsContact O-N 3.08Å; Q203-T206 PolarHBondContact O-OG1 2.82Å; T206-C216 WeakPolarHBondContact O-CB 3.08Å; T206-C216 PolarHBondContact O-N 2.96Å
207	R	85.9	Confident	85.6	Confident	45 Å²	45	46.5 Å²	46.5	17%	0.17	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-66.2	138.2	174.9	-64.5	174.9	-178.2	-90.5	0.8	110.6	D92 R130 S212 D214	D92-R207 VanDerWaalsContact CG-NH2 3.32Å; D92-R207 PolarHBondContact O-NH2 2.87Å; D92-R207 IonicContact OD1-CZ 3.79Å; D92-R207 IonicContact OD1-NE 2.76Å; D92-R207 IonicContact OD1-NH2 2.82Å; D92-R207 PolarHBondContact OD1-NH2 3.18Å; D92-R207 IonicContact OD2-CZ 2.61Å; D92-R207 IonicContact OD2-NE 2.96Å; D92-R207 PolarHBondContact OD2-NE 3.02Å; D92-R207 IonicContact OD2-NH2 2.7Å; D92-R207 PolarHBondContact OD2-NH2 3.17Å; R130-R207 PolarHBondContact NH1-O 3.46Å; R207-S212 PolarHBondContact NH1-O 2.88Å; R207-D214 WeakPolarHBondContact CA-O 3.05Å
208	C	86.3	Confident	85.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	27%	0.268	C	S	.	.	S	Bend	trans	-66.5	-40	179.1	-56.5	0	0	0	0	112.6	P158 D214 C221	P158-C208 HydrophobicContact CB-CB 4.25Å; P158-C208 WeakPolarHBondContact CB-O 3.4Å; C208-D214 HydrophobicContact CB-CB 4.26Å; C208-D214 PolarHBondContact N-O 2.81Å; C208-D214 PolarHBondContact SG-O 3.39Å; C208-C221 HydrophobicContact CB-CB 3.99Å; C208-C221 WeakPolarHBondContact CB-SG 3.5Å; C208-C221 WeakPolarHBondContact SG-CA 3.38Å; C208-C221 WeakPolarHBondContact SG-CB 3.42Å; C208-C221 CovalentContact SG-SG 2.04Å; C208-C221 PolarHBondContact SG-SG 2.8Å
209	R	83.6	Confident	85.3	Confident	83 Å²	83	47 Å²	47	31%	0.313	27%	0.274	S	S	.	.	S	Bend	trans	-147.3	143.4	-173.6	-47.2	-179.2	-156.2	-87.3	1.1	109.2	Y155 S212	Y155-R209 PolarHBondContact O-NH1 3.21Å; R209-S212 PolarHBondContact N-OG 3.43Å; R209-S212 WeakPolarHBondContact O-CB 3.01Å; R209-S212 PolarHBondContact O-N 3.08Å; R209-S212 VanDerWaalsContact O-N 3.14Å; R209-S212 PolarHBondContact O-OG 3.44Å
210	S	73.5	Confident	85.2	Confident	85 Å²	85	52.5 Å²	52.5	59%	0.594	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	141.5	175.1	-48	0	0	0	0	111.8	Y153 S212	Y153-S210 WeakPolarHBondContact CE2-OG 3.42Å; S210-S212 PolarHBondContact O-N 3.48Å
211	G	69.1	Low	85.4	Confident	90 Å²	90	50.5 Å²	50.5	93%	0.928	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-10.8	-176.6	0	0	0	0	0	116.3
212	S	78.9	Confident	85.4	Confident	26 Å²	26	47.2 Å²	47.2	18%	0.182	27%	0.265	C	S	.	.			trans	-89.4	152.8	178	76.6	0	0	0	0	112.9	R207 R209 S210	R207-S212 PolarHBondContact NH1-O 2.88Å; R209-S212 PolarHBondContact N-OG 3.43Å; R209-S212 WeakPolarHBondContact O-CB 3.01Å; R209-S212 PolarHBondContact O-N 3.08Å; R209-S212 VanDerWaalsContact O-N 3.14Å; R209-S212 PolarHBondContact O-OG 3.44Å; S210-S212 PolarHBondContact O-N 3.48Å
213	L	78.7	Confident	85.1	Confident	53 Å²	53	54 Å²	54	28%	0.277	29%	0.291	S	S	.	.			trans	-82.6	-14.9	167.7	-70.8	170.7	0	0	0	112.4	M120 V224 L228	M120-L213 HydrophobicContact CE-CD2 4.16Å; L213-V224 HydrophobicContact CB-CB 3.85Å; L213-V224 HydrophobicContact CB-CG1 3.92Å; L213-V224 VanDerWaalsContact O-CB 3.26Å; L213-V224 WeakPolarHBondContact O-CB 3.49Å; L213-V224 VanDerWaalsContact O-CG2 3.23Å; L213-V224 WeakPolarHBondContact O-CG2 3.37Å; L213-L228 HydrophobicContact CD1-CD2 4.32Å; L213-L228 HydrophobicContact CD2-CD2 4.18Å
214	D	87.3	Confident	84.9	Confident	33 Å²	33	49 Å²	49	18%	0.176	27%	0.268	C	S	.	.			trans	-61.4	134.2	-175.9	-68.3	-1.6	0	0	0	110.8	R207 C208 Q222 R223 V224	R207-D214 WeakPolarHBondContact CA-O 3.05Å; C208-D214 HydrophobicContact CB-CB 4.26Å; C208-D214 PolarHBondContact N-O 2.81Å; C208-D214 PolarHBondContact SG-O 3.39Å; D214-Q222 WeakPolarHBondContact CA-O 3.34Å; D214-R223 VanDerWaalsContact OD1-CA 3.27Å; D214-R223 WeakPolarHBondContact OD1-CA 3.16Å; D214-R223 WeakPolarHBondContact OD1-CG 3.32Å; D214-V224 PolarHBondContact OD1-N 2.97Å
215	M	87.8	Confident	84.5	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.015	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140	-170.2	-78.1	179.9	165.2	0	0	112.6	G93 I95 I117 Q222 V224	G93-M215 VanDerWaalsContact O-CE 3.25Å; G93-M215 WeakPolarHBondContact O-CE 3.44Å; I95-M215 HydrophobicContact CG2-SD 3.57Å; I95-M215 VanDerWaalsContact CG2-SD 3.57Å; I117-M215 HydrophobicContact CD1-SD 4.04Å; I117-M215 HydrophobicContact CG1-SD 4.03Å; I117-M215 HydrophobicContact CG2-CE 3.98Å; I117-M215 HydrophobicContact CG2-SD 4.25Å; M215-Q222 PolarHBondContact N-O 3.27Å; M215-Q222 PolarHBondContact O-N 3.29Å; M215-V224 HydrophobicContact CB-CG2 4.44Å; M215-V224 HydrophobicContact CG-CG2 4.41Å
216	C	90.4	Very high	84.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.9	172.4	-69.1	0	0	0	0	110.9	P158 C159 V202 D204 G205 T206 K220	P158-C216 PolarHBondContact O-SG 2.95Å; C159-C216 WeakPolarHBondContact CA-SG 3.46Å; C159-C216 HydrophobicContact CB-CB 3.71Å; C159-C216 WeakPolarHBondContact CB-SG 3.48Å; C159-C216 WeakPolarHBondContact SG-CA 3.33Å; C159-C216 WeakPolarHBondContact SG-CB 3.43Å; C159-C216 CovalentContact SG-SG 2.03Å; C159-C216 PolarHBondContact SG-SG 3.33Å; V202-C216 HydrophobicContact CG2-CB 3.45Å; V202-C216 VanDerWaalsContact CG2-CB 3.45Å; D204-C216 CarbonylContact C-O 3.56Å; D204-C216 WeakPolarHBondContact CA-O 3.39Å; G205-C216 PolarHBondContact N-O 3.21Å; T206-C216 WeakPolarHBondContact O-CB 3.08Å; T206-C216 PolarHBondContact O-N 2.96Å; C216-K220 WeakPolarHBondContact CA-O 3.18Å
217	I	90.2	Very high	83.8	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	122.9	179.5	-48.7	-173.2	0	0	0	108.4	I95 Y115 G219 K220 Q222 I230	I95-I217 HydrophobicContact CD1-CB 4.48Å; I95-I217 HydrophobicContact CD1-CD1 4.03Å; I95-I217 HydrophobicContact CD1-CG1 3.89Å; I95-I217 HydrophobicContact CD1-CG2 4.08Å; I95-I217 HydrophobicContact CG2-CD1 4.33Å; Y115-I217 HydrophobicContact CD1-CG2 3.83Å; Y115-I217 HydrophobicContact CD2-CG2 3.64Å; Y115-I217 HydrophobicContact CE1-CG2 3.69Å; Y115-I217 HydrophobicContact CE2-CG2 3.52Å; Y115-I217 HydrophobicContact CG-CD1 4.32Å; Y115-I217 HydrophobicContact CG-CG2 3.8Å; I217-G219 VanDerWaalsContact C-N 3.26Å; I217-G219 PolarHBondContact O-N 2.94Å; I217-K220 PolarHBondContact N-O 3.36Å; I217-K220 PolarHBondContact O-N 3.28Å; I217-Q222 HydrophobicContact CB-CG 3.98Å; I217-Q222 HydrophobicContact CD1-CB 4.24Å; I217-Q222 HydrophobicContact CD1-CG 4.08Å; I217-Q222 HydrophobicContact CG1-CB 4.41Å; I217-Q222 HydrophobicContact CG1-CG 4.06Å; I217-I230 HydrophobicContact CD1-CD1 3.79Å; I217-I230 HydrophobicContact CD1-CG1 4.42Å; I217-I230 HydrophobicContact CD1-CG2 4.1Å
218	Q	85.8	Confident	83.5	Confident	117 Å²	117	52.2 Å²	52.2	55%	0.547	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	42	-173	-60.3	-177.4	-13.3	0	0	112.7	Y115 D204 K220	Y115-Q218 WeakPolarHBondContact OH-CG 3.33Å; Y115-Q218 PolarHBondContact OH-NE2 2.88Å; D204-Q218 WeakPolarHBondContact OD1-CA 3.38Å; D204-Q218 PolarHBondContact OD1-N 2.02Å; Q218-K220 PolarHBondContact O-N 2.88Å
219	G	86.8	Confident	83.2	Confident	28 Å²	28	57.8 Å²	57.8	29%	0.289	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	9.2	-177	0	0	0	0	0	115	C159 I217	C159-G219 WeakPolarHBondContact CB-O 3.34Å; I217-G219 VanDerWaalsContact C-N 3.26Å; I217-G219 PolarHBondContact O-N 2.94Å
220	K	88.3	Confident	83.2	Confident	147 Å²	147	56.3 Å²	56.3	64%	0.639	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.8	178.7	-66.9	179.2	-178.9	176	0	111	C159 C216 I217 Q218 Q222	C159-K220 VanDerWaalsContact SG-C 3.55Å; C216-K220 WeakPolarHBondContact CA-O 3.18Å; I217-K220 PolarHBondContact N-O 3.36Å; I217-K220 PolarHBondContact O-N 3.28Å; Q218-K220 PolarHBondContact O-N 2.88Å; K220-Q222 PolarHBondContact O-N 2.7Å
221	C	89.6	Confident	83.4	Confident	44 Å²	44	54.9 Å²	54.9	30%	0.297	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	116.3	175.4	-175.4	0	0	0	0	110.5	P158 C159 C208	P158-C221 HydrophobicContact CG-CB 4.07Å; C159-C221 VanDerWaalsContact SG-CA 3.57Å; C159-C221 PolarHBondContact SG-N 3.15Å; C208-C221 HydrophobicContact CB-CB 3.99Å; C208-C221 WeakPolarHBondContact CB-SG 3.5Å; C208-C221 WeakPolarHBondContact SG-CA 3.38Å; C208-C221 WeakPolarHBondContact SG-CB 3.42Å; C208-C221 CovalentContact SG-SG 2.04Å; C208-C221 PolarHBondContact SG-SG 2.8Å
222	Q	88.8	Confident	84	Confident	77 Å²	77	51.5 Å²	51.5	36%	0.36	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.7	176.4	-61.7	-65.3	-12.3	0	0	109.8	D214 M215 I217 K220 I230	D214-Q222 WeakPolarHBondContact CA-O 3.34Å; M215-Q222 PolarHBondContact N-O 3.27Å; M215-Q222 PolarHBondContact O-N 3.29Å; I217-Q222 HydrophobicContact CB-CG 3.98Å; I217-Q222 HydrophobicContact CD1-CB 4.24Å; I217-Q222 HydrophobicContact CD1-CG 4.08Å; I217-Q222 HydrophobicContact CG1-CB 4.41Å; I217-Q222 HydrophobicContact CG1-CG 4.06Å; K220-Q222 PolarHBondContact O-N 2.7Å; Q222-I230 HydrophobicContact CB-CG2 3.75Å; Q222-I230 HydrophobicContact CG-CG2 4.35Å
223	R	84.6	Confident	84	Confident	143 Å²	143	55.7 Å²	55.7	54%	0.54	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-63.6	141.1	177.6	179.5	170.5	-70.6	169.6	3.7	111.1	D214 I230 G231 S232	D214-R223 VanDerWaalsContact OD1-CA 3.27Å; D214-R223 WeakPolarHBondContact OD1-CA 3.16Å; D214-R223 WeakPolarHBondContact OD1-CG 3.32Å; R223-I230 CarbonylContact O-C 3.54Å; R223-G231 PolarHBondContact O-N 3.01Å; R223-S232 WeakPolarHBondContact CD-O 3.38Å; R223-S232 WeakPolarHBondContact CG-O 3.34Å
224	V	85.6	Confident	83.9	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.048	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-122.8	119.7	170.2	178.3	0	0	0	0	109.1	I117 L213 D214 M215 I230	I117-V224 HydrophobicContact CD1-CB 4.26Å; I117-V224 HydrophobicContact CD1-CG1 3.43Å; I117-V224 VanDerWaalsContact CD1-CG1 3.43Å; I117-V224 HydrophobicContact CD1-CG2 3.73Å; L213-V224 HydrophobicContact CB-CB 3.85Å; L213-V224 HydrophobicContact CB-CG1 3.92Å; L213-V224 VanDerWaalsContact O-CB 3.26Å; L213-V224 WeakPolarHBondContact O-CB 3.49Å; L213-V224 VanDerWaalsContact O-CG2 3.23Å; L213-V224 WeakPolarHBondContact O-CG2 3.37Å; D214-V224 PolarHBondContact OD1-N 2.97Å; M215-V224 HydrophobicContact CB-CG2 4.44Å; M215-V224 HydrophobicContact CG-CG2 4.41Å; V224-I230 HydrophobicContact CG2-CG1 4.33Å
225	G	79.3	Confident	83.2	Confident	3 Å²	3	64.5 Å²	64.5	3%	0.031	33%	0.332	C	S	.	.			trans	-72.5	162.4	174	0	0	0	0	0	111.8	D227 L228 K229 S232 K234	G225-D227 PolarHBondContact O-N 2.88Å; G225-L228 PolarHBondContact O-N 2.75Å; G225-K229 PolarHBondContact N-O 3.33Å; G225-S232 PolarHBondContact N-O 3.42Å; G225-K234 VanDerWaalsContact CA-O 3.31Å; G225-K234 WeakPolarHBondContact CA-O 3.4Å
226	C	78	Confident	82.3	Confident	24 Å²	24	69.7 Å²	69.7	16%	0.162	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-13.4	177.3	60.4	0	0	0	0	114.1	L228 K234 K235 I236 C242	C226-L228 PolarHBondContact O-N 3.19Å; C226-K234 PolarHBondContact N-O 3.08Å; C226-K234 VanDerWaalsContact SG-C 3.52Å; C226-K234 PolarHBondContact SG-O 2.81Å; C226-K235 PolarHBondContact SG-O 3.22Å; C226-K235 VanDerWaalsContact SG-O 3.39Å; C226-I236 HydrophobicContact CB-CG1 3.8Å; C226-C242 HydrophobicContact CB-CB 3.71Å; C226-C242 WeakPolarHBondContact CB-SG 3.36Å; C226-C242 PolarHBondContact O-SG 3.06Å; C226-C242 WeakPolarHBondContact SG-CA 3.29Å; C226-C242 WeakPolarHBondContact SG-CB 3.35Å; C226-C242 CovalentContact SG-SG 2.04Å; C226-C242 PolarHBondContact SG-SG 3.12Å
227	D	81.6	Confident	81.4	Confident	45 Å²	45	70.9 Å²	70.9	24%	0.241	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	19.1	172.8	72.5	-44.3	0	0	0	113.3	G225 K229 S232 K234 C242	G225-D227 PolarHBondContact O-N 2.88Å; D227-K229 VanDerWaalsContact C-N 3.26Å; D227-K229 PolarHBondContact O-N 2.94Å; D227-K229 PolarHBondContact O-NZ 3.45Å; D227-K229 IonicContact OD2-NZ 2.93Å; D227-K229 PolarHBondContact OD2-NZ 3.37Å; D227-S232 WeakPolarHBondContact OD1-CB 3.42Å; D227-S232 PolarHBondContact OD1-OG 3.23Å; D227-K234 HydrophobicContact CB-CD 4.34Å; D227-C242 PolarHBondContact N-SG 3.4Å
228	L	79	Confident	79.9	Confident	79 Å²	79	73.2 Å²	73.2	41%	0.414	39%	0.391	S	S	.	.	S	Bend	trans	56.9	32.3	173.3	-55.8	176.4	0	0	0	114.3	M120 L213 G225 C226	M120-L228 HydrophobicContact CE-CD2 3.79Å; M120-L228 HydrophobicContact CG-CD1 4.23Å; M120-L228 HydrophobicContact SD-CD2 4.37Å; L213-L228 HydrophobicContact CD1-CD2 4.32Å; L213-L228 HydrophobicContact CD2-CD2 4.18Å; G225-L228 PolarHBondContact O-N 2.75Å; C226-L228 PolarHBondContact O-N 3.19Å
229	K	80.9	Confident	79	Confident	119 Å²	119	69.1 Å²	69.1	52%	0.517	38%	0.375	S	S	.	.			trans	-111.4	127.1	176.2	-68.3	-177.3	-160.8	69.9	0	111.4	G225 D227 G231 S232	G225-K229 PolarHBondContact N-O 3.33Å; D227-K229 VanDerWaalsContact C-N 3.26Å; D227-K229 PolarHBondContact O-N 2.94Å; D227-K229 PolarHBondContact O-NZ 3.45Å; D227-K229 IonicContact OD2-NZ 2.93Å; D227-K229 PolarHBondContact OD2-NZ 3.37Å; K229-G231 PolarHBondContact O-N 2.75Å; K229-S232 WeakPolarHBondContact O-CB 3.09Å; K229-S232 PolarHBondContact O-N 3.26Å; K229-S232 VanDerWaalsContact O-N 3.08Å
230	I	83.6	Confident	77.9	Confident	51 Å²	51	70.2 Å²	70.2	26%	0.262	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-61	129.7	169.6	-53.6	164.4	0	0	0	108.1	I117 I217 Q222 R223 V224	I117-I230 HydrophobicContact CD1-CG1 4Å; I117-I230 HydrophobicContact CG1-CD1 4.01Å; I117-I230 HydrophobicContact CG1-CG1 3.78Å; I217-I230 HydrophobicContact CD1-CD1 3.79Å; I217-I230 HydrophobicContact CD1-CG1 4.42Å; I217-I230 HydrophobicContact CD1-CG2 4.1Å; Q222-I230 HydrophobicContact CB-CG2 3.75Å; Q222-I230 HydrophobicContact CG-CG2 4.35Å; R223-I230 CarbonylContact O-C 3.54Å; V224-I230 HydrophobicContact CG2-CG1 4.33Å
231	G	77.9	Confident	77.4	Confident	56 Å²	56	66.7 Å²	66.7	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	-3.3	-173.5	0	0	0	0	0	115.7	R223 K229	R223-G231 PolarHBondContact O-N 3.01Å; K229-G231 PolarHBondContact O-N 2.75Å
232	S	81.7	Confident	76.8	Confident	19 Å²	19	66.9 Å²	66.9	13%	0.133	38%	0.378	C	S	.	.			trans	-75.9	147.8	-180	179.9	0	0	0	0	113	R223 G225 D227 K229 K234	R223-S232 WeakPolarHBondContact CD-O 3.38Å; R223-S232 WeakPolarHBondContact CG-O 3.34Å; G225-S232 PolarHBondContact N-O 3.42Å; D227-S232 WeakPolarHBondContact OD1-CB 3.42Å; D227-S232 PolarHBondContact OD1-OG 3.23Å; K229-S232 WeakPolarHBondContact O-CB 3.09Å; K229-S232 PolarHBondContact O-N 3.26Å; K229-S232 VanDerWaalsContact O-N 3.08Å; S232-K234 PolarHBondContact OG-N 2.91Å
233	T	77.5	Confident	76.3	Confident	113 Å²	113	65.2 Å²	65.2	69%	0.693	38%	0.381	S	S	*	.			trans	-104.5	-1.7	-179.1	52.1	0	0	0	0	113.9
234	K	77.4	Confident	75.7	Confident	108 Å²	108	59.7 Å²	59.7	47%	0.47	37%	0.369	S	S	.	.			trans	-67.7	137.4	-178.4	-67.1	-166.6	171.1	-159.4	0	112.1	G225 C226 D227 S232	G225-K234 VanDerWaalsContact CA-O 3.31Å; G225-K234 WeakPolarHBondContact CA-O 3.4Å; C226-K234 PolarHBondContact N-O 3.08Å; C226-K234 VanDerWaalsContact SG-C 3.52Å; C226-K234 PolarHBondContact SG-O 2.81Å; D227-K234 HydrophobicContact CB-CD 4.34Å; S232-K234 PolarHBondContact OG-N 2.91Å
235	K	73.4	Confident	75.1	Confident	163 Å²	163	66.7 Å²	66.7	71%	0.709	41%	0.406	S	S	*	.			trans	-120.6	161.5	175.9	-69.1	-170.3	173.8	-167.5	0	111.2	C226 G243	C226-K235 PolarHBondContact SG-O 3.22Å; C226-K235 VanDerWaalsContact SG-O 3.39Å; K235-G243 WeakPolarHBondContact O-CA 3.44Å; K235-G243 PolarHBondContact O-N 2.82Å
236	I	67.5	Low	74.2	Confident	112 Å²	112	67.9 Å²	67.9	57%	0.574	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-72.5	141	172.3	-54.6	178.8	0	0	0	109.1	C226 V241	C226-I236 HydrophobicContact CB-CG1 3.8Å; I236-V241 WeakPolarHBondContact CA-O 3.31Å
237	D	72.2	Confident	73.6	Confident	26 Å²	26	74.1 Å²	74.1	14%	0.139	45%	0.45	C	S	.	.			trans	-90.5	178.1	177.7	80.5	-0.7	0	0	0	113.3	C239 G240 V241 G244 D245 G246	D237-C239 PolarHBondContact O-N 2.84Å; D237-C239 VanDerWaalsContact O-N 3.08Å; D237-C239 WeakPolarHBondContact OD1-CA 3.31Å; D237-C239 WeakPolarHBondContact OD1-CB 3.17Å; D237-C239 PolarHBondContact OD1-N 3.43Å; D237-G240 PolarHBondContact O-N 3.42Å; D237-G240 PolarHBondContact OD1-N 3.34Å; D237-G240 VanDerWaalsContact OD1-N 3.11Å; D237-V241 PolarHBondContact N-O 3.44Å; D237-V241 PolarHBondContact OD1-N 3.28Å; D237-G244 WeakPolarHBondContact CB-O 3.27Å; D237-G244 VanDerWaalsContact OD2-CA 3.28Å; D237-G244 WeakPolarHBondContact OD2-CA 3.44Å; D237-D245 PolarHBondContact OD2-N 3.1Å; D237-G246 WeakPolarHBondContact OD2-CA 3.47Å; D237-G246 PolarHBondContact OD2-N 2.84Å
238	G	58.4	Low	72.6	Confident	56 Å²	56	77.2 Å²	77.2	58%	0.577	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-7.8	179.5	0	0	0	0	0	115.5
239	C	66.4	Low	71.7	Confident	31 Å²	31	76 Å²	76	21%	0.209	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2.2	174.5	-60.4	0	0	0	0	112.9	D237 V241 G246 C249	D237-C239 PolarHBondContact O-N 2.84Å; D237-C239 VanDerWaalsContact O-N 3.08Å; D237-C239 WeakPolarHBondContact OD1-CA 3.31Å; D237-C239 WeakPolarHBondContact OD1-CB 3.17Å; D237-C239 PolarHBondContact OD1-N 3.43Å; C239-V241 HydrophobicContact CB-CG2 4.34Å; C239-G246 VanDerWaalsContact SG-C 3.58Å; C239-G246 PolarHBondContact SG-O 3.26Å; C239-C249 WeakPolarHBondContact CA-SG 3.44Å; C239-C249 HydrophobicContact CB-CB 3.66Å; C239-C249 WeakPolarHBondContact CB-SG 3.25Å; C239-C249 WeakPolarHBondContact SG-CB 3.36Å; C239-C249 PolarHBondContact SG-N 3.03Å; C239-C249 CovalentContact SG-SG 2.04Å; C239-C249 PolarHBondContact SG-SG 3.12Å
240	G	64.5	Low	70.7	Confident	50 Å²	50	76.4 Å²	76.4	52%	0.515	49%	0.491	S	S	.	.	S	Bend	trans	84.9	8.9	-176.2	0	0	0	0	0	114.7	D237	D237-G240 PolarHBondContact O-N 3.42Å; D237-G240 PolarHBondContact OD1-N 3.34Å; D237-G240 VanDerWaalsContact OD1-N 3.11Å
241	V	77.6	Confident	69.4	Low	74 Å²	74	79.6 Å²	79.6	45%	0.448	51%	0.505	S	S	.	.			trans	-94.9	131	-175.8	-175.7	0	0	0	0	111.1	I236 D237 C239 G243 G244	I236-V241 WeakPolarHBondContact CA-O 3.31Å; D237-V241 PolarHBondContact N-O 3.44Å; D237-V241 PolarHBondContact OD1-N 3.28Å; C239-V241 HydrophobicContact CB-CG2 4.34Å; V241-G243 PolarHBondContact O-N 3.18Å; V241-G243 VanDerWaalsContact O-N 3.13Å; V241-G244 PolarHBondContact O-N 2.92Å
242	C	77.5	Confident	68.8	Low	48 Å²	48	80.6 Å²	80.6	32%	0.324	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-68.6	109.8	178	174.6	0	0	0	0	112.6	C226 D227 G244	C226-C242 HydrophobicContact CB-CB 3.71Å; C226-C242 WeakPolarHBondContact CB-SG 3.36Å; C226-C242 PolarHBondContact O-SG 3.06Å; C226-C242 WeakPolarHBondContact SG-CA 3.29Å; C226-C242 WeakPolarHBondContact SG-CB 3.35Å; C226-C242 CovalentContact SG-SG 2.04Å; C226-C242 PolarHBondContact SG-SG 3.12Å; D227-C242 PolarHBondContact N-SG 3.4Å; C242-G244 VanDerWaalsContact C-N 3.31Å
243	G	76.7	Confident	68.2	Low	41 Å²	41	82.5 Å²	82.5	42%	0.423	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	29.5	180	0	0	0	0	0	113.5	K235 V241	K235-G243 WeakPolarHBondContact O-CA 3.44Å; K235-G243 PolarHBondContact O-N 2.82Å; V241-G243 PolarHBondContact O-N 3.18Å; V241-G243 VanDerWaalsContact O-N 3.13Å
244	G	73.1	Confident	68.4	Low	27 Å²	27	79.5 Å²	79.5	28%	0.278	49%	0.486	S	S	.	.			trans	-85.7	174.8	170.6	0	0	0	0	0	113.1	D237 V241 C242	D237-G244 WeakPolarHBondContact CB-O 3.27Å; D237-G244 VanDerWaalsContact OD2-CA 3.28Å; D237-G244 WeakPolarHBondContact OD2-CA 3.44Å; V241-G244 PolarHBondContact O-N 2.92Å; C242-G244 VanDerWaalsContact C-N 3.31Å
245	D	71.9	Confident	68.7	Low	155 Å²	155	76.2 Å²	76.2	83%	0.829	47%	0.474	S	S	*	.			trans	-99.2	6.4	-173.8	-57.4	-60.5	0	0	0	113.8	D237 N247	D237-D245 PolarHBondContact OD2-N 3.1Å; D245-N247 PolarHBondContact O-N 3.17Å
246	G	61.7	Low	69.3	Low	28 Å²	28	69.9 Å²	69.9	29%	0.289	45%	0.446	S	S	.	.	S	Bend	trans	71.4	-4.5	174.8	0	0	0	0	0	117	D237 C239	D237-G246 WeakPolarHBondContact OD2-CA 3.47Å; D237-G246 PolarHBondContact OD2-N 2.84Å; C239-G246 VanDerWaalsContact SG-C 3.58Å; C239-G246 PolarHBondContact SG-O 3.26Å
247	N	64.4	Low	70.2	Confident	156 Å²	156	67.5 Å²	67.5	83%	0.834	43%	0.432	S	S	*	.			trans	-92.1	2.4	-177.7	-82.6	-0.6	0	0	0	114.7	D245	D245-N247 PolarHBondContact O-N 3.17Å
248	S	60.4	Low	70.7	Confident	109 Å²	109	69.8 Å²	69.8	76%	0.762	44%	0.443	S	S	*	.	S	Bend	trans	-93.4	-6.2	-169.3	-57	0	0	0	0	115.5
249	C	60.7	Low	71.8	Confident	53 Å²	53	68 Å²	68	36%	0.358	42%	0.422	S	S	.	.			trans	-109.8	138.6	-177.7	50.2	0	0	0	0	111.7	C239	C239-C249 WeakPolarHBondContact CA-SG 3.44Å; C239-C249 HydrophobicContact CB-CB 3.66Å; C239-C249 WeakPolarHBondContact CB-SG 3.25Å; C239-C249 WeakPolarHBondContact SG-CB 3.36Å; C239-C249 PolarHBondContact SG-N 3.03Å; C239-C249 CovalentContact SG-SG 2.04Å; C239-C249 PolarHBondContact SG-SG 3.12Å
250	S	59	Low	72.6	Confident	129 Å²	129	72.3 Å²	72.3	90%	0.902	45%	0.45	S	S	*	.	S	Bend	trans	-77.5	-22.7	-177.5	53.2	0	0	0	0	114
251	Q	58.1	Low	73.3	Confident	118 Å²	118	73.2 Å²	73.2	55%	0.551	44%	0.442	S	S	*	.	S	Bend	trans	-145.6	144.7	172.6	-63.1	-176.3	-11.7	0	0	108.5	R282	Q251-R282 VanDerWaalsContact OE1-CZ 3.3Å
252	P	64	Low	73.5	Confident	76 Å²	76	72.1 Å²	72.1	49%	0.494	44%	0.438	S	S	.	.			trans	-69	151.7	175.5	30.1	-35.3	0	0	0	111.3	F254	P252-F254 VanDerWaalsContact C-N 3.34Å
253	L	70.7	Confident	73.7	Confident	59 Å²	59	78.6 Å²	78.6	31%	0.309	46%	0.463	S	S	.	.	S	Bend	trans	-69.8	-32.3	176.5	178.3	59.1	0	0	0	112.5	N281 R282 L283	L253-N281 WeakPolarHBondContact CD1-OD1 3.43Å; L253-R282 WeakPolarHBondContact O-CB 3.41Å; L253-R282 WeakPolarHBondContact O-CG 3.35Å; L253-R282 PolarHBondContact O-N 3.33Å; L253-L283 HydrophobicContact CD1-CB 4.34Å; L253-L283 HydrophobicContact CD1-CD1 3.63Å; L253-L283 HydrophobicContact CD1-CG 3.78Å
254	F	80	Confident	74	Confident	50 Å²	50	78.2 Å²	78.2	22%	0.219	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.3	-178.9	-49.2	-72.7	0	0	0	110.8	P252 R280 N281 V288 L292	P252-F254 VanDerWaalsContact C-N 3.34Å; F254-R280 CarbonylContact C-O 3.56Å; F254-R280 VanDerWaalsContact CA-O 3.24Å; F254-R280 WeakPolarHBondContact CA-O 3.49Å; F254-N281 HydrophobicContact CD1-CB 3.89Å; F254-N281 HydrophobicContact CE1-CB 3.91Å; F254-V288 HydrophobicContact CD1-CG2 3.75Å; F254-V288 HydrophobicContact CE1-CG1 4.49Å; F254-V288 HydrophobicContact CE1-CG2 4.12Å; F254-L292 HydrophobicContact CD1-CB 4.46Å; F254-L292 HydrophobicContact CD2-CB 3.91Å; F254-L292 WeakPolarHBondContact CD2-O 3.4Å; F254-L292 HydrophobicContact CE1-CD1 4.37Å; F254-L292 HydrophobicContact CE2-CB 4.15Å; F254-L292 HydrophobicContact CE2-CD2 4.43Å; F254-L292 HydrophobicContact CG-CB 4.08Å; F254-L292 HydrophobicContact CZ-CD1 4.25Å
255	N	84.7	Confident	74.4	Confident	39 Å²	39	80.9 Å²	80.9	21%	0.209	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.5	176.9	62.9	-44.5	0	0	0	111.6	E257 R280 R282 C293	N255-E257 WeakPolarHBondContact ND2-CG 3.09Å; N255-E257 PolarHBondContact ND2-OE1 2.94Å; N255-R280 PolarHBondContact N-O 2.83Å; N255-R280 PolarHBondContact O-N 3.48Å; N255-R280 PolarHBondContact OD1-O 2.85Å; N255-R282 HydrophobicContact CB-CG 4.2Å; N255-R282 WeakPolarHBondContact OD1-CG 3.46Å; N255-C293 VanDerWaalsContact C-SG 3.51Å; N255-C293 PolarHBondContact O-SG 3.45Å
256	W	85.8	Confident	74.6	Confident	30 Å²	30	76.8 Å²	76.8	11%	0.114	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	129.2	163.9	-65.1	105.4	0	0	0	109.7	P277 I278 C279 D290 C293 S294 N297 R298 P299	W256-P277 HydrophobicContact CE3-CB 4Å; W256-I278 WeakPolarHBondContact CA-O 3.49Å; W256-I278 VanDerWaalsContact CE3-C 3.5Å; W256-C279 HydrophobicContact CE3-CB 4.25Å; W256-C279 HydrophobicContact CH2-CB 4.3Å; W256-C279 HydrophobicContact CZ3-CB 3.97Å; W256-D290 HydrophobicContact CH2-CB 4.12Å; W256-D290 WeakPolarHBondContact CH2-OD1 3.36Å; W256-D290 VanDerWaalsContact CZ3-OD1 3.31Å; W256-D290 WeakPolarHBondContact CZ3-OD1 3.33Å; W256-C293 HydrophobicContact CD2-CB 3.95Å; W256-C293 VanDerWaalsContact CE2-CB 3.44Å; W256-C293 HydrophobicContact CG-CB 4.36Å; W256-C293 HydrophobicContact CH2-CB 4.26Å; W256-C293 HydrophobicContact CZ2-CB 3.62Å; W256-S294 PolarHBondContact NE1-O 2.86Å; W256-N297 VanDerWaalsContact CD1-C 3.46Å; W256-N297 VanDerWaalsContact CD1-O 3.22Å; W256-R298 HydrophobicContact CD2-CB 4.2Å; W256-R298 HydrophobicContact CD2-CG 3.96Å; W256-R298 HydrophobicContact CE3-CG 4.12Å; W256-R298 HydrophobicContact CH2-CG 4.13Å; W256-R298 HydrophobicContact CZ2-CB 4.02Å; W256-R298 HydrophobicContact CZ2-CG 3.93Å; W256-R298 HydrophobicContact CZ3-CG 4.21Å; W256-P299 VanDerWaalsContact CB-CD 3.41Å; W256-P299 HydrophobicContact CB-CG 4.05Å
257	E	85.9	Confident	75.3	Confident	62 Å²	62	81 Å²	81	29%	0.29	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	153.8	167.4	-59.8	-166.2	165.8	0	0	109.2	N255 P277 I278 R280	N255-E257 WeakPolarHBondContact ND2-CG 3.09Å; N255-E257 PolarHBondContact ND2-OE1 2.94Å; E257-P277 CarbonylContact O-C 3.56Å; E257-P277 WeakPolarHBondContact O-CA 3.05Å; E257-I278 PolarHBondContact N-O 2.02Å; E257-I278 PolarHBondContact O-N 3.25Å; E257-R280 HydrophobicContact CG-CB 4.32Å; E257-R280 WeakPolarHBondContact OE2-CD 3.49Å; E257-R280 IonicContact OE2-CZ 2.68Å; E257-R280 IonicContact OE2-NE 3.36Å; E257-R280 IonicContact OE2-NH1 2.7Å; E257-R280 PolarHBondContact OE2-NH1 2.85Å
258	M	82.3	Confident	75.7	Confident	75 Å²	75	74.6 Å²	74.6	37%	0.369	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.9	173.4	-69.3	-63.5	-78.2	0	0	108.7	P277 P299 S302	M258-P277 HydrophobicContact SD-CB 4.2Å; M258-P299 HydrophobicContact SD-CB 3.74Å; M258-P299 HydrophobicContact SD-CG 4.25Å; M258-S302 WeakPolarHBondContact CE-OG 3.03Å
259	A	82	Confident	76	Confident	17 Å²	17	70.1 Å²	70.1	14%	0.14	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-55.8	156.7	175.8	0	0	0	0	0	111.6	M261 S275 R276 I278	A259-M261 PolarHBondContact O-N 2.96Å; A259-S275 PolarHBondContact N-OG 2.89Å; A259-S275 WeakPolarHBondContact O-CB 3.42Å; A259-S275 PolarHBondContact O-OG 3.14Å; A259-R276 HydrophobicContact CB-CG 3.94Å; A259-R276 VanDerWaalsContact CB-O 3.31Å; A259-R276 WeakPolarHBondContact CB-O 2.99Å; A259-R276 PolarHBondContact N-O 2.83Å; A259-I278 HydrophobicContact CB-CD1 3.67Å; A259-I278 HydrophobicContact CB-CG1 4.08Å
260	P	83.1	Confident	76.5	Confident	123 Å²	123	68.5 Å²	68.5	80%	0.799	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-48.4	141.3	159.8	-24.9	35	0	0	0	110.6	S262	P260-S262 PolarHBondContact O-N 2.88Å
261	M	80.1	Confident	77.4	Confident	69 Å²	69	62.4 Å²	62.4	34%	0.34	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-60.2	136.7	176.3	-77.5	-77.7	172	0	0	110.2	A259 K273 S302 E304	A259-M261 PolarHBondContact O-N 2.96Å; M261-K273 HydrophobicContact CB-CD 4.17Å; M261-K273 HydrophobicContact CG-CD 4.31Å; M261-K273 HydrophobicContact SD-CD 4.17Å; M261-K273 HydrophobicContact SD-CG 4.27Å; M261-S302 WeakPolarHBondContact CE-OG 3.02Å; M261-E304 HydrophobicContact CE-CG 4.28Å; M261-E304 WeakPolarHBondContact CE-OE1 3.38Å
262	S	80.6	Confident	78.5	Confident	51 Å²	51	62.8 Å²	62.8	36%	0.357	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-57.8	160	171.6	76.5	0	0	0	0	111.4	P260 K273 M274	P260-S262 PolarHBondContact O-N 2.88Å; S262-K273 WeakPolarHBondContact O-CB 3.45Å; S262-K273 WeakPolarHBondContact OG-CA 3.29Å; S262-M274 PolarHBondContact N-O 2.84Å; S262-M274 PolarHBondContact OG-N 3.16Å
263	Q	82	Confident	79.3	Confident	183 Å²	183	61.8 Å²	61.8	86%	0.855	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-56.5	154.9	160.6	-62.6	-176	4	0	0	110.1
264	C	82.9	Confident	79.8	Confident	33 Å²	33	64 Å²	64	22%	0.223	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-73.9	132.3	179.9	-166.9	0	0	0	0	110.5	V266 C306 N307	C264-V266 PolarHBondContact O-N 2.97Å; C264-V266 PolarHBondContact SG-O 2.99Å; C264-V266 VanDerWaalsContact SG-O 3.36Å; C264-C306 VanDerWaalsContact CA-SG 3.55Å; C264-C306 HydrophobicContact CB-CB 3.91Å; C264-C306 WeakPolarHBondContact CB-SG 3.38Å; C264-C306 VanDerWaalsContact SG-C 3.56Å; C264-C306 WeakPolarHBondContact SG-CB 3.35Å; C264-C306 CovalentContact SG-SG 2.03Å; C264-C306 PolarHBondContact SG-SG 3.07Å; C264-N307 WeakPolarHBondContact CB-ND2 3.11Å; C264-N307 PolarHBondContact SG-ND2 2.56Å
265	S	82.6	Confident	80	Confident	84 Å²	84	61.8 Å²	61.8	59%	0.587	34%	0.34	S	S	*	.	S	Bend	trans	-64.4	-13.5	-173.1	59	0	0	0	0	116.1	Y272	S265-Y272 WeakPolarHBondContact CB-O 3.44Å; S265-Y272 PolarHBondContact N-O 2.76Å; S265-Y272 PolarHBondContact OG-N 2.92Å; S265-Y272 PolarHBondContact OG-O 3.04Å
266	V	74.9	Confident	80	Confident	69 Å²	69	66.9 Å²	66.9	42%	0.418	36%	0.356	S	S	.	.	S	Bend	trans	-143.7	153.3	165.6	-72.2	0	0	0	0	110.1	C264 C268 N307	C264-V266 PolarHBondContact O-N 2.97Å; C264-V266 PolarHBondContact SG-O 2.99Å; C264-V266 VanDerWaalsContact SG-O 3.36Å; V266-C268 WeakPolarHBondContact CG2-O 3.09Å; V266-N307 WeakPolarHBondContact O-CB 3.46Å; V266-N307 PolarHBondContact O-ND2 2.87Å
267	T	76.2	Confident	80	Confident	117 Å²	117	66 Å²	66	72%	0.718	35%	0.354	S	S	*	.	S	Bend	trans	-75.6	-22.2	179.5	47.8	0	0	0	0	113.9	N307 H309	T267-N307 WeakPolarHBondContact O-CB 3.03Å; T267-N307 PolarHBondContact O-ND2 3.37Å; T267-H309 PolarHBondContact O-CE1 3.49Å; T267-H309 PolarHBondContact O-NE2 3Å
268	C	73.9	Confident	80.1	Confident	21 Å²	21	63.9 Å²	63.9	14%	0.142	35%	0.345	C	S	.	.	S	Bend	trans	-153.5	169.4	179.4	59.2	0	0	0	0	109.9	V266 N307 H309 C311	V266-C268 WeakPolarHBondContact CG2-O 3.09Å; C268-N307 CarbonylContact C-O 3.44Å; C268-H309 VanDerWaalsContact CB-NE2 3.31Å; C268-H309 WeakPolarHBondContact CB-NE2 3.31Å; C268-C311 HydrophobicContact CB-CB 3.95Å; C268-C311 WeakPolarHBondContact CB-SG 3.48Å; C268-C311 PolarHBondContact O-SG 3.48Å; C268-C311 WeakPolarHBondContact SG-CA 3.47Å; C268-C311 WeakPolarHBondContact SG-CB 3.49Å; C268-C311 CovalentContact SG-SG 2.04Å; C268-C311 PolarHBondContact SG-SG 2.9Å
269	G	67.6	Low	80.2	Confident	15 Å²	15	60.3 Å²	60.3	16%	0.155	33%	0.327	C	S	.	.	S	Bend	trans	84.1	19.1	169.7	0	0	0	0	0	116	N307 H309	G269-N307 PolarHBondContact N-O 3.26Å; G269-N307 VanDerWaalsContact N-O 3.17Å; G269-H309 PolarHBondContact N-O 2.92Å
270	S	69.9	Low	80.3	Confident	19 Å²	19	63 Å²	63	13%	0.133	33%	0.334	C	S	.	.	S	Bend	trans	74.4	81	-179.3	-58.3	0	0	0	0	114.8	N307 N343	S270-N307 PolarHBondContact N-O 2.92Å; S270-N343 WeakPolarHBondContact CB-OD1 3.29Å; S270-N343 PolarHBondContact OG-OD1 3.21Å
271	G	77.9	Confident	80.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-176.3	171.7	0	0	0	0	0	114.1	Q305 C306	G271-Q305 WeakPolarHBondContact O-CA 3.42Å; G271-Q305 VanDerWaalsContact O-CG 3.24Å; G271-Q305 WeakPolarHBondContact O-CG 2.97Å; G271-C306 CarbonylContact C-O 3.58Å; G271-C306 PolarHBondContact N-O 3.47Å; G271-C306 PolarHBondContact O-N 3.07Å
272	Y	81.2	Confident	80	Confident	126 Å²	126	60.3 Å²	60.3	49%	0.494	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	142.5	178.3	-58	-83.2	0	0	0	110.6	S265 V303 E304 Q305	S265-Y272 WeakPolarHBondContact CB-O 3.44Å; S265-Y272 PolarHBondContact N-O 2.76Å; S265-Y272 PolarHBondContact OG-N 2.92Å; S265-Y272 PolarHBondContact OG-O 3.04Å; Y272-V303 HydrophobicContact CD1-CG1 4.15Å; Y272-V303 HydrophobicContact CG-CG1 4.46Å; Y272-E304 WeakPolarHBondContact CA-O 3.07Å; Y272-Q305 HydrophobicContact CD1-CB 4.39Å; Y272-Q305 HydrophobicContact CD1-CG 4.24Å; Y272-Q305 HydrophobicContact CE1-CB 4.36Å; Y272-Q305 HydrophobicContact CE1-CG 3.97Å
273	K	81.3	Confident	79.7	Confident	54 Å²	54	65 Å²	65	24%	0.235	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.5	166.9	54.5	170.8	176.7	139.8	0	108.6	M261 S262 V303 E304 C306	M261-K273 HydrophobicContact CB-CD 4.17Å; M261-K273 HydrophobicContact CG-CD 4.31Å; M261-K273 HydrophobicContact SD-CD 4.17Å; M261-K273 HydrophobicContact SD-CG 4.27Å; S262-K273 WeakPolarHBondContact O-CB 3.45Å; S262-K273 WeakPolarHBondContact OG-CA 3.29Å; K273-V303 WeakPolarHBondContact O-CA 3.27Å; K273-E304 HydrophobicContact CD-CB 4.47Å; K273-E304 WeakPolarHBondContact CE-OE2 3.03Å; K273-E304 HydrophobicContact CG-CB 4.01Å; K273-E304 WeakPolarHBondContact CG-O 3.03Å; K273-E304 PolarHBondContact N-O 2.83Å; K273-E304 IonicContact NZ-OE2 2.76Å; K273-E304 PolarHBondContact NZ-OE2 3.21Å; K273-E304 PolarHBondContact O-N 2.91Å; K273-C306 HydrophobicContact CD-CB 4.42Å; K273-C306 HydrophobicContact CG-CB 4.19Å; K273-C306 PolarHBondContact N-SG 3.1Å; K273-C306 VanDerWaalsContact N-SG 3.36Å
274	M	81.9	Confident	79.5	Confident	106 Å²	106	60.6 Å²	60.6	52%	0.522	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147.8	-176.3	61.1	-176.9	-70	0	0	112.4	S262 S302 V303	S262-M274 PolarHBondContact N-O 2.84Å; S262-M274 PolarHBondContact OG-N 3.16Å; M274-S302 CarbonylContact C-O 3.59Å; M274-S302 VanDerWaalsContact CA-O 3.28Å; M274-S302 WeakPolarHBondContact CA-O 3.45Å; M274-V303 HydrophobicContact CB-CG2 4.11Å
275	S	82.6	Confident	78.9	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.1	169.5	173.3	0	0	0	0	109.6	A259 A301 S302	A259-S275 PolarHBondContact N-OG 2.89Å; A259-S275 WeakPolarHBondContact O-CB 3.42Å; A259-S275 PolarHBondContact O-OG 3.14Å; S275-A301 CarbonylContact O-C 3.57Å; S275-A301 WeakPolarHBondContact O-CA 3.33Å; S275-A301 WeakPolarHBondContact O-CB 3.39Å; S275-S302 PolarHBondContact N-O 2.91Å; S275-S302 PolarHBondContact O-N 2.95Å; S275-S302 VanDerWaalsContact O-N 3.07Å
276	R	85.1	Confident	78.4	Confident	146 Å²	146	61.7 Å²	61.7	55%	0.551	32%	0.315	S	S	*	.			trans	-104.2	145.9	178.2	64.8	-179.4	177.7	94.7	2	110.5	A259 I278	A259-R276 HydrophobicContact CB-CG 3.94Å; A259-R276 VanDerWaalsContact CB-O 3.31Å; A259-R276 WeakPolarHBondContact CB-O 2.99Å; A259-R276 PolarHBondContact N-O 2.83Å; R276-I278 HydrophobicContact CG-CG1 4.18Å
277	P	85.7	Confident	78.7	Confident	11 Å²	11	62.8 Å²	62.8	7%	0.071	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.4	167	30.9	-37.4	0	0	0	110.6	W256 E257 M258 R298 P299	W256-P277 HydrophobicContact CE3-CB 4Å; E257-P277 CarbonylContact O-C 3.56Å; E257-P277 WeakPolarHBondContact O-CA 3.05Å; M258-P277 HydrophobicContact SD-CB 4.2Å; P277-R298 HydrophobicContact CB-CG 4.08Å; P277-R298 HydrophobicContact CG-CG 3.95Å; P277-P299 HydrophobicContact CB-CB 4.45Å; P277-P299 HydrophobicContact CB-CG 4.44Å; P277-P299 WeakPolarHBondContact CG-O 3.48Å
278	I	88.9	Confident	78.9	Confident	19 Å²	19	59.2 Å²	59.2	10%	0.097	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.5	177.3	-55.1	-170.4	0	0	0	108.7	W256 E257 A259 R276 D287	W256-I278 WeakPolarHBondContact CA-O 3.49Å; W256-I278 VanDerWaalsContact CE3-C 3.5Å; E257-I278 PolarHBondContact N-O 2.02Å; E257-I278 PolarHBondContact O-N 3.25Å; A259-I278 HydrophobicContact CB-CD1 3.67Å; A259-I278 HydrophobicContact CB-CG1 4.08Å; R276-I278 HydrophobicContact CG-CG1 4.18Å; I278-D287 HydrophobicContact CG2-CB 4.03Å; I278-D287 WeakPolarHBondContact CG2-OD2 3.47Å
279	C	84.9	Confident	79.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.9	170.3	-176.5	0	0	0	0	110.3	W256 V288 C293	W256-C279 HydrophobicContact CE3-CB 4.25Å; W256-C279 HydrophobicContact CH2-CB 4.3Å; W256-C279 HydrophobicContact CZ3-CB 3.97Å; C279-V288 HydrophobicContact CB-CG2 4.34Å; C279-V288 PolarHBondContact O-N 3.31Å; C279-V288 VanDerWaalsContact SG-CG2 3.57Å; C279-C293 WeakPolarHBondContact CA-SG 3.02Å; C279-C293 HydrophobicContact CB-CB 3.75Å; C279-C293 WeakPolarHBondContact CB-SG 3.44Å; C279-C293 WeakPolarHBondContact SG-CB 3.45Å; C279-C293 PolarHBondContact SG-N 3.38Å; C279-C293 CovalentContact SG-SG 2.03Å; C279-C293 PolarHBondContact SG-SG 2.84Å
280	R	84.3	Confident	79.5	Confident	74 Å²	74	64.9 Å²	64.9	28%	0.279	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.8	-173.8	-150.2	179.3	-166.3	-178.2	1.6	112.2	F254 N255 E257 N285 A286 D287	F254-R280 CarbonylContact C-O 3.56Å; F254-R280 VanDerWaalsContact CA-O 3.24Å; F254-R280 WeakPolarHBondContact CA-O 3.49Å; N255-R280 PolarHBondContact N-O 2.83Å; N255-R280 PolarHBondContact O-N 3.48Å; N255-R280 PolarHBondContact OD1-O 2.85Å; E257-R280 HydrophobicContact CG-CB 4.32Å; E257-R280 WeakPolarHBondContact OE2-CD 3.49Å; E257-R280 IonicContact OE2-CZ 2.68Å; E257-R280 IonicContact OE2-NE 3.36Å; E257-R280 IonicContact OE2-NH1 2.7Å; E257-R280 PolarHBondContact OE2-NH1 2.85Å; R280-N285 PolarHBondContact NE-O 3.38Å; R280-N285 PolarHBondContact NH2-O 2.78Å; R280-A286 WeakPolarHBondContact CG-O 3.48Å; R280-D287 IonicContact NE-OD1 3.83Å
281	N	79.4	Confident	79.7	Confident	24 Å²	24	69.6 Å²	69.6	13%	0.128	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121	174.5	-179.5	-20.6	0	0	0	110.9	L253 F254 L283 T284 N285 A286 V288	L253-N281 WeakPolarHBondContact CD1-OD1 3.43Å; F254-N281 HydrophobicContact CD1-CB 3.89Å; F254-N281 HydrophobicContact CE1-CB 3.91Å; N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 2.79Å; N281-L283 PolarHBondContact OD1-N 3.25Å; N281-T284 WeakPolarHBondContact CB-OG1 3.46Å; N281-T284 PolarHBondContact ND2-OG1 3.32Å; N281-T284 PolarHBondContact O-N 3.29Å; N281-N285 WeakPolarHBondContact O-CA 3.41Å; N281-N285 PolarHBondContact O-N 2.91Å; N281-A286 PolarHBondContact N-O 3.11Å; N281-V288 HydrophobicContact CB-CG1 4.16Å
282	R	76.5	Confident	79.6	Confident	111 Å²	111	73.8 Å²	73.8	42%	0.419	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13	-174.4	-64.4	-175.1	67.3	-130.3	0.7	115.6	Q251 L253 N255	Q251-R282 VanDerWaalsContact OE1-CZ 3.3Å; L253-R282 WeakPolarHBondContact O-CB 3.41Å; L253-R282 WeakPolarHBondContact O-CG 3.35Å; L253-R282 PolarHBondContact O-N 3.33Å; N255-R282 HydrophobicContact CB-CG 4.2Å; N255-R282 WeakPolarHBondContact OD1-CG 3.46Å
283	L	73.6	Confident	79.6	Confident	148 Å²	148	68 Å²	68	78%	0.775	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-25.6	176.6	-68.6	179.7	0	0	0	113.1	L253 N281	L253-L283 HydrophobicContact CD1-CB 4.34Å; L253-L283 HydrophobicContact CD1-CD1 3.63Å; L253-L283 HydrophobicContact CD1-CG 3.78Å; N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 2.79Å; N281-L283 PolarHBondContact OD1-N 3.25Å
284	T	77.4	Confident	79.4	Confident	91 Å²	91	68.5 Å²	68.5	56%	0.558	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-10.7	-174.9	61.4	0	0	0	0	114	N281 A286	N281-T284 WeakPolarHBondContact CB-OG1 3.46Å; N281-T284 PolarHBondContact ND2-OG1 3.32Å; N281-T284 PolarHBondContact O-N 3.29Å; T284-A286 PolarHBondContact O-N 2.94Å; T284-A286 WeakPolarHBondContact OG1-CB 3.29Å; T284-A286 PolarHBondContact OG1-N 3.01Å
285	N	72.3	Confident	79	Confident	95 Å²	95	68.8 Å²	68.8	51%	0.508	37%	0.367	S	S	.	.			trans	52.5	19.8	-169.5	-74.1	-18.7	0	0	0	114.2	R280 N281	R280-N285 PolarHBondContact NE-O 3.38Å; R280-N285 PolarHBondContact NH2-O 2.78Å; N281-N285 WeakPolarHBondContact O-CA 3.41Å; N281-N285 PolarHBondContact O-N 2.91Å
286	A	71.2	Confident	78.4	Confident	45 Å²	45	74.3 Å²	74.3	37%	0.372	40%	0.401	S	S	.	.			trans	-83.2	139	172.8	0	0	0	0	0	110.5	R280 N281 T284	R280-A286 WeakPolarHBondContact CG-O 3.48Å; N281-A286 PolarHBondContact N-O 3.11Å; T284-A286 PolarHBondContact O-N 2.94Å; T284-A286 WeakPolarHBondContact OG1-CB 3.29Å; T284-A286 PolarHBondContact OG1-N 3.01Å
287	D	80.3	Confident	77.8	Confident	92 Å²	92	72.9 Å²	72.9	49%	0.492	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-69.9	139.3	168.9	-66.5	5.4	0	0	0	108.9	I278 R280	I278-D287 HydrophobicContact CG2-CB 4.03Å; I278-D287 WeakPolarHBondContact CG2-OD2 3.47Å; R280-D287 IonicContact NE-OD1 3.83Å
288	V	81.1	Confident	77.7	Confident	42 Å²	42	77.4 Å²	77.4	26%	0.255	42%	0.42	S	S	.	.			trans	-137.3	171	-176.6	-57.6	0	0	0	0	111.2	F254 C279 N281 D290 L292	F254-V288 HydrophobicContact CD1-CG2 3.75Å; F254-V288 HydrophobicContact CE1-CG1 4.49Å; F254-V288 HydrophobicContact CE1-CG2 4.12Å; C279-V288 HydrophobicContact CB-CG2 4.34Å; C279-V288 PolarHBondContact O-N 3.31Å; C279-V288 VanDerWaalsContact SG-CG2 3.57Å; N281-V288 HydrophobicContact CB-CG1 4.16Å; V288-D290 PolarHBondContact O-N 3.1Å; V288-L292 HydrophobicContact CB-CD1 3.98Å; V288-L292 HydrophobicContact CG2-CB 4.26Å; V288-L292 HydrophobicContact CG2-CD1 3.94Å
289	D	77.9	Confident	77.4	Confident	95 Å²	95	78.8 Å²	78.8	51%	0.508	43%	0.43	S	S	.	.			trans	-58.5	136.3	-177.7	-176.4	-90	0	0	0	113.1	T291 L292	D289-T291 PolarHBondContact O-N 3.41Å; D289-T291 WeakPolarHBondContact OD1-CB 3.14Å; D289-T291 VanDerWaalsContact OD1-CG2 3.31Å; D289-T291 WeakPolarHBondContact OD1-CG2 3.36Å; D289-T291 PolarHBondContact OD1-N 3.4Å; D289-T291 PolarHBondContact OD1-OG1 2.98Å; D289-L292 WeakPolarHBondContact O-CB 3.09Å; D289-L292 PolarHBondContact O-N 2.03Å
290	D	77	Confident	76.9	Confident	61 Å²	61	87.6 Å²	87.6	33%	0.326	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-52	-26	-179	-99.6	14.9	0	0	0	114	W256 V288 L292 R298	W256-D290 HydrophobicContact CH2-CB 4.12Å; W256-D290 WeakPolarHBondContact CH2-OD1 3.36Å; W256-D290 VanDerWaalsContact CZ3-OD1 3.31Å; W256-D290 WeakPolarHBondContact CZ3-OD1 3.33Å; V288-D290 PolarHBondContact O-N 3.1Å; D290-L292 VanDerWaalsContact C-N 3.3Å; D290-L292 PolarHBondContact O-N 2.82Å; D290-R298 IonicContact OD1-NH2 3.88Å; D290-R298 PolarHBondContact OD1-NH2 3.19Å; D290-R298 IonicContact OD2-CZ 2.68Å; D290-R298 IonicContact OD2-NH1 3.12Å; D290-R298 PolarHBondContact OD2-NH1 2.77Å; D290-R298 IonicContact OD2-NH2 3.64Å; D290-R298 PolarHBondContact OD2-NH2 2.83Å
291	T	74.2	Confident	76.7	Confident	118 Å²	118	86.8 Å²	86.8	72%	0.724	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-76.2	-12.8	179.4	67.3	0	0	0	0	114.3	D289	D289-T291 PolarHBondContact O-N 3.41Å; D289-T291 WeakPolarHBondContact OD1-CB 3.14Å; D289-T291 VanDerWaalsContact OD1-CG2 3.31Å; D289-T291 WeakPolarHBondContact OD1-CG2 3.36Å; D289-T291 PolarHBondContact OD1-N 3.4Å; D289-T291 PolarHBondContact OD1-OG1 2.98Å
292	L	74.8	Confident	76.9	Confident	88 Å²	88	87.6 Å²	87.6	46%	0.461	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-82.6	-18.2	176.4	-62.5	173.7	0	0	0	112.7	F254 V288 D289 D290	F254-L292 HydrophobicContact CD1-CB 4.46Å; F254-L292 HydrophobicContact CD2-CB 3.91Å; F254-L292 WeakPolarHBondContact CD2-O 3.4Å; F254-L292 HydrophobicContact CE1-CD1 4.37Å; F254-L292 HydrophobicContact CE2-CB 4.15Å; F254-L292 HydrophobicContact CE2-CD2 4.43Å; F254-L292 HydrophobicContact CG-CB 4.08Å; F254-L292 HydrophobicContact CZ-CD1 4.25Å; V288-L292 HydrophobicContact CB-CD1 3.98Å; V288-L292 HydrophobicContact CG2-CB 4.26Å; V288-L292 HydrophobicContact CG2-CD1 3.94Å; D289-L292 WeakPolarHBondContact O-CB 3.09Å; D289-L292 PolarHBondContact O-N 2.03Å; D290-L292 VanDerWaalsContact C-N 3.3Å; D290-L292 PolarHBondContact O-N 2.82Å
293	C	80.9	Confident	77.1	Confident	5 Å²	5	86.7 Å²	86.7	3%	0.034	50%	0.495	C	S	.	.	S	Bend	trans	-97.5	146.4	173.6	-71.4	0	0	0	0	111.9	N255 W256 C279 V295	N255-C293 VanDerWaalsContact C-SG 3.51Å; N255-C293 PolarHBondContact O-SG 3.45Å; W256-C293 HydrophobicContact CD2-CB 3.95Å; W256-C293 VanDerWaalsContact CE2-CB 3.44Å; W256-C293 HydrophobicContact CG-CB 4.36Å; W256-C293 HydrophobicContact CH2-CB 4.26Å; W256-C293 HydrophobicContact CZ2-CB 3.62Å; C279-C293 WeakPolarHBondContact CA-SG 3.02Å; C279-C293 HydrophobicContact CB-CB 3.75Å; C279-C293 WeakPolarHBondContact CB-SG 3.44Å; C279-C293 WeakPolarHBondContact SG-CB 3.45Å; C279-C293 PolarHBondContact SG-N 3.38Å; C279-C293 CovalentContact SG-SG 2.03Å; C279-C293 PolarHBondContact SG-SG 2.84Å; C293-V295 PolarHBondContact O-N 3.23Å; C293-V295 VanDerWaalsContact O-N 3.15Å
294	S	76.8	Confident	77.4	Confident	65 Å²	65	83.9 Å²	83.9	46%	0.455	48%	0.477	S	S	.	.			trans	-68.7	116.1	178.8	-170	0	0	0	0	111.5	W256 T296 N297	W256-S294 PolarHBondContact NE1-O 2.86Å; S294-T296 PolarHBondContact O-N 3.09Å; S294-T296 VanDerWaalsContact O-N 3.13Å; S294-T296 PolarHBondContact OG-OG1 3.17Å; S294-N297 PolarHBondContact O-N 3.07Å
295	V	73.2	Confident	77.4	Confident	112 Å²	112	84.6 Å²	84.6	68%	0.679	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-55.7	-30.5	179	-177.3	0	0	0	0	112.4	C293 N297 R298	C293-V295 PolarHBondContact O-N 3.23Å; C293-V295 VanDerWaalsContact O-N 3.15Å; V295-N297 PolarHBondContact O-N 3.48Å; V295-R298 PolarHBondContact O-N 3.05Å
296	T	71.4	Confident	77.7	Confident	118 Å²	118	80.9 Å²	80.9	72%	0.724	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-62.3	-23	177	57.3	0	0	0	0	114.2	S294	S294-T296 PolarHBondContact O-N 3.09Å; S294-T296 VanDerWaalsContact O-N 3.13Å; S294-T296 PolarHBondContact OG-OG1 3.17Å
297	N	72.8	Confident	77.9	Confident	116 Å²	116	81.6 Å²	81.6	62%	0.62	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-111.2	12.9	-172.5	-60.3	9.5	0	0	0	111.7	W256 S294 V295 P299	W256-N297 VanDerWaalsContact CD1-C 3.46Å; W256-N297 VanDerWaalsContact CD1-O 3.22Å; S294-N297 PolarHBondContact O-N 3.07Å; V295-N297 PolarHBondContact O-N 3.48Å; N297-P299 WeakPolarHBondContact O-CD 3.39Å
298	R	83.3	Confident	77.4	Confident	106 Å²	106	81.5 Å²	81.5	40%	0.4	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-69.9	120.5	179.8	-170.1	177.9	-165.7	137.9	19	110	W256 P277 D290 V295	W256-R298 HydrophobicContact CD2-CB 4.2Å; W256-R298 HydrophobicContact CD2-CG 3.96Å; W256-R298 HydrophobicContact CE3-CG 4.12Å; W256-R298 HydrophobicContact CH2-CG 4.13Å; W256-R298 HydrophobicContact CZ2-CB 4.02Å; W256-R298 HydrophobicContact CZ2-CG 3.93Å; W256-R298 HydrophobicContact CZ3-CG 4.21Å; P277-R298 HydrophobicContact CB-CG 4.08Å; P277-R298 HydrophobicContact CG-CG 3.95Å; D290-R298 IonicContact OD1-NH2 3.88Å; D290-R298 PolarHBondContact OD1-NH2 3.19Å; D290-R298 IonicContact OD2-CZ 2.68Å; D290-R298 IonicContact OD2-NH1 3.12Å; D290-R298 PolarHBondContact OD2-NH1 2.77Å; D290-R298 IonicContact OD2-NH2 3.64Å; D290-R298 PolarHBondContact OD2-NH2 2.83Å; V295-R298 PolarHBondContact O-N 3.05Å
299	P	81.3	Confident	76.8	Confident	49 Å²	49	84.5 Å²	84.5	32%	0.318	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-61.9	151.8	172.8	-21.4	32.8	0	0	0	111.8	W256 M258 P277 N297	W256-P299 VanDerWaalsContact CB-CD 3.41Å; W256-P299 HydrophobicContact CB-CG 4.05Å; M258-P299 HydrophobicContact SD-CB 3.74Å; M258-P299 HydrophobicContact SD-CG 4.25Å; P277-P299 HydrophobicContact CB-CB 4.45Å; P277-P299 HydrophobicContact CB-CG 4.44Å; P277-P299 WeakPolarHBondContact CG-O 3.48Å; N297-P299 WeakPolarHBondContact O-CD 3.39Å
300	E	76.3	Confident	76.4	Confident	184 Å²	184	83.2 Å²	83.2	86%	0.86	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-70.2	141.9	166.7	-63.9	-170.7	152.5	0	0	110.1	S302	E300-S302 PolarHBondContact O-N 3.19Å
301	A	79.3	Confident	76.2	Confident	57 Å²	57	81.1 Å²	81.1	47%	0.471	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-66.9	124.3	176.6	0	0	0	0	0	110	S275	S275-A301 CarbonylContact O-C 3.57Å; S275-A301 WeakPolarHBondContact O-CA 3.33Å; S275-A301 WeakPolarHBondContact O-CB 3.39Å
302	S	82.4	Confident	76.4	Confident	41 Å²	41	80.1 Å²	80.1	29%	0.287	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	139.8	-178.3	55.9	0	0	0	0	111.1	M258 M261 M274 S275 E300	M258-S302 WeakPolarHBondContact CE-OG 3.03Å; M261-S302 WeakPolarHBondContact CE-OG 3.02Å; M274-S302 CarbonylContact C-O 3.59Å; M274-S302 VanDerWaalsContact CA-O 3.28Å; M274-S302 WeakPolarHBondContact CA-O 3.45Å; S275-S302 PolarHBondContact N-O 2.91Å; S275-S302 PolarHBondContact O-N 2.95Å; S275-S302 VanDerWaalsContact O-N 3.07Å; E300-S302 PolarHBondContact O-N 3.19Å
303	V	80.9	Confident	76.7	Confident	93 Å²	93	77.2 Å²	77.2	56%	0.564	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	119.8	175.8	-176.3	0	0	0	0	107.8	Y272 K273 M274	Y272-V303 HydrophobicContact CD1-CG1 4.15Å; Y272-V303 HydrophobicContact CG-CG1 4.46Å; K273-V303 WeakPolarHBondContact O-CA 3.27Å; M274-V303 HydrophobicContact CB-CG2 4.11Å
304	E	80.8	Confident	76.9	Confident	88 Å²	88	82.3 Å²	82.3	41%	0.411	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142	-179.2	-73.9	176.7	-158.1	0	0	110	M261 Y272 K273	M261-E304 HydrophobicContact CE-CG 4.28Å; M261-E304 WeakPolarHBondContact CE-OE1 3.38Å; Y272-E304 WeakPolarHBondContact CA-O 3.07Å; K273-E304 HydrophobicContact CD-CB 4.47Å; K273-E304 WeakPolarHBondContact CE-OE2 3.03Å; K273-E304 HydrophobicContact CG-CB 4.01Å; K273-E304 WeakPolarHBondContact CG-O 3.03Å; K273-E304 PolarHBondContact N-O 2.83Å; K273-E304 IonicContact NZ-OE2 2.76Å; K273-E304 PolarHBondContact NZ-OE2 3.21Å; K273-E304 PolarHBondContact O-N 2.91Å
305	Q	77.1	Confident	77.4	Confident	106 Å²	106	80.8 Å²	80.8	50%	0.495	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	141.8	174.7	-155.3	172.9	33.1	0	0	110.2	G271 Y272 T308	G271-Q305 WeakPolarHBondContact O-CA 3.42Å; G271-Q305 VanDerWaalsContact O-CG 3.24Å; G271-Q305 WeakPolarHBondContact O-CG 2.97Å; Y272-Q305 HydrophobicContact CD1-CB 4.39Å; Y272-Q305 HydrophobicContact CD1-CG 4.24Å; Y272-Q305 HydrophobicContact CE1-CB 4.36Å; Y272-Q305 HydrophobicContact CE1-CG 3.97Å; Q305-T308 HydrophobicContact CG-CG2 3.89Å
306	C	79.8	Confident	77.9	Confident	17 Å²	17	76.8 Å²	76.8	12%	0.115	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	163.7	-176.2	49.9	0	0	0	0	110.5	C264 G271 K273 T308	C264-C306 VanDerWaalsContact CA-SG 3.55Å; C264-C306 HydrophobicContact CB-CB 3.91Å; C264-C306 WeakPolarHBondContact CB-SG 3.38Å; C264-C306 VanDerWaalsContact SG-C 3.56Å; C264-C306 WeakPolarHBondContact SG-CB 3.35Å; C264-C306 CovalentContact SG-SG 2.03Å; C264-C306 PolarHBondContact SG-SG 3.07Å; G271-C306 CarbonylContact C-O 3.58Å; G271-C306 PolarHBondContact N-O 3.47Å; G271-C306 PolarHBondContact O-N 3.07Å; K273-C306 HydrophobicContact CD-CB 4.42Å; K273-C306 HydrophobicContact CG-CB 4.19Å; K273-C306 PolarHBondContact N-SG 3.1Å; K273-C306 VanDerWaalsContact N-SG 3.36Å; C306-T308 VanDerWaalsContact C-N 3.26Å; C306-T308 PolarHBondContact O-N 3.07Å
307	N	73.8	Confident	78.6	Confident	61 Å²	61	73.1 Å²	73.1	33%	0.326	40%	0.397	S	S	.	.			trans	50.1	45.5	178.5	-63.4	-15.6	0	0	0	113.7	C264 V266 T267 C268 G269 S270 H309	C264-N307 WeakPolarHBondContact CB-ND2 3.11Å; C264-N307 PolarHBondContact SG-ND2 2.56Å; V266-N307 WeakPolarHBondContact O-CB 3.46Å; V266-N307 PolarHBondContact O-ND2 2.87Å; T267-N307 WeakPolarHBondContact O-CB 3.03Å; T267-N307 PolarHBondContact O-ND2 3.37Å; C268-N307 CarbonylContact C-O 3.44Å; G269-N307 PolarHBondContact N-O 3.26Å; G269-N307 VanDerWaalsContact N-O 3.17Å; S270-N307 PolarHBondContact N-O 2.92Å; N307-H309 PolarHBondContact O-N 2.86Å
308	T	69.6	Low	79.2	Confident	90 Å²	90	71.8 Å²	71.8	55%	0.552	39%	0.389	S	S	*	.			trans	-74.7	5	-178.8	49.4	0	0	0	0	114.4	Q305 C306	Q305-T308 HydrophobicContact CG-CG2 3.89Å; C306-T308 VanDerWaalsContact C-N 3.26Å; C306-T308 PolarHBondContact O-N 3.07Å
309	H	69.4	Low	79.3	Confident	104 Å²	104	74 Å²	74	48%	0.481	41%	0.409	S	S	.	.	S	Bend	trans	-77.2	146.4	173	62.5	-96.2	0	0	0	110.7	T267 C268 G269 N307 C311	T267-H309 PolarHBondContact O-CE1 3.49Å; T267-H309 PolarHBondContact O-NE2 3Å; C268-H309 VanDerWaalsContact CB-NE2 3.31Å; C268-H309 WeakPolarHBondContact CB-NE2 3.31Å; G269-H309 PolarHBondContact N-O 2.92Å; N307-H309 PolarHBondContact O-N 2.86Å; H309-C311 PolarHBondContact O-N 2.04Å
310	S	68.7	Low	79.6	Confident	68 Å²	68	74.7 Å²	74.7	48%	0.476	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-57.6	136.7	175.7	-63.5	0	0	0	0	111.7
311	C	74.1	Confident	80	Confident	18 Å²	18	68.4 Å²	68.4	12%	0.122	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	136.9	170.9	-72	0	0	0	0	110.4	C268 H309 E341	C268-C311 HydrophobicContact CB-CB 3.95Å; C268-C311 WeakPolarHBondContact CB-SG 3.48Å; C268-C311 PolarHBondContact O-SG 3.48Å; C268-C311 WeakPolarHBondContact SG-CA 3.47Å; C268-C311 WeakPolarHBondContact SG-CB 3.49Å; C268-C311 CovalentContact SG-SG 2.04Å; C268-C311 PolarHBondContact SG-SG 2.9Å; H309-C311 PolarHBondContact O-N 2.04Å; C311-E341 PolarHBondContact N-O 3.01Å
312	P	78.3	Confident	80.1	Confident	96 Å²	96	71.7 Å²	71.7	62%	0.623	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.1	140.3	172.3	-26.1	34.7	0	0	0	111.9	R314	P312-R314 PolarHBondContact O-N 2.92Å
313	P	81.1	Confident	80.1	Confident	28 Å²	28	70.9 Å²	70.9	18%	0.182	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	134.5	-178.7	21.8	-31.3	0	0	0	112	A339 E340 V349 M353	P313-A339 CarbonylContact C-O 3.53Å; P313-A339 WeakPolarHBondContact CA-O 3.33Å; P313-E340 HydrophobicContact CB-CB 4.19Å; P313-V349 HydrophobicContact CB-CG2 3.75Å; P313-M353 HydrophobicContact CB-CB 4.14Å; P313-M353 HydrophobicContact CG-CB 3.74Å
314	R	84.1	Confident	80.2	Confident	112 Å²	112	69.1 Å²	69.1	42%	0.423	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	154.1	-171.2	66.5	-169.9	-174	89.5	-6.7	110.9	P312 I316 A339 E341 C354	P312-R314 PolarHBondContact O-N 2.92Å; R314-I316 HydrophobicContact CG-CG1 4.49Å; R314-I316 PolarHBondContact O-N 3.18Å; R314-A339 PolarHBondContact N-O 2.98Å; R314-A339 PolarHBondContact O-N 3.05Å; R314-E341 IonicContact CZ-OE2 2.71Å; R314-E341 IonicContact NE-OE2 3.61Å; R314-E341 IonicContact NH2-OE2 3.6Å; R314-E341 PolarHBondContact NH2-OE2 3.44Å; R314-C354 WeakPolarHBondContact CA-SG 3.33Å; R314-C354 PolarHBondContact N-SG 2.93Å; R314-C354 VanDerWaalsContact N-SG 3.43Å; R314-C354 PolarHBondContact O-SG 3.48Å
315	W	88.4	Confident	79.6	Confident	33 Å²	33	72.3 Å²	72.3	13%	0.125	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	129.4	173.5	-65	109.7	0	0	0	110.4	V336 V337 C338 D351 C354 T356 P357 K358 P359	W315-V336 HydrophobicContact CD2-CG1 4.42Å; W315-V336 HydrophobicContact CE3-CG1 3.8Å; W315-V336 HydrophobicContact CZ3-CG1 4.41Å; W315-V337 VanDerWaalsContact CE3-C 3.49Å; W315-C338 HydrophobicContact CE3-CB 3.99Å; W315-C338 HydrophobicContact CH2-CB 4.21Å; W315-C338 HydrophobicContact CZ3-CB 3.82Å; W315-D351 HydrophobicContact CH2-CB 3.58Å; W315-D351 VanDerWaalsContact CH2-CG 3.48Å; W315-D351 WeakPolarHBondContact CH2-OD2 3.27Å; W315-D351 HydrophobicContact CZ3-CB 4.23Å; W315-C354 HydrophobicContact CD2-CB 3.91Å; W315-C354 VanDerWaalsContact CE2-CB 3.43Å; W315-C354 HydrophobicContact CG-CB 4.17Å; W315-C354 HydrophobicContact CZ2-CB 3.81Å; W315-C354 PolarHBondContact N-SG 3Å; W315-T356 PolarHBondContact NE1-O 2.77Å; W315-P357 PolarHBondContact NE1-O 3.45Å; W315-K358 HydrophobicContact CD2-CB 4.41Å; W315-K358 HydrophobicContact CD2-CG 4.2Å; W315-K358 HydrophobicContact CE3-CD 4.44Å; W315-K358 HydrophobicContact CE3-CG 3.97Å; W315-K358 HydrophobicContact CH2-CB 3.82Å; W315-K358 HydrophobicContact CH2-CD 3.54Å; W315-K358 HydrophobicContact CH2-CG 3.6Å; W315-K358 HydrophobicContact CZ2-CB 3.59Å; W315-K358 HydrophobicContact CZ2-CD 4.23Å; W315-K358 HydrophobicContact CZ2-CG 3.87Å; W315-K358 HydrophobicContact CZ3-CB 4.34Å; W315-K358 HydrophobicContact CZ3-CD 3.67Å; W315-K358 HydrophobicContact CZ3-CG 3.67Å; W315-P359 HydrophobicContact CB-CG 3.83Å; W315-P359 HydrophobicContact CG-CG 4.18Å
316	I	83.9	Confident	79	Confident	27 Å²	27	75.3 Å²	75.3	14%	0.138	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.3	167.1	-59.4	-171.6	0	0	0	106.5	R314 V337 A339 K346	R314-I316 HydrophobicContact CG-CG1 4.49Å; R314-I316 PolarHBondContact O-N 3.18Å; I316-V337 PolarHBondContact N-O 2.98Å; I316-V337 PolarHBondContact O-N 3.31Å; I316-A339 HydrophobicContact CD1-CB 3.74Å; I316-A339 HydrophobicContact CG1-CB 4.02Å; I316-K346 HydrophobicContact CD1-CD 3.73Å; I316-K346 HydrophobicContact CD1-CG 4.08Å
317	A	86.4	Confident	78.4	Confident	41 Å²	41	76.2 Å²	76.2	34%	0.339	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	172.7	0	0	0	0	0	108.5	M335 V336	A317-M335 WeakPolarHBondContact CA-O 3.04Å; A317-V336 HydrophobicContact CB-CG2 3.98Å
318	D	84.1	Confident	78.2	Confident	88 Å²	88	74.2 Å²	74.2	47%	0.471	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-75.9	172.1	167.7	-72.5	-22.5	0	0	0	110.3	R334 M335	D318-R334 WeakPolarHBondContact O-CB 3.38Å; D318-R334 WeakPolarHBondContact O-CD 3.47Å; D318-M335 HydrophobicContact CB-CB 4.24Å; D318-M335 PolarHBondContact N-O 3.2Å; D318-M335 WeakPolarHBondContact OD2-CB 3.27Å
319	D	86.3	Confident	78.5	Confident	152 Å²	152	76.1 Å²	76.1	81%	0.813	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-61.3	152.9	172.5	-63.1	-55	0	0	0	112.3	R334	D319-R334 WeakPolarHBondContact O-CB 3.47Å
320	W	86.6	Confident	79	Confident	64 Å²	64	71.6 Å²	71.6	24%	0.242	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-69.3	143.2	174.1	-67	115.3	0	0	0	112.4	R332 R334 P360 E363	W320-R332 HydrophobicContact CB-CB 4.49Å; W320-R332 HydrophobicContact CB-CG 4.06Å; W320-R332 HydrophobicContact CD2-CG 4.04Å; W320-R332 HydrophobicContact CE3-CG 3.9Å; W320-R332 HydrophobicContact CG-CG 4.15Å; W320-R332 WeakPolarHBondContact CZ3-O 3.45Å; W320-R334 HydrophobicContact CD2-CB 4.08Å; W320-R334 HydrophobicContact CD2-CG 4.07Å; W320-R334 HydrophobicContact CE3-CB 3.62Å; W320-R334 HydrophobicContact CE3-CG 3.62Å; W320-R334 HydrophobicContact CH2-CG 3.97Å; W320-R334 HydrophobicContact CZ2-CG 4.39Å; W320-R334 VanDerWaalsContact CZ2-NE 3.33Å; W320-R334 HydrophobicContact CZ3-CB 4.05Å; W320-R334 HydrophobicContact CZ3-CG 3.57Å; W320-P360 WeakPolarHBondContact CH2-O 3.2Å; W320-E363 HydrophobicContact CE3-CB 4.35Å; W320-E363 HydrophobicContact CH2-CB 3.55Å; W320-E363 HydrophobicContact CZ2-CB 3.73Å; W320-E363 HydrophobicContact CZ2-CG 4.47Å; W320-E363 VanDerWaalsContact CZ2-OE2 3.3Å; W320-E363 WeakPolarHBondContact CZ2-OE2 3.49Å; W320-E363 HydrophobicContact CZ3-CB 3.88Å; W320-E363 PolarHBondContact NE1-OE2 2.86Å
321	S	84.8	Confident	79.7	Confident	53 Å²	53	73.7 Å²	73.7	37%	0.371	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-61	168.3	169.9	74.8	0	0	0	0	112.3	R332 E333	S321-R332 WeakPolarHBondContact O-CB 3.34Å; S321-R332 WeakPolarHBondContact OG-CA 3.49Å; S321-E333 VanDerWaalsContact CB-O 3.32Å; S321-E333 WeakPolarHBondContact CB-O 3.41Å; S321-E333 PolarHBondContact N-O 3.26Å; S321-E333 PolarHBondContact OG-N 3.46Å; S321-E333 PolarHBondContact OG-O 2.68Å
322	T	82.1	Confident	80.2	Confident	125 Å²	125	76.6 Å²	76.6	77%	0.767	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-54.9	148.1	156.7	49.2	0	0	0	0	110.3
323	C	82.3	Confident	80.6	Confident	25 Å²	25	76.6 Å²	76.6	17%	0.169	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-57.6	143.2	171.6	-164	0	0	0	0	110.5	R325 C365 I367	C323-R325 WeakPolarHBondContact CB-O 3.36Å; C323-R325 PolarHBondContact O-N 3.42Å; C323-C365 WeakPolarHBondContact CA-SG 3.27Å; C323-C365 HydrophobicContact CB-CB 3.94Å; C323-C365 WeakPolarHBondContact CB-SG 3.34Å; C323-C365 WeakPolarHBondContact SG-CB 3.05Å; C323-C365 CovalentContact SG-SG 2.03Å; C323-C365 PolarHBondContact SG-SG 2.89Å; C323-I367 HydrophobicContact CB-CD1 3.93Å
324	S	83	Confident	80.8	Confident	55 Å²	55	78.1 Å²	78.1	39%	0.385	39%	0.393	S	S	.	.	S	Bend	trans	-68.8	-9	-179.2	62.4	0	0	0	0	114	Y331	S324-Y331 VanDerWaalsContact CB-O 3.3Å; S324-Y331 WeakPolarHBondContact CB-O 3.49Å; S324-Y331 PolarHBondContact N-O 3.44Å; S324-Y331 WeakPolarHBondContact OG-CD1 3.46Å; S324-Y331 WeakPolarHBondContact OG-CE1 3.25Å; S324-Y331 PolarHBondContact OG-N 2.91Å; S324-Y331 PolarHBondContact OG-O 2.03Å
325	R	68.5	Low	80.5	Confident	156 Å²	156	78 Å²	78	59%	0.589	40%	0.399	S	S	*	.	S	Bend	trans	-130.7	158	170.7	-60.7	-166.4	-179	147.1	-12.4	110.7	C323 H329	C323-R325 WeakPolarHBondContact CB-O 3.36Å; C323-R325 PolarHBondContact O-N 3.42Å; R325-H329 WeakPolarHBondContact CD-O 3.1Å; R325-H329 PolarHBondContact NH1-O 3.41Å
326	L	64	Low	80.6	Confident	169 Å²	169	76.7 Å²	76.7	89%	0.885	40%	0.395	S	S	*	.	S	Bend	trans	-92.8	-15.5	-178.4	-63.3	175.8	0	0	0	113.9
327	C	67.7	Low	80.8	Confident	36 Å²	36	76.3 Å²	76.3	24%	0.243	39%	0.394	C	S	.	.	S	Bend	trans	-153.5	161.5	173.3	55.6	0	0	0	0	108.9	C370	C327-C370 HydrophobicContact CB-CB 4Å; C327-C370 WeakPolarHBondContact CB-SG 3.42Å; C327-C370 WeakPolarHBondContact SG-CB 3.24Å; C327-C370 CovalentContact SG-SG 2.04Å; C327-C370 PolarHBondContact SG-SG 3.42Å
328	G	69.9	Low	80.9	Confident	19 Å²	19	74.4 Å²	74.4	20%	0.196	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.1	-164	-174.2	0	0	0	0	0	114.8	I367 E368	G328-I367 CarbonylContact C-O 3.59Å; G328-I367 WeakPolarHBondContact CA-O 3.44Å; G328-I367 PolarHBondContact N-O 3.24Å; G328-I367 PolarHBondContact O-N 2.87Å; G328-E368 PolarHBondContact N-O 3.02Å
329	H	74.7	Confident	80.9	Confident	129 Å²	129	70.4 Å²	70.4	60%	0.597	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	126.6	179.1	-59.8	-92.7	0	0	0	112.1	R325	R325-H329 WeakPolarHBondContact CD-O 3.1Å; R325-H329 PolarHBondContact NH1-O 3.41Å
330	G	80.9	Confident	80.7	Confident	10 Å²	10	66.2 Å²	66.2	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-163.2	170.3	0	0	0	0	0	111.7	T364 C365	G330-T364 WeakPolarHBondContact O-CA 3.18Å; G330-C365 PolarHBondContact N-O 2.99Å; G330-C365 PolarHBondContact O-N 3.08Å
331	Y	82.6	Confident	79.9	Confident	112 Å²	112	65.2 Å²	65.2	44%	0.439	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.4	176.3	57.6	-87.6	0	0	0	111.2	S324 E333 Q362 E363 C365	S324-Y331 VanDerWaalsContact CB-O 3.3Å; S324-Y331 WeakPolarHBondContact CB-O 3.49Å; S324-Y331 PolarHBondContact N-O 3.44Å; S324-Y331 WeakPolarHBondContact OG-CD1 3.46Å; S324-Y331 WeakPolarHBondContact OG-CE1 3.25Å; S324-Y331 PolarHBondContact OG-N 2.91Å; S324-Y331 PolarHBondContact OG-O 2.03Å; Y331-E333 HydrophobicContact CD2-CG 4.19Å; Y331-E333 WeakPolarHBondContact CE2-OE1 3.34Å; Y331-Q362 HydrophobicContact CD2-CG 4.18Å; Y331-E363 CarbonylContact C-O 3.56Å; Y331-E363 WeakPolarHBondContact CA-O 3.06Å; Y331-C365 WeakPolarHBondContact CA-SG 2.91Å; Y331-C365 PolarHBondContact N-SG 3.35Å
332	R	85.5	Confident	78.9	Confident	79 Å²	79	64.1 Å²	64.1	30%	0.298	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.4	173.6	65.4	-174.7	-167.3	-175.9	-7.3	110.1	W320 S321 Q362 E363	W320-R332 HydrophobicContact CB-CB 4.49Å; W320-R332 HydrophobicContact CB-CG 4.06Å; W320-R332 HydrophobicContact CD2-CG 4.04Å; W320-R332 HydrophobicContact CE3-CG 3.9Å; W320-R332 HydrophobicContact CG-CG 4.15Å; W320-R332 WeakPolarHBondContact CZ3-O 3.45Å; S321-R332 WeakPolarHBondContact O-CB 3.34Å; S321-R332 WeakPolarHBondContact OG-CA 3.49Å; R332-Q362 CarbonylContact O-C 3.39Å; R332-Q362 WeakPolarHBondContact O-CA 3.11Å; R332-E363 HydrophobicContact CG-CB 4.01Å; R332-E363 IonicContact CZ-OE1 3.14Å; R332-E363 IonicContact CZ-OE2 3.92Å; R332-E363 VanDerWaalsContact CZ-OE2 3.28Å; R332-E363 PolarHBondContact N-O 2.99Å; R332-E363 IonicContact NE-OE1 2.68Å; R332-E363 PolarHBondContact NE-OE1 3.44Å; R332-E363 VanDerWaalsContact NE-OE1 3.09Å; R332-E363 IonicContact NE-OE2 3.43Å; R332-E363 PolarHBondContact NE-OE2 2.93Å; R332-E363 IonicContact NH2-OE1 2.74Å; R332-E363 PolarHBondContact NH2-OE1 2.04Å; R332-E363 IonicContact NH2-OE2 2.61Å; R332-E363 PolarHBondContact NH2-OE2 3.07Å; R332-E363 PolarHBondContact O-N 2.78Å
333	E	85.3	Confident	77.8	Confident	95 Å²	95	63.6 Å²	63.6	44%	0.444	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.2	-170.7	-67.4	180	167.9	0	0	111	S321 Y331 T361 Q362	S321-E333 VanDerWaalsContact CB-O 3.32Å; S321-E333 WeakPolarHBondContact CB-O 3.41Å; S321-E333 PolarHBondContact N-O 3.26Å; S321-E333 PolarHBondContact OG-N 3.46Å; S321-E333 PolarHBondContact OG-O 2.68Å; Y331-E333 HydrophobicContact CD2-CG 4.19Å; Y331-E333 WeakPolarHBondContact CE2-OE1 3.34Å; E333-T361 CarbonylContact C-O 3.59Å; E333-T361 VanDerWaalsContact CA-O 3.27Å; E333-T361 WeakPolarHBondContact CA-O 3.15Å; E333-Q362 HydrophobicContact CG-CB 4.33Å; E333-Q362 HydrophobicContact CG-CG 3.94Å; E333-Q362 PolarHBondContact OE1-NE2 2.88Å
334	R	85.9	Confident	76.6	Confident	60 Å²	60	65.5 Å²	65.5	23%	0.226	34%	0.339	C	S	.	.			trans	-138.9	150.2	175.1	70.5	-175.2	171.3	-175.8	-8.6	111.1	D318 D319 W320 V336 P360 T361	D318-R334 WeakPolarHBondContact O-CB 3.38Å; D318-R334 WeakPolarHBondContact O-CD 3.47Å; D319-R334 WeakPolarHBondContact O-CB 3.47Å; W320-R334 HydrophobicContact CD2-CB 4.08Å; W320-R334 HydrophobicContact CD2-CG 4.07Å; W320-R334 HydrophobicContact CE3-CB 3.62Å; W320-R334 HydrophobicContact CE3-CG 3.62Å; W320-R334 HydrophobicContact CH2-CG 3.97Å; W320-R334 HydrophobicContact CZ2-CG 4.39Å; W320-R334 VanDerWaalsContact CZ2-NE 3.33Å; W320-R334 HydrophobicContact CZ3-CB 4.05Å; W320-R334 HydrophobicContact CZ3-CG 3.57Å; R334-V336 HydrophobicContact CG-CG2 3.94Å; R334-P360 PolarHBondContact NE-O 3.05Å; R334-P360 PolarHBondContact NH2-O 3.3Å; R334-T361 PolarHBondContact N-O 3.14Å
335	M	78.5	Confident	75.6	Confident	110 Å²	110	68.1 Å²	68.1	54%	0.542	35%	0.348	S	S	.	.			trans	-73.9	133.7	171.3	-153.3	-178.4	-53.9	0	0	109.6	A317 D318 V337	A317-M335 WeakPolarHBondContact CA-O 3.04Å; D318-M335 HydrophobicContact CB-CB 4.24Å; D318-M335 PolarHBondContact N-O 3.2Å; D318-M335 WeakPolarHBondContact OD2-CB 3.27Å; M335-V337 HydrophobicContact CG-CG1 4Å; M335-V337 HydrophobicContact SD-CG1 3.96Å
336	V	89.2	Confident	75.9	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.03	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	115	173.1	-178.7	0	0	0	0	108	W315 A317 R334 K358 P359 T361	W315-V336 HydrophobicContact CD2-CG1 4.42Å; W315-V336 HydrophobicContact CE3-CG1 3.8Å; W315-V336 HydrophobicContact CZ3-CG1 4.41Å; A317-V336 HydrophobicContact CB-CG2 3.98Å; R334-V336 HydrophobicContact CG-CG2 3.94Å; V336-K358 HydrophobicContact CG1-CG 3.9Å; V336-K358 VanDerWaalsContact O-CE 3.28Å; V336-K358 WeakPolarHBondContact O-CE 3.44Å; V336-K358 PolarHBondContact O-NZ 2.68Å; V336-P359 HydrophobicContact CG1-CB 3.99Å; V336-P359 HydrophobicContact CG1-CG 4.05Å; V336-P359 HydrophobicContact CG2-CB 4.34Å; V336-T361 HydrophobicContact CB-CG2 3.75Å; V336-T361 HydrophobicContact CG2-CG2 3.7Å
337	V	88.8	Confident	76.6	Confident	20 Å²	20	61 Å²	61	12%	0.121	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.9	-176.3	-63.1	0	0	0	0	110.5	W315 I316 M335 R348	W315-V337 VanDerWaalsContact CE3-C 3.49Å; I316-V337 PolarHBondContact N-O 2.98Å; I316-V337 PolarHBondContact O-N 3.31Å; M335-V337 HydrophobicContact CG-CG1 4Å; M335-V337 HydrophobicContact SD-CG1 3.96Å; V337-R348 HydrophobicContact CB-CG 4.18Å
338	C	87.5	Confident	77.2	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	130.3	165.6	-175	0	0	0	0	108.6	W315 V349 C354	W315-C338 HydrophobicContact CE3-CB 3.99Å; W315-C338 HydrophobicContact CH2-CB 4.21Å; W315-C338 HydrophobicContact CZ3-CB 3.82Å; C338-V349 HydrophobicContact CB-CG2 4.15Å; C338-V349 PolarHBondContact O-N 2.75Å; C338-V349 WeakPolarHBondContact SG-CG2 3.08Å; C338-C354 WeakPolarHBondContact CA-SG 3.48Å; C338-C354 HydrophobicContact CB-CB 3.9Å; C338-C354 WeakPolarHBondContact CB-SG 3Å; C338-C354 WeakPolarHBondContact SG-CB 3.37Å; C338-C354 PolarHBondContact SG-N 3.04Å; C338-C354 CovalentContact SG-SG 2.02Å; C338-C354 PolarHBondContact SG-SG 3Å
339	A	84.9	Confident	77.9	Confident	4 Å²	4	68.3 Å²	68.3	3%	0.033	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	140.3	-177.7	0	0	0	0	0	112.4	P313 R314 I316 T347	P313-A339 CarbonylContact C-O 3.53Å; P313-A339 WeakPolarHBondContact CA-O 3.33Å; R314-A339 PolarHBondContact N-O 2.98Å; R314-A339 PolarHBondContact O-N 3.05Å; I316-A339 HydrophobicContact CD1-CB 3.74Å; I316-A339 HydrophobicContact CG1-CB 4.02Å; A339-T347 CarbonylContact C-O 3.58Å; A339-T347 WeakPolarHBondContact CA-O 3.43Å; A339-T347 WeakPolarHBondContact CB-O 3.38Å
340	E	82.9	Confident	78.3	Confident	64 Å²	64	65 Å²	65	30%	0.299	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	144.8	169.5	-166.4	174.2	-136.3	0	0	108.8	P313 K346 T347 V349	P313-E340 HydrophobicContact CB-CB 4.19Å; E340-K346 WeakPolarHBondContact O-CA 3.41Å; E340-T347 PolarHBondContact N-O 2.92Å; E340-T347 PolarHBondContact O-N 3.27Å; E340-T347 PolarHBondContact O-OG1 2.62Å; E340-V349 HydrophobicContact CB-CG1 3.89Å
341	E	69.1	Low	78.4	Confident	43 Å²	43	67.2 Å²	67.2	20%	0.201	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112.7	-176.7	-171	157.1	-154.7	0	0	109.9	C311 R314 K346	C311-E341 PolarHBondContact N-O 3.01Å; R314-E341 IonicContact CZ-OE2 2.71Å; R314-E341 IonicContact NE-OE2 3.61Å; R314-E341 IonicContact NH2-OE2 3.6Å; R314-E341 PolarHBondContact NH2-OE2 3.44Å; E341-K346 HydrophobicContact CB-CG 4.46Å; E341-K346 VanDerWaalsContact CD-CE 3.45Å; E341-K346 HydrophobicContact CG-CG 4.01Å; E341-K346 WeakPolarHBondContact OE1-CE 3.35Å; E341-K346 WeakPolarHBondContact OE1-CG 3.19Å; E341-K346 IonicContact OE1-NZ 2.56Å
342	S	64.4	Low	78.3	Confident	31 Å²	31	69 Å²	69	22%	0.217	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.8	-177.3	62.1	0	0	0	0	110.1	G344 I345	S342-G344 PolarHBondContact O-N 3.47Å; S342-G344 VanDerWaalsContact O-N 3.15Å; S342-I345 PolarHBondContact N-O 3.28Å; S342-I345 WeakPolarHBondContact O-CB 3.41Å; S342-I345 PolarHBondContact O-N 2.87Å
343	N	57.8	Low	78	Confident	113 Å²	113	70.3 Å²	70.3	60%	0.604	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	39.4	178.4	-55	-59.9	0	0	0	113.7	S270 I345	S270-N343 WeakPolarHBondContact CB-OD1 3.29Å; S270-N343 PolarHBondContact OG-OD1 3.21Å; N343-I345 VanDerWaalsContact C-N 3.25Å; N343-I345 PolarHBondContact O-N 2.85Å
344	G	57.7	Low	78	Confident	65 Å²	65	66.1 Å²	66.1	67%	0.67	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	2.9	-177.2	0	0	0	0	0	115.8	S342	S342-G344 PolarHBondContact O-N 3.47Å; S342-G344 VanDerWaalsContact O-N 3.15Å
345	I	62.1	Low	77.7	Confident	110 Å²	110	75.1 Å²	75.1	56%	0.564	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.7	172.7	-54.8	178.4	0	0	0	108.5	S342 N343 T347	S342-I345 PolarHBondContact N-O 3.28Å; S342-I345 WeakPolarHBondContact O-CB 3.41Å; S342-I345 PolarHBondContact O-N 2.87Å; N343-I345 VanDerWaalsContact C-N 3.25Å; N343-I345 PolarHBondContact O-N 2.85Å; I345-T347 HydrophobicContact CG2-CG2 4.19Å
346	K	74.3	Confident	77.6	Confident	121 Å²	121	74 Å²	74	53%	0.526	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.6	173	-66.7	171	178.5	-179.9	0	109.4	I316 E340 E341	I316-K346 HydrophobicContact CD1-CD 3.73Å; I316-K346 HydrophobicContact CD1-CG 4.08Å; E340-K346 WeakPolarHBondContact O-CA 3.41Å; E341-K346 HydrophobicContact CB-CG 4.46Å; E341-K346 VanDerWaalsContact CD-CE 3.45Å; E341-K346 HydrophobicContact CG-CG 4.01Å; E341-K346 WeakPolarHBondContact OE1-CE 3.35Å; E341-K346 WeakPolarHBondContact OE1-CG 3.19Å; E341-K346 IonicContact OE1-NZ 2.56Å
347	T	78.4	Confident	77.3	Confident	56 Å²	56	79.4 Å²	79.4	34%	0.344	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.3	176.8	50.9	0	0	0	0	109.5	A339 E340 I345 V349	A339-T347 CarbonylContact C-O 3.58Å; A339-T347 WeakPolarHBondContact CA-O 3.43Å; A339-T347 WeakPolarHBondContact CB-O 3.38Å; E340-T347 PolarHBondContact N-O 2.92Å; E340-T347 PolarHBondContact O-N 3.27Å; E340-T347 PolarHBondContact O-OG1 2.62Å; I345-T347 HydrophobicContact CG2-CG2 4.19Å; T347-V349 PolarHBondContact O-N 3.42Å
348	R	80.2	Confident	77.2	Confident	172 Å²	172	82.9 Å²	82.9	65%	0.649	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.1	172.3	-179.4	174.8	-178.8	179.2	1.2	109.1	V337	V337-R348 HydrophobicContact CB-CG 4.18Å
349	V	85.4	Confident	77.2	Confident	35 Å²	35	84.8 Å²	84.8	21%	0.212	45%	0.446	C	S	.	.			trans	-112	178.8	174.5	-59.3	0	0	0	0	110.1	P313 C338 E340 T347 M353	P313-V349 HydrophobicContact CB-CG2 3.75Å; C338-V349 HydrophobicContact CB-CG2 4.15Å; C338-V349 PolarHBondContact O-N 2.75Å; C338-V349 WeakPolarHBondContact SG-CG2 3.08Å; E340-V349 HydrophobicContact CB-CG1 3.89Å; T347-V349 PolarHBondContact O-N 3.42Å; V349-M353 HydrophobicContact CB-CG 4.39Å; V349-M353 HydrophobicContact CG2-CB 3.91Å; V349-M353 HydrophobicContact CG2-CG 4.2Å
350	A	83.3	Confident	77.2	Confident	61 Å²	61	88.7 Å²	88.7	50%	0.504	47%	0.471	S	S	.	.			trans	-69.2	139.5	177	0	0	0	0	0	111.2	I352 M353	A350-I352 HydrophobicContact CB-CG2 4.06Å; A350-I352 PolarHBondContact O-N 2.7Å; A350-I352 VanDerWaalsContact O-N 3.08Å; A350-M353 HydrophobicContact CB-CG 4.39Å; A350-M353 VanDerWaalsContact O-CB 3.32Å; A350-M353 WeakPolarHBondContact O-CB 3.47Å; A350-M353 WeakPolarHBondContact O-CG 3.49Å; A350-M353 PolarHBondContact O-N 2.84Å
351	D	82.8	Confident	77.4	Confident	55 Å²	55	88.9 Å²	88.9	29%	0.294	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-50	-35.7	-178	-81.4	33.9	0	0	0	113.8	W315 M353 C354 K358	W315-D351 HydrophobicContact CH2-CB 3.58Å; W315-D351 VanDerWaalsContact CH2-CG 3.48Å; W315-D351 WeakPolarHBondContact CH2-OD2 3.27Å; W315-D351 HydrophobicContact CZ3-CB 4.23Å; D351-M353 PolarHBondContact O-N 2.84Å; D351-C354 PolarHBondContact O-N 3.37Å; D351-K358 IonicContact OD2-NZ 3.34Å; D351-K358 PolarHBondContact OD2-NZ 2.83Å
352	I	80.8	Confident	78.2	Confident	150 Å²	150	91.9 Å²	91.9	77%	0.769	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.3	176.6	-167.3	167.9	0	0	0	114.8	A350 C354	A350-I352 HydrophobicContact CB-CG2 4.06Å; A350-I352 PolarHBondContact O-N 2.7Å; A350-I352 VanDerWaalsContact O-N 3.08Å; I352-C354 VanDerWaalsContact C-N 3.25Å; I352-C354 PolarHBondContact O-N 2.87Å
353	M	78.4	Confident	79.2	Confident	106 Å²	106	93.5 Å²	93.5	52%	0.522	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-70.8	-26.3	179.3	-60.3	-61.9	-68.2	0	0	111.7	P313 V349 A350 D351 R355	P313-M353 HydrophobicContact CB-CB 4.14Å; P313-M353 HydrophobicContact CG-CB 3.74Å; V349-M353 HydrophobicContact CB-CG 4.39Å; V349-M353 HydrophobicContact CG2-CB 3.91Å; V349-M353 HydrophobicContact CG2-CG 4.2Å; A350-M353 HydrophobicContact CB-CG 4.39Å; A350-M353 VanDerWaalsContact O-CB 3.32Å; A350-M353 WeakPolarHBondContact O-CB 3.47Å; A350-M353 WeakPolarHBondContact O-CG 3.49Å; A350-M353 PolarHBondContact O-N 2.84Å; D351-M353 PolarHBondContact O-N 2.84Å; M353-R355 PolarHBondContact O-N 2.83Å
354	C	84.7	Confident	80.3	Confident	7 Å²	7	93.5 Å²	93.5	5%	0.047	50%	0.499	C	S	.	.			trans	-85.1	100.3	175.9	-71	0	0	0	0	109.6	R314 W315 C338 D351 I352 T356	R314-C354 WeakPolarHBondContact CA-SG 3.33Å; R314-C354 PolarHBondContact N-SG 2.93Å; R314-C354 VanDerWaalsContact N-SG 3.43Å; R314-C354 PolarHBondContact O-SG 3.48Å; W315-C354 HydrophobicContact CD2-CB 3.91Å; W315-C354 VanDerWaalsContact CE2-CB 3.43Å; W315-C354 HydrophobicContact CG-CB 4.17Å; W315-C354 HydrophobicContact CZ2-CB 3.81Å; W315-C354 PolarHBondContact N-SG 3Å; C338-C354 WeakPolarHBondContact CA-SG 3.48Å; C338-C354 HydrophobicContact CB-CB 3.9Å; C338-C354 WeakPolarHBondContact CB-SG 3Å; C338-C354 WeakPolarHBondContact SG-CB 3.37Å; C338-C354 PolarHBondContact SG-N 3.04Å; C338-C354 CovalentContact SG-SG 2.02Å; C338-C354 PolarHBondContact SG-SG 3Å; D351-C354 PolarHBondContact O-N 3.37Å; I352-C354 VanDerWaalsContact C-N 3.25Å; I352-C354 PolarHBondContact O-N 2.87Å; C354-T356 PolarHBondContact O-N 3.26Å
355	R	80.1	Confident	81.3	Confident	249 Å²	249	91.1 Å²	91.1	94%	0.94	47%	0.472	S	S	*	.			trans	-69.5	-11.1	-176.7	-61.3	-174.3	-179.1	-168.7	-0.2	114.9	M353	M353-R355 PolarHBondContact O-N 2.83Å
356	T	77.6	Confident	81.3	Confident	87 Å²	87	91.8 Å²	91.8	53%	0.534	48%	0.475	S	S	.	.	S	Bend	trans	-84	155.6	174.5	42.7	0	0	0	0	111	W315 C354	W315-T356 PolarHBondContact NE1-O 2.77Å; C354-T356 PolarHBondContact O-N 3.26Å
357	P	82.1	Confident	80.5	Confident	119 Å²	119	89.2 Å²	89.2	77%	0.773	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-61.7	142.3	177.1	25.9	-34.9	0	0	0	111.4	W315 P359	W315-P357 PolarHBondContact NE1-O 3.45Å; P357-P359 WeakPolarHBondContact O-CD 3.46Å
358	K	86.9	Confident	79.6	Confident	93 Å²	93	95 Å²	95	40%	0.404	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-66.8	124.1	-178.8	-173.8	170.1	-172.5	166.6	0	111	W315 V336 D351	W315-K358 HydrophobicContact CD2-CB 4.41Å; W315-K358 HydrophobicContact CD2-CG 4.2Å; W315-K358 HydrophobicContact CE3-CD 4.44Å; W315-K358 HydrophobicContact CE3-CG 3.97Å; W315-K358 HydrophobicContact CH2-CB 3.82Å; W315-K358 HydrophobicContact CH2-CD 3.54Å; W315-K358 HydrophobicContact CH2-CG 3.6Å; W315-K358 HydrophobicContact CZ2-CB 3.59Å; W315-K358 HydrophobicContact CZ2-CD 4.23Å; W315-K358 HydrophobicContact CZ2-CG 3.87Å; W315-K358 HydrophobicContact CZ3-CB 4.34Å; W315-K358 HydrophobicContact CZ3-CD 3.67Å; W315-K358 HydrophobicContact CZ3-CG 3.67Å; V336-K358 HydrophobicContact CG1-CG 3.9Å; V336-K358 VanDerWaalsContact O-CE 3.28Å; V336-K358 WeakPolarHBondContact O-CE 3.44Å; V336-K358 PolarHBondContact O-NZ 2.68Å; D351-K358 IonicContact OD2-NZ 3.34Å; D351-K358 PolarHBondContact OD2-NZ 2.83Å
359	P	87.6	Confident	78.7	Confident	39 Å²	39	94.1 Å²	94.1	25%	0.253	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-56	145.5	172.8	-26.8	33.6	0	0	0	112.5	W315 V336 P357 T361	W315-P359 HydrophobicContact CB-CG 3.83Å; W315-P359 HydrophobicContact CG-CG 4.18Å; V336-P359 HydrophobicContact CG1-CB 3.99Å; V336-P359 HydrophobicContact CG1-CG 4.05Å; V336-P359 HydrophobicContact CG2-CB 4.34Å; P357-P359 WeakPolarHBondContact O-CD 3.46Å; P359-T361 PolarHBondContact O-N 2.75Å
360	P	84.3	Confident	77.7	Confident	86 Å²	86	95.7 Å²	95.7	56%	0.558	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-63.6	136.7	-178.9	24.2	-33	0	0	0	111.3	W320 R334	W320-P360 WeakPolarHBondContact CH2-O 3.2Å; R334-P360 PolarHBondContact NE-O 3.05Å; R334-P360 PolarHBondContact NH2-O 3.3Å
361	T	86.8	Confident	77.1	Confident	69 Å²	69	93.9 Å²	93.9	42%	0.423	49%	0.488	S	S	.	.	S	Bend	trans	-91	-8.8	179.6	47.1	0	0	0	0	113.7	E333 R334 V336 P359	E333-T361 CarbonylContact C-O 3.59Å; E333-T361 VanDerWaalsContact CA-O 3.27Å; E333-T361 WeakPolarHBondContact CA-O 3.15Å; R334-T361 PolarHBondContact N-O 3.14Å; V336-T361 HydrophobicContact CB-CG2 3.75Å; V336-T361 HydrophobicContact CG2-CG2 3.7Å; P359-T361 PolarHBondContact O-N 2.75Å
362	Q	87.4	Confident	76.7	Confident	105 Å²	105	96 Å²	96	49%	0.491	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.4	179.5	-167.2	178.8	78.1	0	0	109.8	Y331 R332 E333	Y331-Q362 HydrophobicContact CD2-CG 4.18Å; R332-Q362 CarbonylContact O-C 3.39Å; R332-Q362 WeakPolarHBondContact O-CA 3.11Å; E333-Q362 HydrophobicContact CG-CB 4.33Å; E333-Q362 HydrophobicContact CG-CG 3.94Å; E333-Q362 PolarHBondContact OE1-NE2 2.88Å
363	E	85.2	Confident	76.8	Confident	65 Å²	65	91.5 Å²	91.5	30%	0.304	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.1	179.3	179.1	-164.2	136.6	0	0	109.4	W320 Y331 R332	W320-E363 HydrophobicContact CE3-CB 4.35Å; W320-E363 HydrophobicContact CH2-CB 3.55Å; W320-E363 HydrophobicContact CZ2-CB 3.73Å; W320-E363 HydrophobicContact CZ2-CG 4.47Å; W320-E363 VanDerWaalsContact CZ2-OE2 3.3Å; W320-E363 WeakPolarHBondContact CZ2-OE2 3.49Å; W320-E363 HydrophobicContact CZ3-CB 3.88Å; W320-E363 PolarHBondContact NE1-OE2 2.86Å; Y331-E363 CarbonylContact C-O 3.56Å; Y331-E363 WeakPolarHBondContact CA-O 3.06Å; R332-E363 HydrophobicContact CG-CB 4.01Å; R332-E363 IonicContact CZ-OE1 3.14Å; R332-E363 IonicContact CZ-OE2 3.92Å; R332-E363 VanDerWaalsContact CZ-OE2 3.28Å; R332-E363 PolarHBondContact N-O 2.99Å; R332-E363 IonicContact NE-OE1 2.68Å; R332-E363 PolarHBondContact NE-OE1 3.44Å; R332-E363 VanDerWaalsContact NE-OE1 3.09Å; R332-E363 IonicContact NE-OE2 3.43Å; R332-E363 PolarHBondContact NE-OE2 2.93Å; R332-E363 IonicContact NH2-OE1 2.74Å; R332-E363 PolarHBondContact NH2-OE1 2.04Å; R332-E363 IonicContact NH2-OE2 2.61Å; R332-E363 PolarHBondContact NH2-OE2 3.07Å; R332-E363 PolarHBondContact O-N 2.78Å
364	T	81.4	Confident	76.8	Confident	113 Å²	113	89.8 Å²	89.8	69%	0.693	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.1	171.6	50.5	0	0	0	0	111.4	G330	G330-T364 WeakPolarHBondContact O-CA 3.18Å
365	C	77	Confident	76.9	Confident	16 Å²	16	92.8 Å²	92.8	11%	0.108	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.8	172.9	37.9	0	0	0	0	110	C323 G330 Y331	C323-C365 WeakPolarHBondContact CA-SG 3.27Å; C323-C365 HydrophobicContact CB-CB 3.94Å; C323-C365 WeakPolarHBondContact CB-SG 3.34Å; C323-C365 WeakPolarHBondContact SG-CB 3.05Å; C323-C365 CovalentContact SG-SG 2.03Å; C323-C365 PolarHBondContact SG-SG 2.89Å; G330-C365 PolarHBondContact N-O 2.99Å; G330-C365 PolarHBondContact O-N 3.08Å; Y331-C365 WeakPolarHBondContact CA-SG 2.91Å; Y331-C365 PolarHBondContact N-SG 3.35Å
366	I	62.5	Low	76.9	Confident	124 Å²	124	86.6 Å²	86.6	64%	0.636	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	127	174.3	-49.4	-178.3	0	0	0	107.3
367	I	57.6	Low	77.3	Confident	66 Å²	66	89.8 Å²	89.8	34%	0.338	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.5	173	-55.4	176.3	0	0	0	106.8	C323 G328	C323-I367 HydrophobicContact CB-CD1 3.93Å; G328-I367 CarbonylContact C-O 3.59Å; G328-I367 WeakPolarHBondContact CA-O 3.44Å; G328-I367 PolarHBondContact N-O 3.24Å; G328-I367 PolarHBondContact O-N 2.87Å
368	E	59.4	Low	77.4	Confident	177 Å²	177	87.5 Å²	87.5	83%	0.827	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-56.1	167.2	-176.7	-63.6	174.8	145	0	0	113.8	G328	G328-E368 PolarHBondContact N-O 3.02Å
369	E	62	Low	77.2	Confident	154 Å²	154	86.2 Å²	86.2	72%	0.72	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-57.1	142.7	-173.4	-62.5	-169.2	153.5	0	0	112.9	T399	E369-T399 HydrophobicContact CB-CG2 3.95Å
370	C	63.8	Low	76.8	Confident	68 Å²	68	87.5 Å²	87.5	46%	0.459	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-74.8	133.7	-173.8	-63.7	0	0	0	0	111.5	C327	C327-C370 HydrophobicContact CB-CB 4Å; C327-C370 WeakPolarHBondContact CB-SG 3.42Å; C327-C370 WeakPolarHBondContact SG-CB 3.24Å; C327-C370 CovalentContact SG-SG 2.04Å; C327-C370 PolarHBondContact SG-SG 3.42Å
371	P	70.1	Confident	76.8	Confident	23 Å²	23	85 Å²	85	15%	0.149	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-66.7	152.6	172.4	29.2	-34.1	0	0	0	111	K397 K406 C407	P371-K397 CarbonylContact C-O 3.59Å; P371-K397 WeakPolarHBondContact CA-O 3.29Å; P371-K397 VanDerWaalsContact CB-O 3.27Å; P371-K397 WeakPolarHBondContact CB-O 3.44Å; P371-K406 HydrophobicContact CG-CB 3.93Å; P371-C407 VanDerWaalsContact C-SG 3.52Å; P371-C407 PolarHBondContact O-SG 2.87Å; P371-C407 VanDerWaalsContact O-SG 3.42Å
372	H	75.1	Confident	76.6	Confident	99 Å²	99	85.7 Å²	85.7	46%	0.458	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	163.1	-171.2	77.3	-64.9	0	0	0	112.8	E374 C396 K397 C407	H372-E374 IonicContact CE1-OE1 3.71Å; H372-E374 IonicContact NE2-OE1 2.64Å; H372-C396 CarbonylContact O-C 3.43Å; H372-C396 WeakPolarHBondContact O-CA 3.39Å; H372-K397 PolarHBondContact N-O 2.92Å; H372-K397 PolarHBondContact ND1-O 2.68Å; H372-K397 PolarHBondContact O-N 2.87Å; H372-C407 VanDerWaalsContact C-SG 3.55Å; H372-C407 PolarHBondContact O-SG 2.92Å; H372-C407 VanDerWaalsContact O-SG 3.37Å
373	W	82.7	Confident	76.1	Confident	57 Å²	57	83.1 Å²	83.1	22%	0.216	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.6	176.7	-69.9	113.6	0	0	0	110.6	V394 C396 C407 D408 T411 K412 P413	W373-V394 HydrophobicContact CE3-CG1 4.04Å; W373-C396 HydrophobicContact CD2-CB 4.42Å; W373-C396 HydrophobicContact CE3-CB 3.8Å; W373-C396 HydrophobicContact CH2-CB 4.06Å; W373-C396 HydrophobicContact CZ3-CB 3.6Å; W373-C407 HydrophobicContact CD2-CB 3.95Å; W373-C407 VanDerWaalsContact CE2-CB 3.45Å; W373-C407 HydrophobicContact CG-CB 4.41Å; W373-C407 HydrophobicContact CH2-CB 4.19Å; W373-C407 HydrophobicContact CZ2-CB 3.59Å; W373-D408 WeakPolarHBondContact CZ2-O 3.41Å; W373-D408 PolarHBondContact NE1-O 2.79Å; W373-T411 PolarHBondContact NE1-OG1 2.77Å; W373-T411 VanDerWaalsContact NE1-OG1 3.16Å; W373-K412 HydrophobicContact CD2-CB 4.37Å; W373-K412 HydrophobicContact CD2-CG 4.19Å; W373-K412 HydrophobicContact CE3-CD 4.49Å; W373-K412 HydrophobicContact CE3-CG 4.13Å; W373-K412 HydrophobicContact CH2-CB 4.17Å; W373-K412 HydrophobicContact CH2-CD 3.64Å; W373-K412 HydrophobicContact CH2-CG 3.86Å; W373-K412 HydrophobicContact CZ2-CB 3.68Å; W373-K412 HydrophobicContact CZ2-CD 4.09Å; W373-K412 HydrophobicContact CZ2-CG 3.87Å; W373-K412 HydrophobicContact CZ3-CD 3.85Å; W373-K412 HydrophobicContact CZ3-CG 3.97Å; W373-P413 HydrophobicContact CB-CG 4.06Å
374	E	78.2	Confident	75.7	Confident	69 Å²	69	84.9 Å²	84.9	32%	0.322	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	150.3	164.2	-73.6	-177.1	-146.7	0	0	110.5	H372 E395 K397	H372-E374 IonicContact CE1-OE1 3.71Å; H372-E374 IonicContact NE2-OE1 2.64Å; E374-E395 PolarHBondContact N-O 3.33Å; E374-E395 PolarHBondContact O-N 3.08Å; E374-K397 HydrophobicContact CG-CD 4.48Å; E374-K397 WeakPolarHBondContact OE1-CD 3.33Å; E374-K397 WeakPolarHBondContact OE2-CD 3.46Å; E374-K397 VanDerWaalsContact OE2-CE 3.31Å; E374-K397 WeakPolarHBondContact OE2-CE 3.46Å; E374-K397 IonicContact OE2-NZ 3.64Å; E374-K397 PolarHBondContact OE2-NZ 3.33Å
375	V	86.6	Confident	75.2	Confident	70 Å²	70	81 Å²	81	42%	0.424	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.9	179.3	-66.1	0	0	0	0	110	V394 P413	V375-V394 HydrophobicContact CG1-CG1 4.21Å; V375-V394 HydrophobicContact CG1-CG2 4.24Å; V375-P413 HydrophobicContact CG1-CB 3.62Å; V375-P413 HydrophobicContact CG1-CG 3.69Å
376	E	81.3	Confident	75.2	Confident	119 Å²	119	81.5 Å²	81.5	56%	0.556	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-82.6	167.2	171.2	-61.5	-173.9	131.9	0	0	111.4	R392 G393	E376-R392 WeakPolarHBondContact O-CB 3.42Å; E376-R392 WeakPolarHBondContact O-CD 3.46Å; E376-G393 PolarHBondContact N-O 3.27Å; E376-G393 WeakPolarHBondContact OE2-CA 3.46Å; E376-G393 PolarHBondContact OE2-N 2.95Å; E376-G393 VanDerWaalsContact OE2-N 3.09Å
377	D	85.8	Confident	76.1	Confident	155 Å²	155	82.6 Å²	82.6	83%	0.829	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-60	151.1	168.6	-76.8	-45.3	0	0	0	112.3	R392	D377-R392 WeakPolarHBondContact O-CB 3.48Å
378	W	84.9	Confident	77.2	Confident	70 Å²	70	79.8 Å²	79.8	27%	0.265	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-71.4	129.3	175.5	-69.2	107.7	0	0	0	111.5	Q390 M391 R392 G414 Q417	W378-Q390 HydrophobicContact CB-CB 4.24Å; W378-Q390 HydrophobicContact CD2-CB 4.47Å; W378-Q390 HydrophobicContact CE3-CB 3.91Å; W378-M391 VanDerWaalsContact CE3-C 3.48Å; W378-R392 HydrophobicContact CD2-CB 4.2Å; W378-R392 HydrophobicContact CD2-CG 4.13Å; W378-R392 HydrophobicContact CE3-CB 3.86Å; W378-R392 HydrophobicContact CE3-CG 3.8Å; W378-R392 HydrophobicContact CH2-CG 3.92Å; W378-R392 HydrophobicContact CZ2-CG 4.23Å; W378-R392 VanDerWaalsContact CZ2-CZ 3.45Å; W378-R392 VanDerWaalsContact CZ2-NE 3.25Å; W378-R392 HydrophobicContact CZ3-CB 4.2Å; W378-R392 HydrophobicContact CZ3-CG 3.67Å; W378-G414 WeakPolarHBondContact CH2-O 3.46Å; W378-Q417 HydrophobicContact CD2-CG 3.92Å; W378-Q417 VanDerWaalsContact CE2-OE1 3.23Å; W378-Q417 HydrophobicContact CE3-CG 3.81Å; W378-Q417 HydrophobicContact CH2-CB 3.67Å; W378-Q417 HydrophobicContact CH2-CG 3.72Å; W378-Q417 HydrophobicContact CZ2-CB 3.98Å; W378-Q417 VanDerWaalsContact CZ2-CD 3.49Å; W378-Q417 HydrophobicContact CZ2-CG 3.82Å; W378-Q417 HydrophobicContact CZ3-CB 4.02Å; W378-Q417 HydrophobicContact CZ3-CG 3.72Å
379	T	81.9	Confident	78.1	Confident	67 Å²	67	74.8 Å²	74.8	41%	0.411	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.7	160.2	172.1	63	0	0	0	0	111.5	Q390 M391	T379-Q390 WeakPolarHBondContact O-CG 3.02Å; T379-Q390 PolarHBondContact O-NE2 3.31Å; T379-M391 WeakPolarHBondContact CG2-O 3.45Å; T379-M391 PolarHBondContact N-O 2.7Å; T379-M391 PolarHBondContact OG1-N 2.81Å; T379-M391 PolarHBondContact OG1-O 2.93Å
380	G	79.3	Confident	79.1	Confident	65 Å²	65	69.5 Å²	69.5	67%	0.67	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-51.9	147.4	167.5	0	0	0	0	0	112.5	S382	G380-S382 PolarHBondContact O-N 2.88Å
381	C	85	Confident	79.9	Confident	34 Å²	34	71 Å²	71	23%	0.23	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-60.5	133.8	179.4	-169.1	0	0	0	0	110.5	V383 Q390 C419 T421	C381-V383 PolarHBondContact O-N 2.03Å; C381-Q390 HydrophobicContact CB-CG 4.35Å; C381-C419 WeakPolarHBondContact CA-SG 3.07Å; C381-C419 HydrophobicContact CB-CB 3.92Å; C381-C419 WeakPolarHBondContact CB-SG 3.33Å; C381-C419 WeakPolarHBondContact SG-CB 3.18Å; C381-C419 CovalentContact SG-SG 2.03Å; C381-C419 PolarHBondContact SG-SG 3.01Å; C381-T421 HydrophobicContact CB-CG2 3.89Å
382	S	81.6	Confident	80.5	Confident	84 Å²	84	72.8 Å²	72.8	59%	0.587	41%	0.406	S	S	*	.	S	Bend	trans	-66.1	-3.5	-169.8	65	0	0	0	0	116.3	G380 I389	G380-S382 PolarHBondContact O-N 2.88Å; S382-I389 VanDerWaalsContact CB-O 3.3Å; S382-I389 WeakPolarHBondContact CB-O 3.45Å; S382-I389 PolarHBondContact N-O 3.42Å; S382-I389 PolarHBondContact OG-N 3.16Å; S382-I389 PolarHBondContact OG-O 3.48Å
383	V	77.8	Confident	80.7	Confident	51 Å²	51	69 Å²	69	31%	0.309	39%	0.393	S	S	.	.			trans	-132.8	149.3	175.9	-58.5	0	0	0	0	109.7	C381 C385 Q387 T421	C381-V383 PolarHBondContact O-N 2.03Å; V383-C385 WeakPolarHBondContact CG2-O 3.45Å; V383-Q387 WeakPolarHBondContact CG2-O 3.45Å; V383-T421 VanDerWaalsContact O-CG2 3.25Å; V383-T421 WeakPolarHBondContact O-CG2 3.43Å
384	S	74.9	Confident	80.9	Confident	101 Å²	101	66.9 Å²	66.9	71%	0.706	39%	0.387	S	S	*	.	S	Bend	trans	-81.6	-22	174	51	0	0	0	0	113.3	T421	S384-T421 PolarHBondContact O-OG1 2.91Å
385	C	72.7	Confident	81.1	Confident	33 Å²	33	67.4 Å²	67.4	22%	0.223	39%	0.389	C	S	.	.	S	Bend	trans	-139.5	147.7	176.1	62.7	0	0	0	0	111	V383 T421 I423 C425	V383-C385 WeakPolarHBondContact CG2-O 3.45Å; C385-T421 WeakPolarHBondContact CA-OG1 3.45Å; C385-I423 CarbonylContact C-O 3.25Å; C385-I423 WeakPolarHBondContact CA-O 3.46Å; C385-I423 HydrophobicContact CB-CB 4.05Å; C385-I423 HydrophobicContact CB-CG2 3.74Å; C385-I423 VanDerWaalsContact CB-O 3.29Å; C385-I423 WeakPolarHBondContact CB-O 3.3Å; C385-C425 HydrophobicContact CB-CB 4.14Å; C385-C425 WeakPolarHBondContact CB-SG 3.3Å; C385-C425 PolarHBondContact O-SG 3.12Å; C385-C425 VanDerWaalsContact SG-CA 3.58Å; C385-C425 WeakPolarHBondContact SG-CB 3.47Å; C385-C425 CovalentContact SG-SG 2.04Å; C385-C425 PolarHBondContact SG-SG 2.99Å
386	G	75.8	Confident	80.9	Confident	26 Å²	26	64.4 Å²	64.4	27%	0.268	37%	0.372	S	S	.	.	S	Bend	trans	87.3	-148.4	-179.4	0	0	0	0	0	114.3	S420 T421 I423	G386-S420 WeakPolarHBondContact O-CA 3.27Å; G386-S420 PolarHBondContact O-OG 2.87Å; G386-T421 PolarHBondContact O-N 2.83Å; G386-T421 VanDerWaalsContact O-N 3.12Å; G386-I423 PolarHBondContact N-O 3.21Å
387	Q	82	Confident	80.6	Confident	146 Å²	146	60.9 Å²	60.9	68%	0.682	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.6	173.4	-70.9	-179.8	-17	0	0	110.3	V383 C419	V383-Q387 WeakPolarHBondContact CG2-O 3.45Å; Q387-C419 CarbonylContact C-O 3.6Å; Q387-C419 WeakPolarHBondContact CA-O 3.45Å
388	G	80.3	Confident	79.9	Confident	7 Å²	7	54.8 Å²	54.8	7%	0.072	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	-160.2	177.5	0	0	0	0	0	112	Q418 C419	G388-Q418 WeakPolarHBondContact O-CG 3.46Å; G388-C419 PolarHBondContact N-O 2.72Å; G388-C419 PolarHBondContact O-N 2.69Å; G388-C419 PolarHBondContact O-SG 3.1Å
389	I	79.4	Confident	78.9	Confident	73 Å²	73	55.3 Å²	55.3	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.4	-179.6	-62.8	177	0	0	0	109	S382 M391 M416 Q417 C419	S382-I389 VanDerWaalsContact CB-O 3.3Å; S382-I389 WeakPolarHBondContact CB-O 3.45Å; S382-I389 PolarHBondContact N-O 3.42Å; S382-I389 PolarHBondContact OG-N 3.16Å; S382-I389 PolarHBondContact OG-O 3.48Å; I389-M391 HydrophobicContact CG2-CG 4.41Å; I389-M416 HydrophobicContact CD1-SD 4.4Å; I389-M416 HydrophobicContact CG2-CE 4.06Å; I389-M416 HydrophobicContact CG2-CG 3.37Å; I389-M416 HydrophobicContact CG2-SD 3.77Å; I389-Q417 WeakPolarHBondContact CA-O 3.47Å; I389-C419 PolarHBondContact N-SG 2.84Å
390	Q	82.9	Confident	78.2	Confident	42 Å²	42	58.3 Å²	58.3	20%	0.196	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.6	164.5	-63	177.6	-77.2	0	0	109.5	W378 T379 C381 M416 Q417 C419	W378-Q390 HydrophobicContact CB-CB 4.24Å; W378-Q390 HydrophobicContact CD2-CB 4.47Å; W378-Q390 HydrophobicContact CE3-CB 3.91Å; T379-Q390 WeakPolarHBondContact O-CG 3.02Å; T379-Q390 PolarHBondContact O-NE2 3.31Å; C381-Q390 HydrophobicContact CB-CG 4.35Å; Q390-M416 WeakPolarHBondContact O-CA 3.37Å; Q390-Q417 HydrophobicContact CB-CG 4.09Å; Q390-Q417 PolarHBondContact N-O 3.42Å; Q390-Q417 PolarHBondContact O-N 2.91Å; Q390-Q417 VanDerWaalsContact OE1-NE2 3.07Å; Q390-C419 HydrophobicContact CG-CB 3.82Å
391	M	80.3	Confident	77.5	Confident	101 Å²	101	57.5 Å²	57.5	50%	0.498	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	161.9	176.3	-59.3	-176.6	-63.1	0	0	109.4	W378 T379 I389 S415 M416	W378-M391 VanDerWaalsContact CE3-C 3.48Å; T379-M391 WeakPolarHBondContact CG2-O 3.45Å; T379-M391 PolarHBondContact N-O 2.7Å; T379-M391 PolarHBondContact OG1-N 2.81Å; T379-M391 PolarHBondContact OG1-O 2.93Å; I389-M391 HydrophobicContact CG2-CG 4.41Å; M391-S415 VanDerWaalsContact CA-O 3.3Å; M391-S415 WeakPolarHBondContact CA-O 3Å; M391-M416 HydrophobicContact CG-CE 3.91Å; M391-M416 HydrophobicContact SD-CE 3.75Å
392	R	81.8	Confident	76.8	Confident	59 Å²	59	58.7 Å²	58.7	22%	0.223	35%	0.349	C	S	.	.			trans	-149.7	155	171.9	63.3	177	172.2	178.9	-4.9	111.2	E376 D377 W378 V394 G414 S415	E376-R392 WeakPolarHBondContact O-CB 3.42Å; E376-R392 WeakPolarHBondContact O-CD 3.46Å; D377-R392 WeakPolarHBondContact O-CB 3.48Å; W378-R392 HydrophobicContact CD2-CB 4.2Å; W378-R392 HydrophobicContact CD2-CG 4.13Å; W378-R392 HydrophobicContact CE3-CB 3.86Å; W378-R392 HydrophobicContact CE3-CG 3.8Å; W378-R392 HydrophobicContact CH2-CG 3.92Å; W378-R392 HydrophobicContact CZ2-CG 4.23Å; W378-R392 VanDerWaalsContact CZ2-CZ 3.45Å; W378-R392 VanDerWaalsContact CZ2-NE 3.25Å; W378-R392 HydrophobicContact CZ3-CB 4.2Å; W378-R392 HydrophobicContact CZ3-CG 3.67Å; R392-V394 HydrophobicContact CG-CG2 4.06Å; R392-G414 PolarHBondContact NE-O 2.64Å; R392-G414 PolarHBondContact NH2-O 2.89Å; R392-S415 PolarHBondContact N-O 2.87Å; R392-S415 VanDerWaalsContact N-O 3.08Å
393	G	80.1	Confident	76	Confident	19 Å²	19	60.6 Å²	60.6	20%	0.196	35%	0.352	C	S	.	.			trans	-62	143	162.5	0	0	0	0	0	111.4	E376	E376-G393 PolarHBondContact N-O 3.27Å; E376-G393 WeakPolarHBondContact OE2-CA 3.46Å; E376-G393 PolarHBondContact OE2-N 2.95Å; E376-G393 VanDerWaalsContact OE2-N 3.09Å
394	V	87	Confident	75.6	Confident	14 Å²	14	59.6 Å²	59.6	9%	0.085	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	99.6	173.2	-176.7	0	0	0	0	107	W373 V375 R392 K412 P413	W373-V394 HydrophobicContact CE3-CG1 4.04Å; V375-V394 HydrophobicContact CG1-CG1 4.21Å; V375-V394 HydrophobicContact CG1-CG2 4.24Å; R392-V394 HydrophobicContact CG-CG2 4.06Å; V394-K412 HydrophobicContact CG1-CD 4.4Å; V394-K412 VanDerWaalsContact CG1-CE 3.45Å; V394-K412 HydrophobicContact CG1-CG 3.89Å; V394-K412 PolarHBondContact O-NZ 2.04Å; V394-P413 HydrophobicContact CG1-CB 3.95Å; V394-P413 HydrophobicContact CG1-CG 4.08Å; V394-P413 HydrophobicContact CG2-CB 4.46Å
395	E	81.3	Confident	75.1	Confident	79 Å²	79	59.8 Å²	59.8	37%	0.369	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.9	-169.7	-59.8	-163.3	132.6	0	0	110.4	E374 K397 L403	E374-E395 PolarHBondContact N-O 3.33Å; E374-E395 PolarHBondContact O-N 3.08Å; E395-K397 WeakPolarHBondContact OE2-CE 3.49Å; E395-L403 HydrophobicContact CB-CD2 3.96Å; E395-L403 HydrophobicContact CG-CD2 4.31Å; E395-L403 WeakPolarHBondContact OE2-CD2 3.38Å
396	C	82	Confident	74.6	Confident	8 Å²	8	66.7 Å²	66.7	5%	0.054	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.7	173.3	167.2	0	0	0	0	107.9	H372 W373 S404 C407	H372-C396 CarbonylContact O-C 3.43Å; H372-C396 WeakPolarHBondContact O-CA 3.39Å; W373-C396 HydrophobicContact CD2-CB 4.42Å; W373-C396 HydrophobicContact CE3-CB 3.8Å; W373-C396 HydrophobicContact CH2-CB 4.06Å; W373-C396 HydrophobicContact CZ3-CB 3.6Å; C396-S404 VanDerWaalsContact CB-O 3.23Å; C396-S404 WeakPolarHBondContact CB-O 3.46Å; C396-S404 PolarHBondContact O-N 2.88Å; C396-S404 PolarHBondContact SG-O 3.34Å; C396-S404 VanDerWaalsContact SG-O 3.38Å; C396-C407 HydrophobicContact CB-CB 3.67Å; C396-C407 WeakPolarHBondContact CB-SG 3.26Å; C396-C407 WeakPolarHBondContact SG-CB 3.39Å; C396-C407 PolarHBondContact SG-N 2.95Å; C396-C407 CovalentContact SG-SG 2.02Å; C396-C407 PolarHBondContact SG-SG 2.83Å
397	K	75.4	Confident	74.6	Confident	44 Å²	44	66 Å²	66	19%	0.191	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.2	179.5	-59.1	-164.4	-158.8	156.5	0	112.1	P371 H372 E374 E395 S402 L403	P371-K397 CarbonylContact C-O 3.59Å; P371-K397 WeakPolarHBondContact CA-O 3.29Å; P371-K397 VanDerWaalsContact CB-O 3.27Å; P371-K397 WeakPolarHBondContact CB-O 3.44Å; H372-K397 PolarHBondContact N-O 2.92Å; H372-K397 PolarHBondContact ND1-O 2.68Å; H372-K397 PolarHBondContact O-N 2.87Å; E374-K397 HydrophobicContact CG-CD 4.48Å; E374-K397 WeakPolarHBondContact OE1-CD 3.33Å; E374-K397 WeakPolarHBondContact OE2-CD 3.46Å; E374-K397 VanDerWaalsContact OE2-CE 3.31Å; E374-K397 WeakPolarHBondContact OE2-CE 3.46Å; E374-K397 IonicContact OE2-NZ 3.64Å; E374-K397 PolarHBondContact OE2-NZ 3.33Å; E395-K397 WeakPolarHBondContact OE2-CE 3.49Å; K397-S402 CarbonylContact C-O 3.57Å; K397-S402 VanDerWaalsContact CA-O 3.29Å; K397-S402 WeakPolarHBondContact CA-O 3.35Å; K397-L403 HydrophobicContact CG-CD2 4.21Å
398	S	72.4	Confident	74	Confident	28 Å²	28	62.8 Å²	62.8	20%	0.196	36%	0.359	C	S	.	.			trans	-73.4	168.6	170.3	-143.3	0	0	0	0	110.9	D400 G401 S402	S398-D400 PolarHBondContact O-N 2.71Å; S398-D400 VanDerWaalsContact O-N 3.08Å; S398-G401 PolarHBondContact O-N 2.85Å; S398-S402 WeakPolarHBondContact CB-OG 3.45Å; S398-S402 PolarHBondContact N-O 3.04Å
399	T	62.7	Low	73.4	Confident	80 Å²	80	67.7 Å²	67.7	49%	0.491	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-36.1	169.6	44.8	0	0	0	0	113.3	E369 G401	E369-T399 HydrophobicContact CB-CG2 3.95Å; T399-G401 PolarHBondContact O-N 3.46Å
400	D	66.6	Low	72.7	Confident	131 Å²	131	71.9 Å²	71.9	70%	0.701	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	14	-175.5	-24.6	-53.1	0	0	0	112.9	S398 S402	S398-D400 PolarHBondContact O-N 2.71Å; S398-D400 VanDerWaalsContact O-N 3.08Å; D400-S402 PolarHBondContact O-N 2.88Å
401	G	64.6	Low	72.3	Confident	48 Å²	48	74.1 Å²	74.1	50%	0.495	43%	0.429	S	S	.	.	S	Bend	trans	70.1	6.7	-177.3	0	0	0	0	0	114.9	S398 T399	S398-G401 PolarHBondContact O-N 2.85Å; T399-G401 PolarHBondContact O-N 3.46Å
402	S	70.8	Confident	72.3	Confident	58 Å²	58	74 Å²	74	41%	0.406	43%	0.425	S	S	.	.			trans	-84.3	140.4	-177	62	0	0	0	0	112.6	K397 S398 D400 S404	K397-S402 CarbonylContact C-O 3.57Å; K397-S402 VanDerWaalsContact CA-O 3.29Å; K397-S402 WeakPolarHBondContact CA-O 3.35Å; S398-S402 WeakPolarHBondContact CB-OG 3.45Å; S398-S402 PolarHBondContact N-O 3.04Å; D400-S402 PolarHBondContact O-N 2.88Å; S402-S404 PolarHBondContact O-N 2.79Å
403	L	65.7	Low	72.3	Confident	124 Å²	124	72.9 Å²	72.9	65%	0.649	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-64.8	124.4	180	-69.8	171.9	0	0	0	111.5	E395 K397	E395-L403 HydrophobicContact CB-CD2 3.96Å; E395-L403 HydrophobicContact CG-CD2 4.31Å; E395-L403 WeakPolarHBondContact OE2-CD2 3.38Å; K397-L403 HydrophobicContact CG-CD2 4.21Å
404	S	68.5	Low	72.3	Confident	30 Å²	30	74.2 Å²	74.2	21%	0.21	44%	0.44	C	S	.	.			trans	-122	154.6	-175	-179	0	0	0	0	111.2	C396 S402 K406	C396-S404 VanDerWaalsContact CB-O 3.23Å; C396-S404 WeakPolarHBondContact CB-O 3.46Å; C396-S404 PolarHBondContact O-N 2.88Å; C396-S404 PolarHBondContact SG-O 3.34Å; C396-S404 VanDerWaalsContact SG-O 3.38Å; S402-S404 PolarHBondContact O-N 2.79Å; S404-K406 PolarHBondContact OG-N 2.03Å
405	A	64.6	Low	72.1	Confident	105 Å²	105	76.6 Å²	76.6	87%	0.868	46%	0.457	S	S	*	.	S	Bend	trans	-112.2	15	175.3	0	0	0	0	0	112.4
406	K	63.3	Low	72.1	Confident	179 Å²	179	78 Å²	78	78%	0.778	47%	0.465	S	S	*	.			trans	-103.9	-4.4	-169.8	-60.4	178.2	-176.2	172.4	0	115.1	P371 S404	P371-K406 HydrophobicContact CG-CB 3.93Å; S404-K406 PolarHBondContact OG-N 2.03Å
407	C	74	Confident	72.1	Confident	11 Å²	11	81.2 Å²	81.2	7%	0.074	48%	0.479	C	S	.	.	S	Bend	trans	-68.3	148.2	175.3	-56.6	0	0	0	0	111.1	P371 H372 W373 C396 P409	P371-C407 VanDerWaalsContact C-SG 3.52Å; P371-C407 PolarHBondContact O-SG 2.87Å; P371-C407 VanDerWaalsContact O-SG 3.42Å; H372-C407 VanDerWaalsContact C-SG 3.55Å; H372-C407 PolarHBondContact O-SG 2.92Å; H372-C407 VanDerWaalsContact O-SG 3.37Å; W373-C407 HydrophobicContact CD2-CB 3.95Å; W373-C407 VanDerWaalsContact CE2-CB 3.45Å; W373-C407 HydrophobicContact CG-CB 4.41Å; W373-C407 HydrophobicContact CH2-CB 4.19Å; W373-C407 HydrophobicContact CZ2-CB 3.59Å; C396-C407 HydrophobicContact CB-CB 3.67Å; C396-C407 WeakPolarHBondContact CB-SG 3.26Å; C396-C407 WeakPolarHBondContact SG-CB 3.39Å; C396-C407 PolarHBondContact SG-N 2.95Å; C396-C407 CovalentContact SG-SG 2.02Å; C396-C407 PolarHBondContact SG-SG 2.83Å; C407-P409 WeakPolarHBondContact O-CD 3.49Å
408	D	70.3	Confident	72.4	Confident	79 Å²	79	86.2 Å²	86.2	42%	0.422	50%	0.503	S	S	.	.			trans	-64.4	122.4	-179.4	-175.4	-5.5	0	0	0	111.5	W373 L410 T411	W373-D408 WeakPolarHBondContact CZ2-O 3.41Å; W373-D408 PolarHBondContact NE1-O 2.79Å; D408-L410 PolarHBondContact O-N 2.78Å; D408-L410 WeakPolarHBondContact OD1-CB 3.45Å; D408-L410 PolarHBondContact OD1-N 2.94Å; D408-T411 HydrophobicContact CB-CG2 4.44Å; D408-T411 PolarHBondContact O-N 3.03Å; D408-T411 PolarHBondContact O-OG1 3.09Å; D408-T411 VanDerWaalsContact O-OG1 3.07Å
409	P	67.4	Low	72.7	Confident	110 Å²	110	85.6 Å²	85.6	71%	0.714	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-59.3	-24.8	174.3	-24.5	35.3	0	0	0	114.7	C407 T411 K412	C407-P409 WeakPolarHBondContact O-CD 3.49Å; P409-T411 VanDerWaalsContact C-N 3.34Å; P409-K412 WeakPolarHBondContact O-CB 3.45Å; P409-K412 PolarHBondContact O-N 3.03Å
410	L	64.5	Low	73.5	Confident	161 Å²	161	85.5 Å²	85.5	84%	0.843	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-72.1	-27.5	179.6	-65.1	171.7	0	0	0	112.8	D408	D408-L410 PolarHBondContact O-N 2.78Å; D408-L410 WeakPolarHBondContact OD1-CB 3.45Å; D408-L410 PolarHBondContact OD1-N 2.94Å
411	T	75.9	Confident	73.7	Confident	88 Å²	88	81.5 Å²	81.5	54%	0.54	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-94.2	2.3	178.5	60.3	0	0	0	0	113	W373 D408 P409 P413	W373-T411 PolarHBondContact NE1-OG1 2.77Å; W373-T411 VanDerWaalsContact NE1-OG1 3.16Å; D408-T411 HydrophobicContact CB-CG2 4.44Å; D408-T411 PolarHBondContact O-N 3.03Å; D408-T411 PolarHBondContact O-OG1 3.09Å; D408-T411 VanDerWaalsContact O-OG1 3.07Å; P409-T411 VanDerWaalsContact C-N 3.34Å; T411-P413 VanDerWaalsContact O-CD 3.28Å; T411-P413 WeakPolarHBondContact O-CD 3.45Å
412	K	79.1	Confident	73.9	Confident	98 Å²	98	82.1 Å²	82.1	43%	0.426	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.1	121.8	-174.6	-174.3	171.6	-175.5	165.7	0	111.7	W373 V394 P409	W373-K412 HydrophobicContact CD2-CB 4.37Å; W373-K412 HydrophobicContact CD2-CG 4.19Å; W373-K412 HydrophobicContact CE3-CD 4.49Å; W373-K412 HydrophobicContact CE3-CG 4.13Å; W373-K412 HydrophobicContact CH2-CB 4.17Å; W373-K412 HydrophobicContact CH2-CD 3.64Å; W373-K412 HydrophobicContact CH2-CG 3.86Å; W373-K412 HydrophobicContact CZ2-CB 3.68Å; W373-K412 HydrophobicContact CZ2-CD 4.09Å; W373-K412 HydrophobicContact CZ2-CG 3.87Å; W373-K412 HydrophobicContact CZ3-CD 3.85Å; W373-K412 HydrophobicContact CZ3-CG 3.97Å; V394-K412 HydrophobicContact CG1-CD 4.4Å; V394-K412 VanDerWaalsContact CG1-CE 3.45Å; V394-K412 HydrophobicContact CG1-CG 3.89Å; V394-K412 PolarHBondContact O-NZ 2.04Å; P409-K412 WeakPolarHBondContact O-CB 3.45Å; P409-K412 PolarHBondContact O-N 3.03Å
413	P	82	Confident	73.4	Confident	36 Å²	36	84.2 Å²	84.2	23%	0.234	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-58.6	145.3	174.4	-26.5	35.5	0	0	0	113.4	W373 V375 V394 T411 S415	W373-P413 HydrophobicContact CB-CG 4.06Å; V375-P413 HydrophobicContact CG1-CB 3.62Å; V375-P413 HydrophobicContact CG1-CG 3.69Å; V394-P413 HydrophobicContact CG1-CB 3.95Å; V394-P413 HydrophobicContact CG1-CG 4.08Å; V394-P413 HydrophobicContact CG2-CB 4.46Å; T411-P413 VanDerWaalsContact O-CD 3.28Å; T411-P413 WeakPolarHBondContact O-CD 3.45Å; P413-S415 PolarHBondContact O-N 3.19Å
414	G	79.5	Confident	73.2	Confident	48 Å²	48	86.9 Å²	86.9	50%	0.495	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-63.4	129.5	174.9	0	0	0	0	0	112.1	W378 R392	W378-G414 WeakPolarHBondContact CH2-O 3.46Å; R392-G414 PolarHBondContact NE-O 2.64Å; R392-G414 PolarHBondContact NH2-O 2.89Å
415	S	83.4	Confident	72.5	Confident	63 Å²	63	89.7 Å²	89.7	44%	0.441	52%	0.521	S	S	.	.	S	Bend	trans	-93.6	3.8	-178.8	63.2	0	0	0	0	114.3	M391 R392 P413	M391-S415 VanDerWaalsContact CA-O 3.3Å; M391-S415 WeakPolarHBondContact CA-O 3Å; R392-S415 PolarHBondContact N-O 2.87Å; R392-S415 VanDerWaalsContact N-O 3.08Å; P413-S415 PolarHBondContact O-N 3.19Å
416	M	80.4	Confident	72	Confident	109 Å²	109	88.3 Å²	88.3	54%	0.537	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	134	-178.1	-175.6	173.9	-78.4	0	0	109.8	I389 Q390 M391	I389-M416 HydrophobicContact CD1-SD 4.4Å; I389-M416 HydrophobicContact CG2-CE 4.06Å; I389-M416 HydrophobicContact CG2-CG 3.37Å; I389-M416 HydrophobicContact CG2-SD 3.77Å; Q390-M416 WeakPolarHBondContact O-CA 3.37Å; M391-M416 HydrophobicContact CG-CE 3.91Å; M391-M416 HydrophobicContact SD-CE 3.75Å
417	Q	82.6	Confident	71.3	Confident	76 Å²	76	83.4 Å²	83.4	36%	0.355	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	160.7	173.7	74.5	178.6	11.8	0	0	111.5	W378 I389 Q390	W378-Q417 HydrophobicContact CD2-CG 3.92Å; W378-Q417 VanDerWaalsContact CE2-OE1 3.23Å; W378-Q417 HydrophobicContact CE3-CG 3.81Å; W378-Q417 HydrophobicContact CH2-CB 3.67Å; W378-Q417 HydrophobicContact CH2-CG 3.72Å; W378-Q417 HydrophobicContact CZ2-CB 3.98Å; W378-Q417 VanDerWaalsContact CZ2-CD 3.49Å; W378-Q417 HydrophobicContact CZ2-CG 3.82Å; W378-Q417 HydrophobicContact CZ3-CB 4.02Å; W378-Q417 HydrophobicContact CZ3-CG 3.72Å; I389-Q417 WeakPolarHBondContact CA-O 3.47Å; Q390-Q417 HydrophobicContact CB-CG 4.09Å; Q390-Q417 PolarHBondContact N-O 3.42Å; Q390-Q417 PolarHBondContact O-N 2.91Å; Q390-Q417 VanDerWaalsContact OE1-NE2 3.07Å
418	Q	81.5	Confident	69.5	Low	148 Å²	148	88.3 Å²	88.3	69%	0.692	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.9	137.6	178.9	-153.6	166.9	15.3	0	0	110.4	G388	G388-Q418 WeakPolarHBondContact O-CG 3.46Å
419	C	79.7	Confident	67.8	Low	15 Å²	15	91.4 Å²	91.4	10%	0.101	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.1	162.2	-179.1	56.2	0	0	0	0	111.2	C381 Q387 G388 I389 Q390	C381-C419 WeakPolarHBondContact CA-SG 3.07Å; C381-C419 HydrophobicContact CB-CB 3.92Å; C381-C419 WeakPolarHBondContact CB-SG 3.33Å; C381-C419 WeakPolarHBondContact SG-CB 3.18Å; C381-C419 CovalentContact SG-SG 2.03Å; C381-C419 PolarHBondContact SG-SG 3.01Å; Q387-C419 CarbonylContact C-O 3.6Å; Q387-C419 WeakPolarHBondContact CA-O 3.45Å; G388-C419 PolarHBondContact N-O 2.72Å; G388-C419 PolarHBondContact O-N 2.69Å; G388-C419 PolarHBondContact O-SG 3.1Å; I389-C419 PolarHBondContact N-SG 2.84Å; Q390-C419 HydrophobicContact CG-CB 3.82Å
420	S	79.8	Confident	66.3	Low	79 Å²	79	91.8 Å²	91.8	55%	0.552	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-136.3	135.8	167.8	-177.8	0	0	0	0	108.8	G386 G422	G386-S420 WeakPolarHBondContact O-CA 3.27Å; G386-S420 PolarHBondContact O-OG 2.87Å; S420-G422 VanDerWaalsContact C-N 3.33Å; S420-G422 PolarHBondContact OG-N 2.88Å
421	T	70.6	Confident	64.7	Low	47 Å²	47	93 Å²	93	29%	0.288	56%	0.562	S	S	.	*			trans	-89.2	0.4	177.6	64.9	0	0	0	0	113.3	C381 V383 S384 C385 G386 I423	C381-T421 HydrophobicContact CB-CG2 3.89Å; V383-T421 VanDerWaalsContact O-CG2 3.25Å; V383-T421 WeakPolarHBondContact O-CG2 3.43Å; S384-T421 PolarHBondContact O-OG1 2.91Å; C385-T421 WeakPolarHBondContact CA-OG1 3.45Å; G386-T421 PolarHBondContact O-N 2.83Å; G386-T421 VanDerWaalsContact O-N 3.12Å; T421-I423 PolarHBondContact O-N 2.82Å
422	G	68.2	Low	62.6	Low	60 Å²	60	95.5 Å²	95.5	62%	0.619	58%	0.577	S	S	*	*	S	Bend	trans	69.5	-7.4	-178.3	0	0	0	0	0	115.2	S420	S420-G422 VanDerWaalsContact C-N 3.33Å; S420-G422 PolarHBondContact OG-N 2.88Å
423	I	61.3	Low	60.2	Low	103 Å²	103	94.2 Å²	94.2	53%	0.528	59%	0.592	S	S	.	*			trans	-92.6	126.6	-178	-61.9	159.1	0	0	0	109	C385 G386 T421	C385-I423 CarbonylContact C-O 3.25Å; C385-I423 WeakPolarHBondContact CA-O 3.46Å; C385-I423 HydrophobicContact CB-CB 4.05Å; C385-I423 HydrophobicContact CB-CG2 3.74Å; C385-I423 VanDerWaalsContact CB-O 3.29Å; C385-I423 WeakPolarHBondContact CB-O 3.3Å; G386-I423 PolarHBondContact N-O 3.21Å; T421-I423 PolarHBondContact O-N 2.82Å
424	H	59.8	Low	57.8	Low	179 Å²	179	96.4 Å²	96.4	83%	0.829	62%	0.62	S	S	*	*			trans	-85.9	130.7	176.3	-73.8	-89	0	0	0	112	G426	H424-G426 VanDerWaalsContact C-N 3.31Å; H424-G426 PolarHBondContact O-N 2.68Å
425	C	55	Low	55.7	Low	90 Å²	90	100.1 Å²	100.1	61%	0.608	63%	0.633	S	S	*	*			trans	-75.3	72.4	178.6	-52.1	0	0	0	0	112.7	C385	C385-C425 HydrophobicContact CB-CB 4.14Å; C385-C425 WeakPolarHBondContact CB-SG 3.3Å; C385-C425 PolarHBondContact O-SG 3.12Å; C385-C425 VanDerWaalsContact SG-CA 3.58Å; C385-C425 WeakPolarHBondContact SG-CB 3.47Å; C385-C425 CovalentContact SG-SG 2.04Å; C385-C425 PolarHBondContact SG-SG 2.99Å
426	G	54.6	Low	53.1	Low	76 Å²	76	104.3 Å²	104.3	78%	0.784	65%	0.649	S	S	*	*			trans	-87.2	140.9	172.7	0	0	0	0	0	112.7	H424	H424-G426 VanDerWaalsContact C-N 3.31Å; H424-G426 PolarHBondContact O-N 2.68Å
427	G	47	Very low	50.8	Low	76 Å²	76	106.6 Å²	106.6	78%	0.784	66%	0.662	S	S	*	*			trans	-109	141.7	-172.6	0	0	0	0	0	116.1
428	S	36.4	Very low	48.4	Very low	113 Å²	113	109.8 Å²	109.8	79%	0.79	69%	0.686	S	S	*	*			trans	98.3	134.7	152	-147.1	0	0	0	0	120.5
429	L	35.3	Very low	45.9	Very low	144 Å²	144	106.2 Å²	106.2	75%	0.754	69%	0.689	S	S	*	*			trans	78.3	120.1	154.3	-75.9	156.6	0	0	0	122.7
430	N	34.8	Very low	43.5	Very low	118 Å²	118	110.2 Å²	110.2	63%	0.631	72%	0.718	S	S	*	*			trans	83.2	108	148	-67.8	-41.9	0	0	0	122
431	K	31.1	Very low	41.1	Very low	188 Å²	188	110.3 Å²	110.3	82%	0.817	72%	0.718	S	S	*	*				51.5	123.8	118.1	-67.6	176.1	177.1	177.2	0	117.8
432	V	32.2	Very low	39.1	Very low	139 Å²	139	118 Å²	118	84%	0.842	74%	0.742	S	S	*	*			cis	-151.5	154.7	23.3	179.7	0	0	0	0	109.3
433	G	29.9	Very low	37.2	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	75%	0.745	S	S	*	*			cis	125.1	72.4	-4.2	0	0	0	0	0	115.7
434	G	31.6	Very low	35.7	Very low	81 Å²	81	121.8 Å²	121.8	84%	0.835	76%	0.756	S	S	*	*			trans	-123.5	107.3	-171.3	0	0	0	0	0	117.4
435	T	33.6	Very low	34.3	Very low	126 Å²	126	119 Å²	119	77%	0.773	75%	0.747	S	S	*	*			trans	5.5	108	156.9	-46.8	0	0	0	0	123.5
436	I	30.3	Very low	33	Very low	151 Å²	151	121.6 Å²	121.6	77%	0.774	75%	0.75	S	S	*	*			trans	34.8	128.6	132	-19	169.4	0	0	0	122.9
437	I	31.8	Very low	31.8	Very low	157 Å²	157	127.4 Å²	127.4	81%	0.805	75%	0.749	S	S	*	*				153	136.2	121.2	-76.8	-177.5	0	0	0	114
438	V	32.3	Very low	31	Very low	143 Å²	143	129 Å²	129	87%	0.867	75%	0.747	S	S	*	*			trans	-54.4	141.5	179.6	-178.4	0	0	0	0	116.6
439	G	28.1	Very low	30.7	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	74%	0.737	S	S	*	*			trans	163	155.7	149.5	0	0	0	0	0	114
440	S	28.8	Very low	30.5	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	74%	0.738	S	S	*	*			cis	-179.6	107.5	-47.8	173.8	0	0	0	0	106.1
441	S	29.8	Very low	30.4	Very low	81 Å²	81	133.6 Å²	133.6	57%	0.566	74%	0.74	S	S	*	*			trans	68.2	151.7	156.1	73.2	0	0	0	0	121.7
442	R	28.4	Very low	30.5	Very low	209 Å²	209	131.1 Å²	131.1	79%	0.789	74%	0.735	S	S	*	*			trans	82.2	115	140.2	94.6	-168.4	76.7	172.7	4.6	122.1
443	S	29.8	Very low	30.3	Very low	96 Å²	96	130.8 Å²	130.8	67%	0.671	73%	0.729	S	S	*	*				100.5	120.1	121.7	-69.9	0	0	0	0	123.2
444	L	29.9	Very low	30.5	Very low	147 Å²	147	132.3 Å²	132.3	77%	0.77	73%	0.728	S	S	*	*			trans	77.6	132.8	130.7	-63.8	169.1	0	0	0	122
445	N	29.9	Very low	30.7	Very low	121 Å²	121	132.4 Å²	132.4	65%	0.647	72%	0.716	S	S	*	*			trans	66.9	153.6	141.5	-67.3	28.4	0	0	0	118.8
446	E	27.8	Very low	30.7	Very low	144 Å²	144	133.2 Å²	133.2	67%	0.673	72%	0.716	S	S	*	*			cis	-153.8	150.4	-9.1	-126.3	172.5	116	0	0	112.9
447	R	29.1	Very low	31.2	Very low	198 Å²	198	129.7 Å²	129.7	75%	0.747	71%	0.709	S	S	*	*			trans	22.4	114.4	133.7	-174.3	-171.8	-167.8	152.6	5.3	119.8
448	S	29.6	Very low	31.6	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	71%	0.709	S	S	*	*				-173.7	126.8	119.6	-77.1	0	0	0	0	108.8
449	E	30.4	Very low	32.2	Very low	123 Å²	123	130.8 Å²	130.8	58%	0.575	71%	0.706	S	S	*	*				98.4	132.4	52.8	-160.8	-168.6	-89	0	0	111.5
450	R	32.4	Very low	32.8	Very low	203 Å²	203	133.3 Å²	133.3	77%	0.766	70%	0.703	S	S	*	*			trans	106.4	153.3	159	-56.6	-171.6	-175.1	-132.2	-15.8	120.5
451	Q	31.1	Very low	33.4	Very low	147 Å²	147	134.2 Å²	134.2	69%	0.687	70%	0.699	S	S	*	*			trans	66.2	125.7	172.2	-104.7	47.1	27.3	0	0	116.2
452	L	34	Very low	34.2	Very low	135 Å²	135	138.1 Å²	138.1	71%	0.707	71%	0.709	S	S	*	*			cis	63.1	129.2	41.8	-63.3	165.3	0	0	0	112.1
453	D	28.5	Very low	35	Very low	132 Å²	132	135.1 Å²	135.1	71%	0.706	71%	0.708	S	S	*	*			cis	-166.5	174.6	-7	-161.3	-4.5	0	0	0	107.8
454	S	33.3	Very low	35.7	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	71%	0.713	S	S	*	*			trans	63	162.1	159.4	67.4	0	0	0	0	117.8
455	S	35.8	Very low	36.3	Very low	84 Å²	84	137.8 Å²	137.8	59%	0.587	71%	0.711	S	S	*	*			cis	-166.3	176.3	-23.6	46	0	0	0	0	110.7
456	D	33.6	Very low	37.1	Very low	143 Å²	143	139.1 Å²	139.1	77%	0.765	72%	0.718	S	S	*	*			trans	84	127.5	154.3	-50.7	-42.4	0	0	0	116.8
457	A	41.8	Very low	37.8	Very low	77 Å²	77	140.9 Å²	140.9	64%	0.636	73%	0.726	S	S	*	*				84	125	50.9	0	0	0	0	0	113.7
458	D	39.1	Very low	38.5	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	72%	0.723	S	S	*	*			cis	-130.3	-102.2	-26.5	-93.3	-56.6	0	0	0	113
459	E	45	Very low	39.2	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	73%	0.732	S	S	*	*			cis	-168.9	169	-5.2	-145.7	164.3	-159.9	0	0	109.9
460	D	40.7	Very low	39.9	Very low	126 Å²	126	139 Å²	139	67%	0.674	74%	0.742	S	S	*	*			trans	73	128.3	156.5	-87.6	20.8	0	0	0	127.8
461	N	42.1	Very low	40.5	Very low	117 Å²	117	135.2 Å²	135.2	63%	0.626	74%	0.741	S	S	*	*			trans	74	148.4	138.4	-58.5	-20.1	0	0	0	122.2
462	E	45.5	Very low	41	Very low	164 Å²	164	135.5 Å²	135.5	77%	0.766	75%	0.747	S	S	*	*			cis	156.6	161	-10.6	-99.2	177	172.1	0	0	104.3
463	D	45.5	Very low	41.3	Very low	146 Å²	146	136 Å²	136	78%	0.781	75%	0.751	S	S	*	*			cis	-167	-159.6	-32.7	-145.9	-32.8	0	0	0	109.2
464	E	44.5	Very low	41.8	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.762	75%	0.752	S	S	*	*			trans	82.3	152.1	165.3	-58.1	-158	-171.6	0	0	119.5
465	N	42.6	Very low	42	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	75%	0.753	S	S	*	*			cis	-176.8	162.4	-16.9	-93.4	-27.1	0	0	0	107.2
466	D	46.2	Very low	41.9	Very low	150 Å²	150	140.8 Å²	140.8	80%	0.802	77%	0.765	S	S	*	*			cis	-142.9	-144.3	-15.1	-161.4	0	0	0	0	106.8
467	E	42.6	Very low	42	Very low	181 Å²	181	137.1 Å²	137.1	85%	0.846	76%	0.761	S	S	*	*			cis	-142	161.6	6.8	-60.1	171.5	112.6	0	0	107.9
468	G	44.9	Very low	41.9	Very low	66 Å²	66	141.9 Å²	141.9	68%	0.68	77%	0.77	S	S	*	*				76.6	136.4	80.3	0	0	0	0	0	115
469	D	44	Very low	41.6	Very low	176 Å²	176	140.9 Å²	140.9	94%	0.941	77%	0.765	S	S	*	*			cis	-149.7	-158.9	-2.9	-84.3	-27.8	0	0	0	110.8
470	D	43.8	Very low	41.1	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	76%	0.764	S	S	*	*			trans	-147.7	-173.6	-142.5	-165.8	20.3	0	0	0	118.2
471	V	45.5	Very low	41	Very low	123 Å²	123	139.4 Å²	139.4	75%	0.745	77%	0.767	S	S	*	*			trans	73.9	156.9	164.8	-51.9	0	0	0	0	119.7
472	D	41.2	Very low	40.9	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	78%	0.777	S	S	*	*			cis	-154.4	-179.5	26.2	-161.4	0.8	0	0	0	113.3
473	D	41.6	Very low	40.6	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	77%	0.77	S	S	*	*			trans	-136.5	-160.8	-163	-166.3	16.3	0	0	0	116.7
474	L	39.4	Very low	40	Very low	138 Å²	138	137.8 Å²	137.8	72%	0.723	77%	0.772	S	S	*	*			trans	97.4	153.1	168.8	-55.7	171.2	0	0	0	118.5
475	E	37.6	Very low	39.6	Very low	163 Å²	163	133 Å²	133	76%	0.762	77%	0.767	S	S	*	*			cis	-170.6	152.3	-31	-165.2	-170.8	167.9	0	0	110.8
476	S	32.9	Very low	39.2	Very low	119 Å²	119	133.8 Å²	133.8	83%	0.832	77%	0.77	S	S	*	*			trans	69.6	154.1	160.6	76.7	0	0	0	0	120.8
477	G	36.1	Very low	38.6	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	76%	0.764	S	S	*	*			cis	165.9	149.9	-12.7	0	0	0	0	0	115.4
478	Q	38.2	Very low	38.2	Very low	177 Å²	177	132.9 Å²	132.9	83%	0.827	76%	0.764	S	S	*	*			trans	66.3	151.4	158.5	-60.8	-173.6	-98.9	0	0	119.8
479	D	33.5	Very low	37.7	Very low	131 Å²	131	133 Å²	133	70%	0.701	76%	0.758	S	S	*	*			cis	-157.9	176.3	-18.5	-82.3	-25.9	0	0	0	105.5
480	T	35.2	Very low	37.3	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	75%	0.746	S	S	*	*			cis	-129.6	-170.3	16.7	59.2	0	0	0	0	110.2
481	D	38.4	Very low	36.7	Very low	137 Å²	137	131.6 Å²	131.6	73%	0.733	75%	0.745	S	S	*	*			cis	77.1	128.1	24.8	-137.7	28.7	0	0	0	115.5
482	D	39.9	Very low	37.1	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	74%	0.742	S	S	*	*			cis	-60	174	-3.1	-42.6	-106	0	0	0	114.3
483	G	38	Very low	36.6	Very low	61 Å²	61	130.9 Å²	130.9	63%	0.629	74%	0.742	S	S	*	*			cis	105.8	135.4	3.4	0	0	0	0	0	113.4
484	E	33.9	Very low	36	Very low	176 Å²	176	130.7 Å²	130.7	82%	0.822	74%	0.741	S	S	*	*			cis	-81.9	-155.7	-11	-63.2	-168	64.2	0	0	110.9
485	G	36.5	Very low	35.5	Very low	63 Å²	63	134.7 Å²	134.7	65%	0.649	75%	0.748	S	S	*	*			cis	81	157.7	12	0	0	0	0	0	113.9
486	L	33.5	Very low	35	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	75%	0.746	S	S	*	*			cis	-154.6	168	-6.8	-71.8	180	0	0	0	106.2
487	S	33.1	Very low	34.7	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	75%	0.749	S	S	*	*			cis	-176.1	151.1	-16.1	49.3	0	0	0	0	105.1
488	Y	34.2	Very low	34.4	Very low	218 Å²	218	142.5 Å²	142.5	86%	0.855	76%	0.758	S	S	*	*			cis	-153	165.8	5.3	-110.1	-166.1	0	0	0	106.6
489	A	35.7	Very low	33.8	Very low	67 Å²	67	140.2 Å²	140.2	55%	0.554	76%	0.756	S	S	*	*			cis	80.8	137.6	42.3	0	0	0	0	0	113.8
490	D	35	Very low	33.5	Very low	129 Å²	129	142.7 Å²	142.7	69%	0.69	76%	0.764	S	S	*	*			cis	-165.2	156.9	-0.5	-129.7	-7.2	0	0	0	117.5
491	Q	31.1	Very low	33.1	Very low	165 Å²	165	141.8 Å²	141.8	77%	0.771	76%	0.763	S	S	*	*			trans	65	165.6	140.2	-79	178.6	56.3	0	0	126.1
492	P	54.1	Low	32.6	Very low	103 Å²	103	146 Å²	146	67%	0.669	77%	0.768	S	S	*	*			trans	-136.4	-165.4	-155.3	44.9	-25.7	0	0	0	116.2
493	L	31.3	Very low	32	Very low	159 Å²	159	145.1 Å²	145.1	83%	0.832	76%	0.763	S	S	*	*			trans	160.7	177.7	133	-84.5	175.8	0	0	0	114.7
494	L	29.5	Very low	31.6	Very low	143 Å²	143	148.1 Å²	148.1	75%	0.749	76%	0.764	S	S	*	*			trans	-109.3	160.7	-173.4	-46.1	86.2	0	0	0	113.3
495	Y	27.1	Very low	31.5	Very low	222 Å²	222	146 Å²	146	87%	0.871	75%	0.754	S	S	*	*				173.1	152.9	116.7	-113.8	-101	0	0	0	116.6
496	A	27.6	Very low	31.1	Very low	89 Å²	89	150.6 Å²	150.6	74%	0.736	76%	0.759	S	S	*	*			trans	55.4	159	148.2	0	0	0	0	0	125.5
497	H	26.8	Very low	30.7	Very low	192 Å²	192	147.6 Å²	147.6	89%	0.889	76%	0.756	S	S	*	*			trans	-96.4	159.3	167.4	-68.3	-99	0	0	0	112.4
498	R	29.2	Very low	31.3	Very low	230 Å²	230	148.5 Å²	148.5	87%	0.868	76%	0.76	S	S	*	*				142.6	156.8	116	-161.7	-179.5	-174.5	178.9	2.7	114.1
499	T	26.7	Very low	31	Very low	129 Å²	129	145.9 Å²	145.9	79%	0.791	76%	0.761	S	S	*	*			trans	94.7	176.9	164	75.5	0	0	0	0	117.9
500	Q	27.3	Very low	30.4	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	76%	0.76	S	S	*	*			trans	-138.2	175.7	-146.3	-62.2	172.6	-57	0	0	113
501	S	26.6	Very low	30.5	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	76%	0.762	S	S	*	*			trans	92.4	125.8	170.6	-49.6	0	0	0	0	114.1
502	R	28.1	Very low	30.4	Very low	225 Å²	225	148 Å²	148	85%	0.849	76%	0.757	S	S	*	*			cis	90.1	141.5	33.2	-166.7	-166.8	-173.3	-175.9	4.3	111.8
503	L	27.8	Very low	29.2	Very low	137 Å²	137	149.6 Å²	149.6	72%	0.717	77%	0.765	S	S	*	*			trans	77.9	146.5	-172.8	-74.2	100.7	0	0	0	114.6
504	N	28.9	Very low	29	Very low	124 Å²	124	148.8 Å²	148.8	66%	0.663	76%	0.759	S	S	*	*			cis	-174.2	171.3	-31	-132.9	19.6	0	0	0	109.2
505	Q	32.2	Very low	29.1	Very low	131 Å²	131	148.2 Å²	148.2	61%	0.612	75%	0.752	S	S	*	*			trans	66.9	154.2	153.1	-68.7	164.3	-94.3	0	0	116.7
506	E	26.5	Very low	29.2	Very low	161 Å²	161	144.7 Å²	144.7	75%	0.752	75%	0.747	S	S	*	*			cis	-150.1	165	-14	-124.9	147.9	-173	0	0	110.5
507	A	26.7	Very low	29.3	Very low	87 Å²	87	147.2 Å²	147.2	72%	0.719	75%	0.746	S	S	*	*			trans	-94.4	-163.4	170.7	0	0	0	0	0	109.1
508	P	45.8	Very low	29.3	Very low	115 Å²	115	145.8 Å²	145.8	75%	0.747	74%	0.744	S	S	*	*			cis	-134.1	-170	-9.5	42.4	-25.3	0	0	0	113.4
509	D	26.1	Very low	29.2	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	74%	0.738	S	S	*	*				-153.1	159.3	118.8	-130.7	-29.8	0	0	0	112.5
510	E	23.7	Very low	29.3	Very low	115 Å²	115	140.1 Å²	140.1	54%	0.537	74%	0.744	S	S	.	*			trans	-114.2	-174	-171.6	-131.5	-155.4	141.1	0	0	111	R512	E510-R512 WeakPolarHBondContact OE1-CG 3.48Å; E510-R512 PolarHBondContact OE1-N 2.78Å; E510-R512 IonicContact OE2-CZ 3Å; E510-R512 IonicContact OE2-NE 2.77Å; E510-R512 IonicContact OE2-NH1 2.83Å; E510-R512 PolarHBondContact OE2-NH1 2.64Å; E510-R512 IonicContact OE2-NH2 3.27Å
511	P	37.6	Very low	29.7	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	73%	0.733	S	S	*	*			cis	-149.3	144	41.2	38.8	-15.2	0	0	0	120.7
512	R	27.8	Very low	29.9	Very low	178 Å²	178	137.5 Å²	137.5	67%	0.672	73%	0.734	S	S	*	*			trans	31.4	127.5	133.3	-57	-173.1	164.1	74	11.1	122.8	E510	E510-R512 WeakPolarHBondContact OE1-CG 3.48Å; E510-R512 PolarHBondContact OE1-N 2.78Å; E510-R512 IonicContact OE2-CZ 3Å; E510-R512 IonicContact OE2-NE 2.77Å; E510-R512 IonicContact OE2-NH1 2.83Å; E510-R512 PolarHBondContact OE2-NH1 2.64Å; E510-R512 IonicContact OE2-NH2 3.27Å
513	T	29.4	Very low	30.4	Very low	135 Å²	135	133.7 Å²	133.7	83%	0.828	73%	0.73	S	S	*	*				-141	116.3	110.9	42.6	0	0	0	0	108.8
514	M	27.6	Very low	31	Very low	143 Å²	143	134 Å²	134	70%	0.704	73%	0.733	S	S	*	*				69.8	137.6	78.9	-67.1	-74.8	-75.2	0	0	113.6
515	H	31.2	Very low	31.1	Very low	131 Å²	131	136.9 Å²	136.9	61%	0.606	74%	0.74	S	S	*	*			cis	-171.7	164.8	-18.4	-138.3	29.3	0	0	0	106.4
516	L	29.9	Very low	31.6	Very low	148 Å²	148	138 Å²	138	78%	0.775	75%	0.75	S	S	*	*			cis	-130	172.4	10.3	-67.2	93.6	0	0	0	108.8
517	M	28.8	Very low	32.1	Very low	142 Å²	142	139.3 Å²	139.3	70%	0.7	75%	0.748	S	S	*	*			cis	92.6	131.1	16.1	-71.1	-68.9	-179.5	0	0	119.4
518	N	28.2	Very low	32.3	Very low	161 Å²	161	136.5 Å²	136.5	86%	0.861	73%	0.728	S	S	*	*			trans	66.4	140	167	-69.9	-12.7	0	0	0	121.1
519	G	26.6	Very low	32.1	Very low	72 Å²	72	138 Å²	138	74%	0.742	73%	0.725	S	S	*	*			cis	149.8	-172.9	-14.3	0	0	0	0	0	117.2
520	N	28.4	Very low	33.2	Very low	169 Å²	169	135.8 Å²	135.8	90%	0.904	71%	0.713	S	S	*	*			trans	84.7	151.1	167.5	-149.4	17.1	0	0	0	118.8
521	S	35.3	Very low	33.8	Very low	92 Å²	92	138 Å²	138	64%	0.643	72%	0.723	S	S	*	*			trans	-87.3	156.5	-161.8	-48.3	0	0	0	0	115.7
522	N	30.9	Very low	33.9	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	73%	0.726	S	S	*	*				-177	135.1	115	-92.2	-33.7	0	0	0	114.8
523	N	38.8	Very low	34.5	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	74%	0.739	S	S	*	*			trans	55.2	123.7	148.4	-59.6	-22.5	0	0	0	123
524	N	39.3	Very low	34.9	Very low	144 Å²	144	136 Å²	136	77%	0.77	73%	0.733	S	S	*	*			trans	92.4	133.6	135.1	-107.7	2.2	0	0	0	122.7
525	F	32	Very low	35.8	Very low	185 Å²	185	135.6 Å²	135.6	81%	0.811	74%	0.741	S	S	*	*			trans	74	158.5	166.4	-74.2	-81.4	0	0	0	120.3
526	N	42.9	Very low	36.5	Very low	154 Å²	154	133.7 Å²	133.7	82%	0.824	74%	0.743	S	S	*	*			trans	-114.9	142.3	-151	-59.7	-19.3	0	0	0	116.1
527	R	36	Very low	37.8	Very low	188 Å²	188	130.4 Å²	130.4	71%	0.709	73%	0.726	S	S	*	*			trans	174.9	155.9	149.4	-106.3	-177	143	-149	-14.1	109.7	A1139 A1140	R527-A1139 HydrophobicContact CB-CB 4.13Å; R527-A1139 HydrophobicContact CG-CB 3.8Å; R527-A1139 PolarHBondContact NH2-O 2.83Å; R527-A1140 PolarHBondContact NE-O 3.36Å; R527-A1140 PolarHBondContact NH2-O 3.21Å
528	G	32.4	Very low	39.3	Very low	29 Å²	29	129 Å²	129	30%	0.299	72%	0.721	S	S	.	*			trans	169.2	133.5	156.7	0	0	0	0	0	118.4	G1137 A1138	G528-G1137 CarbonylContact O-C 3.59Å; G528-G1137 WeakPolarHBondContact O-CA 3.49Å; G528-A1138 PolarHBondContact N-O 3.43Å; G528-A1138 CarbonylContact O-C 3.02Å; G528-A1138 VanDerWaalsContact O-C 3.27Å; G528-A1138 WeakPolarHBondContact O-CA 3.46Å; G528-A1138 PolarHBondContact O-N 2.9Å; G528-A1138 VanDerWaalsContact O-O 3.06Å
529	E	41.9	Very low	41.2	Very low	145 Å²	145	123.2 Å²	123.2	68%	0.678	69%	0.692	S	S	*	*			trans	-39.2	140.8	173.5	31.5	35.2	104.9	0	0	113.2	A1139	E529-A1139 HydrophobicContact CG-CB 3.53Å; E529-A1139 WeakPolarHBondContact OE2-CB 3.33Å
530	D	47.3	Very low	43.3	Very low	117 Å²	117	123 Å²	123	63%	0.626	68%	0.677	S	S	*	*			cis	73.4	132.6	25.3	-134.8	-13.5	0	0	0	116.3
531	E	37	Very low	45.6	Very low	161 Å²	161	117.2 Å²	117.2	75%	0.752	64%	0.642	S	S	*	*			trans	-146.7	151.7	-142.1	-156	167	-142.9	0	0	118.8
532	S	39.6	Very low	47.4	Very low	112 Å²	112	115.9 Å²	115.9	78%	0.783	63%	0.628	S	S	*	*			trans	-160.5	144.1	175.9	61.6	0	0	0	0	111.4
533	E	40.6	Very low	49.5	Very low	204 Å²	204	111.8 Å²	111.8	95%	0.953	60%	0.603	S	S	*	*			trans	-88.6	171.7	-165.7	-65.1	-177.9	110.7	0	0	117.8
534	G	37.3	Very low	51	Low	68 Å²	68	106.2 Å²	106.2	70%	0.701	57%	0.573	S	S	*	*			trans	-141.1	174.7	175.1	0	0	0	0	0	114
535	P	46.1	Very low	52.3	Low	135 Å²	135	106.3 Å²	106.3	88%	0.877	57%	0.573	S	S	*	*			trans	-93.9	167.4	-160.6	36.7	-37.6	0	0	0	116.9
536	S	46.6	Very low	54.3	Low	91 Å²	91	105.4 Å²	105.4	64%	0.636	57%	0.572	S	S	*	*			trans	-93.1	-177.1	-176.1	63.5	0	0	0	0	115.3
537	L	56.8	Low	55.9	Low	80 Å²	80	101.1 Å²	101.1	42%	0.419	54%	0.544	S	S	.	.			trans	-110.2	-6.3	-162.8	-67.5	174.4	0	0	0	116.1	I567 F568 E570	L537-I567 WeakPolarHBondContact O-CG1 3.04Å; L537-F568 HydrophobicContact CD2-CD1 4.24Å; L537-E570 HydrophobicContact CD2-CB 3.84Å; L537-E570 HydrophobicContact CD2-CG 4.19Å
538	D	61.2	Low	57.8	Low	112 Å²	112	94.4 Å²	94.4	60%	0.599	53%	0.526	S	S	*	.	S	Bend	trans	-79.7	154.3	-171.7	-56.6	-70.7	0	0	0	113.7	T540	D538-T540 PolarHBondContact O-N 2.89Å
539	P	69	Low	59.9	Low	39 Å²	39	98.5 Å²	98.5	25%	0.253	55%	0.547	S	S	.	.			trans	-65.7	121.3	174.6	-8.9	22.5	0	0	0	110.5	K566 I567 V578 L582 C583	P539-K566 WeakPolarHBondContact CA-O 3.48Å; P539-I567 HydrophobicContact CB-CB 4.18Å; P539-I567 HydrophobicContact CG-CB 4.32Å; P539-I567 HydrophobicContact CG-CD1 4.07Å; P539-I567 HydrophobicContact CG-CG1 4.2Å; P539-V578 HydrophobicContact CB-CG2 4.25Å; P539-L582 WeakPolarHBondContact CB-O 3.31Å; P539-C583 PolarHBondContact O-SG 2.98Å
540	T	69.7	Low	61.8	Low	69 Å²	69	92.5 Å²	92.5	42%	0.423	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	159.1	-178.9	49.1	0	0	0	0	111.8	D538 I542 K566 C583	D538-T540 PolarHBondContact O-N 2.89Å; T540-I542 VanDerWaalsContact C-N 3.26Å; T540-I542 PolarHBondContact O-N 3.42Å; T540-K566 PolarHBondContact N-O 2.9Å; T540-K566 PolarHBondContact O-N 3.47Å; T540-C583 VanDerWaalsContact CA-SG 3.58Å; T540-C583 PolarHBondContact N-SG 2.92Å; T540-C583 PolarHBondContact O-SG 3.42Å; T540-C583 VanDerWaalsContact O-SG 3.4Å
541	Y	77.5	Confident	63.4	Low	46 Å²	46	90.7 Å²	90.7	18%	0.18	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	79.7	174.4	-78.4	-73.9	0	0	0	110.5	C565 D580 C583 K587	Y541-C565 HydrophobicContact CD1-CB 4.35Å; Y541-C565 HydrophobicContact CE1-CB 4.1Å; Y541-D580 HydrophobicContact CE1-CB 4.27Å; Y541-D580 WeakPolarHBondContact CE1-OD1 3.23Å; Y541-D580 PolarHBondContact OH-O 3.47Å; Y541-C583 HydrophobicContact CD2-CB 3.74Å; Y541-C583 HydrophobicContact CE2-CB 3.54Å; Y541-C583 HydrophobicContact CG-CB 4.31Å; Y541-K587 HydrophobicContact CD1-CB 4.35Å; Y541-K587 HydrophobicContact CD1-CD 4.48Å; Y541-K587 HydrophobicContact CD1-CG 4Å; Y541-K587 HydrophobicContact CE1-CB 3.76Å; Y541-K587 HydrophobicContact CE1-CD 3.85Å; Y541-K587 HydrophobicContact CE1-CG 3.64Å; Y541-K587 HydrophobicContact CE2-CB 4.45Å
542	I	72.3	Confident	65.1	Low	65 Å²	65	85.3 Å²	85.3	33%	0.333	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.9	177.6	-53.1	-177.7	0	0	0	108.8	T540 D544 N564 K566 V575	T540-I542 VanDerWaalsContact C-N 3.26Å; T540-I542 PolarHBondContact O-N 3.42Å; I542-D544 PolarHBondContact O-N 2.85Å; I542-N564 PolarHBondContact N-O 3.35Å; I542-N564 PolarHBondContact O-N 3.5Å; I542-N564 VanDerWaalsContact O-N 3.11Å; I542-K566 HydrophobicContact CB-CB 4.03Å; I542-K566 HydrophobicContact CB-CD 4.29Å; I542-K566 HydrophobicContact CD1-CB 3.91Å; I542-K566 HydrophobicContact CG1-CB 4.01Å; I542-V575 HydrophobicContact CD1-CG1 4.4Å
543	K	75.3	Confident	66.7	Low	60 Å²	60	86.5 Å²	86.5	26%	0.261	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	124.7	170.7	-167.8	178.2	-174.9	163.3	0	109	R561 Y563 E591	K543-R561 HydrophobicContact CG-CG 4.29Å; K543-Y563 HydrophobicContact CB-CD1 3.98Å; K543-Y563 HydrophobicContact CB-CE1 3.6Å; K543-Y563 HydrophobicContact CD-CE1 4.37Å; K543-Y563 HydrophobicContact CG-CE1 3.99Å; K543-Y563 HydrophobicContact CG-CE2 4.21Å; K543-E591 VanDerWaalsContact CE-CD 3.49Å; K543-E591 VanDerWaalsContact CE-OE1 3.29Å; K543-E591 WeakPolarHBondContact CE-OE1 3.4Å; K543-E591 VanDerWaalsContact CE-OE2 3.24Å; K543-E591 WeakPolarHBondContact CE-OE2 3.5Å; K543-E591 IonicContact NZ-OE1 2.94Å; K543-E591 PolarHBondContact NZ-OE1 3.5Å; K543-E591 IonicContact NZ-OE2 2.77Å; K543-E591 PolarHBondContact NZ-OE2 3.07Å
544	D	69.9	Low	68.1	Low	27 Å²	27	78.9 Å²	78.9	14%	0.144	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-56.7	146.2	171.7	-72.8	-30.1	0	0	0	109.9	I542 R561 T562 N564 K566	I542-D544 PolarHBondContact O-N 2.85Å; D544-R561 PolarHBondContact O-NE 3.44Å; D544-R561 PolarHBondContact O-NH2 2.85Å; D544-T562 WeakPolarHBondContact CB-O 3.48Å; D544-T562 PolarHBondContact N-O 2.9Å; D544-T562 VanDerWaalsContact N-O 3.12Å; D544-T562 PolarHBondContact OD2-OG1 3.18Å; D544-N564 PolarHBondContact OD2-ND2 3.21Å; D544-K566 WeakPolarHBondContact OD1-CE 3.46Å; D544-K566 IonicContact OD1-NZ 3.96Å; D544-K566 PolarHBondContact OD1-NZ 2.86Å
545	N	67.1	Low	69.4	Low	145 Å²	145	76.4 Å²	76.4	78%	0.775	44%	0.441	S	S	*	.	S	Bend	trans	-83.3	-16.6	-177.8	-95	-15.2	0	0	0	114.1	R561	N545-R561 PolarHBondContact OD1-NH2 2.84Å
546	E	73.7	Confident	70.9	Confident	167 Å²	167	77 Å²	77	78%	0.78	43%	0.432	S	S	*	.	S	Bend	trans	-105.2	146.6	-179.3	-66.1	172.5	-179.9	0	0	110.2
547	W	76.9	Confident	72.5	Confident	63 Å²	63	73.1 Å²	73.1	24%	0.239	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-85.5	155	168	-71.3	93.9	0	0	0	109.6	R559 R561 E591 E593	W547-R559 HydrophobicContact CB-CB 4.31Å; W547-R559 HydrophobicContact CB-CG 4.12Å; W547-R559 HydrophobicContact CD2-CG 4Å; W547-R559 HydrophobicContact CE3-CB 4.24Å; W547-R559 HydrophobicContact CE3-CG 3.72Å; W547-R559 HydrophobicContact CG-CG 4.19Å; W547-R559 WeakPolarHBondContact CZ3-O 3.38Å; W547-R561 HydrophobicContact CD2-CB 3.69Å; W547-R561 HydrophobicContact CD2-CG 4.39Å; W547-R561 HydrophobicContact CE3-CB 3.34Å; W547-R561 HydrophobicContact CE3-CG 4.47Å; W547-R561 HydrophobicContact CG-CB 4.41Å; W547-R561 HydrophobicContact CH2-CB 3.85Å; W547-R561 HydrophobicContact CZ2-CB 4.2Å; W547-R561 HydrophobicContact CZ3-CB 3.42Å; W547-R561 VanDerWaalsContact CZ3-CB 3.42Å; W547-E591 HydrophobicContact CH2-CB 3.88Å; W547-E591 HydrophobicContact CZ3-CB 4.28Å; W547-E593 HydrophobicContact CD2-CB 4.49Å; W547-E593 VanDerWaalsContact CE2-OE2 3.25Å; W547-E593 HydrophobicContact CE3-CB 4.1Å; W547-E593 HydrophobicContact CH2-CB 3.43Å; W547-E593 VanDerWaalsContact CH2-CB 3.43Å; W547-E593 HydrophobicContact CZ2-CB 3.81Å; W547-E593 HydrophobicContact CZ2-CG 4.47Å; W547-E593 HydrophobicContact CZ3-CB 3.56Å; W547-E593 PolarHBondContact NE1-OE2 2.75Å
548	S	76.3	Confident	73.5	Confident	47 Å²	47	72.3 Å²	72.3	33%	0.329	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-55.9	157.7	164.2	78.2	0	0	0	0	110.8	R559 R560	S548-R559 WeakPolarHBondContact O-CB 3.13Å; S548-R559 WeakPolarHBondContact OG-CA 3.41Å; S548-R560 WeakPolarHBondContact CB-O 3.45Å; S548-R560 PolarHBondContact N-O 2.82Å; S548-R560 PolarHBondContact OG-N 2.87Å; S548-R560 PolarHBondContact OG-O 2.89Å
549	P	76.3	Confident	74.4	Confident	115 Å²	115	71.1 Å²	71.1	75%	0.747	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-52.7	153.9	159.1	25.2	-34.8	0	0	0	110.3
550	C	80.4	Confident	74.8	Confident	19 Å²	19	75.1 Å²	75.1	13%	0.128	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-61.5	146.3	177.8	-162.5	0	0	0	0	110.8	V552 C595 E597	C550-V552 WeakPolarHBondContact CB-O 3.38Å; C550-V552 PolarHBondContact O-N 2.82Å; C550-V552 VanDerWaalsContact O-N 3.09Å; C550-C595 WeakPolarHBondContact CA-SG 3.43Å; C550-C595 HydrophobicContact CB-CB 3.86Å; C550-C595 WeakPolarHBondContact CB-SG 3.28Å; C550-C595 WeakPolarHBondContact SG-CB 3.45Å; C550-C595 CovalentContact SG-SG 2.03Å; C550-C595 PolarHBondContact SG-SG 2.87Å; C550-E597 HydrophobicContact CB-CG 3.81Å; C550-E597 VanDerWaalsContact CB-OE1 3.27Å; C550-E597 WeakPolarHBondContact CB-OE1 3.38Å
551	S	81.6	Confident	75.1	Confident	79 Å²	79	73.8 Å²	73.8	55%	0.552	39%	0.387	S	S	*	.	S	Bend	trans	-67.4	-5.8	179.4	67.6	0	0	0	0	114.4	I558	S551-I558 VanDerWaalsContact CB-O 3.23Å; S551-I558 WeakPolarHBondContact CB-O 3Å; S551-I558 PolarHBondContact N-O 2.88Å; S551-I558 PolarHBondContact OG-N 3.5Å; S551-I558 PolarHBondContact OG-O 2.03Å
552	V	73.6	Confident	74.7	Confident	48 Å²	48	73.9 Å²	73.9	29%	0.291	39%	0.392	S	S	.	.	S	Bend	trans	-131.5	158.7	174.9	-56.1	0	0	0	0	108.6	C550 C554 G555	C550-V552 WeakPolarHBondContact CB-O 3.38Å; C550-V552 PolarHBondContact O-N 2.82Å; C550-V552 VanDerWaalsContact O-N 3.09Å; V552-C554 WeakPolarHBondContact CG2-O 3.48Å; V552-G555 WeakPolarHBondContact CG2-O 3.01Å
553	T	72.7	Confident	75.1	Confident	138 Å²	138	72.8 Å²	72.8	85%	0.847	38%	0.384	S	S	*	.	S	Bend	trans	-105.6	4.5	176.4	59.4	0	0	0	0	113.3
554	C	69.2	Low	75.1	Confident	44 Å²	44	71.8 Å²	71.8	30%	0.297	38%	0.382	S	S	.	.	S	Bend	trans	-160.4	149	170.6	63.4	0	0	0	0	108.2	V552 D598 C600	V552-C554 WeakPolarHBondContact CG2-O 3.48Å; C554-D598 CarbonylContact C-O 3.57Å; C554-D598 WeakPolarHBondContact CA-O 2.9Å; C554-D598 WeakPolarHBondContact CB-O 3.38Å; C554-C600 HydrophobicContact CB-CB 3.96Å; C554-C600 WeakPolarHBondContact CB-SG 3.32Å; C554-C600 PolarHBondContact O-SG 2.86Å; C554-C600 VanDerWaalsContact SG-CA 3.59Å; C554-C600 WeakPolarHBondContact SG-CB 3.45Å; C554-C600 CovalentContact SG-SG 2.04Å; C554-C600 PolarHBondContact SG-SG 2.86Å
555	G	66.2	Low	75.5	Confident	15 Å²	15	70.5 Å²	70.5	16%	0.155	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.6	-162.3	-178.8	0	0	0	0	0	114.6	V552 E597 D598	V552-G555 WeakPolarHBondContact CG2-O 3.01Å; G555-E597 WeakPolarHBondContact CA-O 3.02Å; G555-E597 PolarHBondContact N-O 2.68Å; G555-E597 VanDerWaalsContact N-O 3.08Å; G555-E597 PolarHBondContact O-N 3.04Å; G555-D598 PolarHBondContact N-O 2.91Å
556	E	77.7	Confident	76	Confident	148 Å²	148	65.3 Å²	65.3	69%	0.692	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	134.3	-176.5	-56.6	-161.4	174.7	0	0	113.1	V596	E556-V596 HydrophobicContact CG-CG1 4.34Å; E556-V596 HydrophobicContact CG-CG2 4.1Å
557	G	80.1	Confident	76.2	Confident	10 Å²	10	59.3 Å²	59.3	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	-164.6	172	0	0	0	0	0	112.1	R594 C595	G557-R594 WeakPolarHBondContact O-CA 3.23Å; G557-C595 VanDerWaalsContact C-SG 3.55Å; G557-C595 PolarHBondContact N-O 3.36Å; G557-C595 PolarHBondContact O-N 2.72Å; G557-C595 VanDerWaalsContact O-O 3.11Å
558	I	76.3	Confident	75.9	Confident	62 Å²	62	60.1 Å²	60.1	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.7	177.7	51.1	171.2	0	0	0	111	S551 V592 E593 R594	S551-I558 VanDerWaalsContact CB-O 3.23Å; S551-I558 WeakPolarHBondContact CB-O 3Å; S551-I558 PolarHBondContact N-O 2.88Å; S551-I558 PolarHBondContact OG-N 3.5Å; S551-I558 PolarHBondContact OG-O 2.03Å; I558-V592 HydrophobicContact CB-CG1 3.78Å; I558-V592 HydrophobicContact CD1-CG1 4.07Å; I558-V592 HydrophobicContact CG1-CG1 4.48Å; I558-V592 HydrophobicContact CG2-CG1 3.92Å; I558-E593 WeakPolarHBondContact CA-O 3.02Å; I558-R594 HydrophobicContact CG2-CG 4.23Å
559	R	79.8	Confident	75.6	Confident	87 Å²	87	61.4 Å²	61.4	33%	0.328	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.2	167.4	57.9	-175.6	-168	-166.3	0.5	109.4	W547 S548 V592 E593 C595	W547-R559 HydrophobicContact CB-CB 4.31Å; W547-R559 HydrophobicContact CB-CG 4.12Å; W547-R559 HydrophobicContact CD2-CG 4Å; W547-R559 HydrophobicContact CE3-CB 4.24Å; W547-R559 HydrophobicContact CE3-CG 3.72Å; W547-R559 HydrophobicContact CG-CG 4.19Å; W547-R559 WeakPolarHBondContact CZ3-O 3.38Å; S548-R559 WeakPolarHBondContact O-CB 3.13Å; S548-R559 WeakPolarHBondContact OG-CA 3.41Å; R559-V592 WeakPolarHBondContact O-CA 3.25Å; R559-E593 HydrophobicContact CG-CB 4.21Å; R559-E593 IonicContact CZ-OE2 2.8Å; R559-E593 PolarHBondContact N-O 3.08Å; R559-E593 IonicContact NE-OE2 3Å; R559-E593 PolarHBondContact NE-OE2 2.9Å; R559-E593 IonicContact NH2-OE1 3.09Å; R559-E593 IonicContact NH2-OE2 3.15Å; R559-E593 PolarHBondContact NH2-OE2 3.39Å; R559-E593 PolarHBondContact O-N 2.81Å; R559-C595 HydrophobicContact CG-CB 4.09Å; R559-C595 PolarHBondContact N-SG 2.94Å
560	R	79.3	Confident	74.5	Confident	123 Å²	123	62 Å²	62	46%	0.464	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.2	-175.8	-62.6	-176.9	178.8	-94.4	-2.7	110.2	S548 E591 V592	S548-R560 WeakPolarHBondContact CB-O 3.45Å; S548-R560 PolarHBondContact N-O 2.82Å; S548-R560 PolarHBondContact OG-N 2.87Å; S548-R560 PolarHBondContact OG-O 2.89Å; R560-E591 CarbonylContact C-O 3.55Å; R560-E591 VanDerWaalsContact CA-O 3.32Å; R560-E591 WeakPolarHBondContact CA-O 3.21Å; R560-V592 HydrophobicContact CG-CG2 4.33Å
561	R	75.4	Confident	73.5	Confident	41 Å²	41	72.4 Å²	72.4	16%	0.155	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	105.5	179.4	-179.1	167	176.6	-179.2	-0.9	108.9	K543 D544 N545 W547 E591	K543-R561 HydrophobicContact CG-CG 4.29Å; D544-R561 PolarHBondContact O-NE 3.44Å; D544-R561 PolarHBondContact O-NH2 2.85Å; N545-R561 PolarHBondContact OD1-NH2 2.84Å; W547-R561 HydrophobicContact CD2-CB 3.69Å; W547-R561 HydrophobicContact CD2-CG 4.39Å; W547-R561 HydrophobicContact CE3-CB 3.34Å; W547-R561 HydrophobicContact CE3-CG 4.47Å; W547-R561 HydrophobicContact CG-CB 4.41Å; W547-R561 HydrophobicContact CH2-CB 3.85Å; W547-R561 HydrophobicContact CZ2-CB 4.2Å; W547-R561 HydrophobicContact CZ3-CB 3.42Å; W547-R561 VanDerWaalsContact CZ3-CB 3.42Å; R561-E591 HydrophobicContact CB-CB 4.49Å; R561-E591 PolarHBondContact N-O 2.83Å; R561-E591 PolarHBondContact O-N 3.48Å; R561-E591 VanDerWaalsContact O-N 3.12Å
562	T	69.6	Low	72.6	Confident	49 Å²	49	71.6 Å²	71.6	30%	0.301	35%	0.352	S	S	.	.			trans	-78.1	143.6	-173.9	42.2	0	0	0	0	111.5	D544 N564 D590	D544-T562 WeakPolarHBondContact CB-O 3.48Å; D544-T562 PolarHBondContact N-O 2.9Å; D544-T562 VanDerWaalsContact N-O 3.12Å; D544-T562 PolarHBondContact OD2-OG1 3.18Å; T562-N564 PolarHBondContact OG1-ND2 2.78Å; T562-N564 VanDerWaalsContact OG1-ND2 3.17Å; T562-D590 WeakPolarHBondContact CA-OD1 2.99Å; T562-D590 WeakPolarHBondContact CG2-OD1 3.3Å
563	Y	80.6	Confident	72.2	Confident	42 Å²	42	79.1 Å²	79.1	17%	0.165	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.9	160.8	-74.6	-99.9	0	0	0	107.9	K543 K587 P588 E591	K543-Y563 HydrophobicContact CB-CD1 3.98Å; K543-Y563 HydrophobicContact CB-CE1 3.6Å; K543-Y563 HydrophobicContact CD-CE1 4.37Å; K543-Y563 HydrophobicContact CG-CE1 3.99Å; K543-Y563 HydrophobicContact CG-CE2 4.21Å; Y563-K587 WeakPolarHBondContact O-CE 3.16Å; Y563-K587 PolarHBondContact O-NZ 3.33Å; Y563-P588 HydrophobicContact CD1-CB 4.12Å; Y563-P588 HydrophobicContact CD1-CG 3.93Å; Y563-P588 HydrophobicContact CD2-CB 3.93Å; Y563-P588 HydrophobicContact CE1-CB 4.4Å; Y563-P588 HydrophobicContact CE1-CG 4.36Å; Y563-P588 HydrophobicContact CE2-CB 4.25Å; Y563-P588 HydrophobicContact CG-CB 3.88Å; Y563-P588 HydrophobicContact CG-CG 4.06Å; Y563-E591 HydrophobicContact CE2-CG 4.37Å; Y563-E591 PolarHBondContact OH-OE1 3.17Å
564	N	74.3	Confident	71.7	Confident	39 Å²	39	76 Å²	76	21%	0.209	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.8	-178.9	-81.1	-45.3	0	0	0	110.5	I542 D544 T562 K566 T577 K587	I542-N564 PolarHBondContact N-O 3.35Å; I542-N564 PolarHBondContact O-N 3.5Å; I542-N564 VanDerWaalsContact O-N 3.11Å; D544-N564 PolarHBondContact OD2-ND2 3.21Å; T562-N564 PolarHBondContact OG1-ND2 2.78Å; T562-N564 VanDerWaalsContact OG1-ND2 3.17Å; N564-K566 PolarHBondContact O-N 2.81Å; N564-T577 HydrophobicContact CB-CG2 4.09Å; N564-K587 PolarHBondContact OD1-NZ 2.98Å
565	C	79.4	Confident	71.8	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	121.8	-178.6	178.9	0	0	0	0	111.1	Y541 T577 V578 N579 D580 C583	Y541-C565 HydrophobicContact CD1-CB 4.35Å; Y541-C565 HydrophobicContact CE1-CB 4.1Å; C565-T577 WeakPolarHBondContact O-CA 3.35Å; C565-T577 WeakPolarHBondContact O-CG2 3.43Å; C565-V578 PolarHBondContact O-N 2.94Å; C565-V578 VanDerWaalsContact SG-CG2 3.54Å; C565-N579 PolarHBondContact SG-O 3.46Å; C565-N579 VanDerWaalsContact SG-O 3.34Å; C565-D580 HydrophobicContact CB-CB 4.43Å; C565-D580 WeakPolarHBondContact CB-OD1 3.17Å; C565-D580 PolarHBondContact N-OD1 3Å; C565-C583 WeakPolarHBondContact CA-SG 3.46Å; C565-C583 HydrophobicContact CB-CB 3.85Å; C565-C583 WeakPolarHBondContact CB-SG 3.11Å; C565-C583 WeakPolarHBondContact SG-CB 3.48Å; C565-C583 PolarHBondContact SG-N 2.94Å; C565-C583 CovalentContact SG-SG 2.02Å; C565-C583 PolarHBondContact SG-SG 3.38Å
566	K	76.5	Confident	72	Confident	36 Å²	36	78.1 Å²	78.1	16%	0.157	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	135.3	-167	-87.5	173.9	168.4	-178.2	0	111.6	P539 T540 I542 D544 N564 V575 A576 T577	P539-K566 WeakPolarHBondContact CA-O 3.48Å; T540-K566 PolarHBondContact N-O 2.9Å; T540-K566 PolarHBondContact O-N 3.47Å; I542-K566 HydrophobicContact CB-CB 4.03Å; I542-K566 HydrophobicContact CB-CD 4.29Å; I542-K566 HydrophobicContact CD1-CB 3.91Å; I542-K566 HydrophobicContact CG1-CB 4.01Å; D544-K566 WeakPolarHBondContact OD1-CE 3.46Å; D544-K566 IonicContact OD1-NZ 3.96Å; D544-K566 PolarHBondContact OD1-NZ 2.86Å; N564-K566 PolarHBondContact O-N 2.81Å; K566-V575 HydrophobicContact CB-CG1 3.71Å; K566-V575 HydrophobicContact CD-CG1 3.78Å; K566-V575 HydrophobicContact CG-CG1 3.84Å; K566-A576 WeakPolarHBondContact CA-O 2.96Å; K566-T577 VanDerWaalsContact CE-OG1 3.23Å; K566-T577 WeakPolarHBondContact CE-OG1 3.33Å; K566-T577 HydrophobicContact CG-CG2 4.14Å
567	I	77.5	Confident	71.8	Confident	41 Å²	41	75.4 Å²	75.4	21%	0.21	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.6	175.5	-166.3	-178.4	0	0	0	109.7	L537 P539 L569 V575 A576 V578	L537-I567 WeakPolarHBondContact O-CG1 3.04Å; P539-I567 HydrophobicContact CB-CB 4.18Å; P539-I567 HydrophobicContact CG-CB 4.32Å; P539-I567 HydrophobicContact CG-CD1 4.07Å; P539-I567 HydrophobicContact CG-CG1 4.2Å; I567-L569 HydrophobicContact CG2-CD2 3.93Å; I567-L569 HydrophobicContact CG2-CG 4.3Å; I567-V575 WeakPolarHBondContact O-CA 3.25Å; I567-A576 HydrophobicContact CG2-CB 4.32Å; I567-A576 PolarHBondContact N-O 3.16Å; I567-A576 PolarHBondContact O-N 2.93Å; I567-V578 HydrophobicContact CG2-CG1 3.8Å
568	F	70.5	Confident	71.5	Confident	79 Å²	79	77 Å²	77	35%	0.346	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108.7	171.5	-174	-109.4	0	0	0	110.3	L537 E570 R573 V575	L537-F568 HydrophobicContact CD2-CD1 4.24Å; F568-E570 PolarHBondContact O-N 2.91Å; F568-R573 WeakPolarHBondContact CE2-O 3.48Å; F568-R573 HydrophobicContact CZ-CB 4Å; F568-R573 HydrophobicContact CZ-CG 4.44Å; F568-V575 HydrophobicContact CD2-CG2 3.88Å
569	L	69.8	Low	71.1	Confident	75 Å²	75	79.2 Å²	79.2	39%	0.393	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	90.6	177.6	-61.9	179.1	0	0	0	109.5	I567 Y571 S572 R573 T574 A576	I567-L569 HydrophobicContact CG2-CD2 3.93Å; I567-L569 HydrophobicContact CG2-CG 4.3Å; L569-Y571 VanDerWaalsContact C-N 3.27Å; L569-Y571 PolarHBondContact O-N 3.18Å; L569-S572 CarbonylContact O-C 3.58Å; L569-S572 PolarHBondContact O-N 2.85Å; L569-S572 VanDerWaalsContact O-N 3.07Å; L569-S572 PolarHBondContact O-OG 3.42Å; L569-R573 WeakPolarHBondContact O-CA 3.38Å; L569-R573 PolarHBondContact O-N 3.18Å; L569-T574 WeakPolarHBondContact CB-O 3.47Å; L569-T574 PolarHBondContact N-O 3.07Å; L569-T574 PolarHBondContact O-N 2.79Å; L569-A576 HydrophobicContact CD1-CB 3.65Å; L569-A576 HydrophobicContact CG-CB 4.02Å
570	E	53.8	Low	70.7	Confident	126 Å²	126	77.5 Å²	77.5	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-40.4	-173	-166.5	179.5	-155.4	0	0	113.6	L537 F568 S572 R573	L537-E570 HydrophobicContact CD2-CB 3.84Å; L537-E570 HydrophobicContact CD2-CG 4.19Å; F568-E570 PolarHBondContact O-N 2.91Å; E570-S572 VanDerWaalsContact C-N 3.3Å; E570-S572 PolarHBondContact O-N 3.05Å; E570-R573 WeakPolarHBondContact O-CG 3.37Å; E570-R573 PolarHBondContact O-N 3.02Å; E570-R573 VanDerWaalsContact O-N 3.15Å
571	Y	59.1	Low	70	Confident	238 Å²	238	76 Å²	76	93%	0.933	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.7	179.4	-178.8	-98.4	0	0	0	113.7	L569	L569-Y571 VanDerWaalsContact C-N 3.27Å; L569-Y571 PolarHBondContact O-N 3.18Å
572	S	63.3	Low	69.5	Low	62 Å²	62	79 Å²	79	43%	0.434	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-7.7	174.9	55.1	0	0	0	0	113.6	L569 E570 T574	L569-S572 CarbonylContact O-C 3.58Å; L569-S572 PolarHBondContact O-N 2.85Å; L569-S572 VanDerWaalsContact O-N 3.07Å; L569-S572 PolarHBondContact O-OG 3.42Å; E570-S572 VanDerWaalsContact C-N 3.3Å; E570-S572 PolarHBondContact O-N 3.05Å; S572-T574 PolarHBondContact O-N 3.34Å; S572-T574 PolarHBondContact OG-OG1 2.86Å
573	R	65.4	Low	69.6	Low	207 Å²	207	77 Å²	77	78%	0.781	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	35	-171.4	-60.3	-175.2	171.6	-148.9	-6.7	113.9	F568 L569 E570	F568-R573 WeakPolarHBondContact CE2-O 3.48Å; F568-R573 HydrophobicContact CZ-CB 4Å; F568-R573 HydrophobicContact CZ-CG 4.44Å; L569-R573 WeakPolarHBondContact O-CA 3.38Å; L569-R573 PolarHBondContact O-N 3.18Å; E570-R573 WeakPolarHBondContact O-CG 3.37Å; E570-R573 PolarHBondContact O-N 3.02Å; E570-R573 VanDerWaalsContact O-N 3.15Å
574	T	62.5	Low	68.7	Low	71 Å²	71	84.7 Å²	84.7	44%	0.436	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.3	-178.8	54	0	0	0	0	111.5	L569 S572	L569-T574 WeakPolarHBondContact CB-O 3.47Å; L569-T574 PolarHBondContact N-O 3.07Å; L569-T574 PolarHBondContact O-N 2.79Å; S572-T574 PolarHBondContact O-N 3.34Å; S572-T574 PolarHBondContact OG-OG1 2.86Å
575	V	70.4	Confident	68.1	Low	77 Å²	77	85.5 Å²	85.5	47%	0.467	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	127.2	168.2	-176.3	0	0	0	0	109.4	I542 K566 I567 F568	I542-V575 HydrophobicContact CD1-CG1 4.4Å; K566-V575 HydrophobicContact CB-CG1 3.71Å; K566-V575 HydrophobicContact CD-CG1 3.78Å; K566-V575 HydrophobicContact CG-CG1 3.84Å; I567-V575 WeakPolarHBondContact O-CA 3.25Å; F568-V575 HydrophobicContact CD2-CG2 3.88Å
576	A	71.4	Confident	67.1	Low	27 Å²	27	95.4 Å²	95.4	22%	0.223	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132	175.4	0	0	0	0	0	110.5	K566 I567 L569	K566-A576 WeakPolarHBondContact CA-O 2.96Å; I567-A576 HydrophobicContact CG2-CB 4.32Å; I567-A576 PolarHBondContact N-O 3.16Å; I567-A576 PolarHBondContact O-N 2.93Å; L569-A576 HydrophobicContact CD1-CB 3.65Å; L569-A576 HydrophobicContact CG-CB 4.02Å
577	T	72.9	Confident	66.9	Low	91 Å²	91	97.4 Å²	97.4	56%	0.558	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	131	171.9	-34.9	0	0	0	0	109.5	N564 C565 K566	N564-T577 HydrophobicContact CB-CG2 4.09Å; C565-T577 WeakPolarHBondContact O-CA 3.35Å; C565-T577 WeakPolarHBondContact O-CG2 3.43Å; K566-T577 VanDerWaalsContact CE-OG1 3.23Å; K566-T577 WeakPolarHBondContact CE-OG1 3.33Å; K566-T577 HydrophobicContact CG-CG2 4.14Å
578	V	73.5	Confident	66.6	Low	44 Å²	44	98 Å²	98	27%	0.267	51%	0.506	S	S	.	.			trans	-126	173	178.7	-61.3	0	0	0	0	109.8	P539 C565 I567 L582	P539-V578 HydrophobicContact CB-CG2 4.25Å; C565-V578 PolarHBondContact O-N 2.94Å; C565-V578 VanDerWaalsContact SG-CG2 3.54Å; I567-V578 HydrophobicContact CG2-CG1 3.8Å; V578-L582 HydrophobicContact CB-CD1 4.1Å; V578-L582 HydrophobicContact CG2-CB 4.22Å; V578-L582 HydrophobicContact CG2-CD1 4.31Å
579	N	68.7	Low	66.2	Low	108 Å²	108	102.9 Å²	102.9	58%	0.578	53%	0.53	S	S	*	.			trans	-64.2	138.9	-177.1	-168.1	25.8	0	0	0	111	C565 S581 L582	C565-N579 PolarHBondContact SG-O 3.46Å; C565-N579 VanDerWaalsContact SG-O 3.34Å; N579-S581 PolarHBondContact ND2-OG 3.25Å; N579-S581 PolarHBondContact O-N 3.37Å; N579-L582 HydrophobicContact CB-CD1 4.32Å; N579-L582 WeakPolarHBondContact O-CB 3.26Å; N579-L582 PolarHBondContact O-N 2.61Å
580	D	70.5	Confident	66.6	Low	51 Å²	51	102.5 Å²	102.5	27%	0.273	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-58.2	-20.2	-177.7	-81.2	-13.2	0	0	0	113.4	Y541 C565 L582 K587	Y541-D580 HydrophobicContact CE1-CB 4.27Å; Y541-D580 WeakPolarHBondContact CE1-OD1 3.23Å; Y541-D580 PolarHBondContact OH-O 3.47Å; C565-D580 HydrophobicContact CB-CB 4.43Å; C565-D580 WeakPolarHBondContact CB-OD1 3.17Å; C565-D580 PolarHBondContact N-OD1 3Å; D580-L582 PolarHBondContact O-N 2.96Å; D580-K587 IonicContact OD1-NZ 3.28Å; D580-K587 WeakPolarHBondContact OD2-CD 3.43Å; D580-K587 IonicContact OD2-NZ 2.78Å; D580-K587 PolarHBondContact OD2-NZ 2.02Å
581	S	65.2	Low	67.5	Low	93 Å²	93	99.8 Å²	99.8	65%	0.65	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-70.8	-4.2	172	73.3	0	0	0	0	115.2	N579	N579-S581 PolarHBondContact ND2-OG 3.25Å; N579-S581 PolarHBondContact O-N 3.37Å
582	L	64.7	Low	68.5	Low	104 Å²	104	92 Å²	92	55%	0.545	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-104.7	-5	-179.2	-64	169.4	0	0	0	112.8	P539 V578 N579 D580	P539-L582 WeakPolarHBondContact CB-O 3.31Å; V578-L582 HydrophobicContact CB-CD1 4.1Å; V578-L582 HydrophobicContact CG2-CB 4.22Å; V578-L582 HydrophobicContact CG2-CD1 4.31Å; N579-L582 HydrophobicContact CB-CD1 4.32Å; N579-L582 WeakPolarHBondContact O-CB 3.26Å; N579-L582 PolarHBondContact O-N 2.61Å; D580-L582 PolarHBondContact O-N 2.96Å
583	C	72.5	Confident	69	Low	7 Å²	7	92.6 Å²	92.6	5%	0.047	49%	0.488	C	S	.	.	S	Bend	trans	-105.2	116.6	172.1	-68.8	0	0	0	0	109.4	P539 T540 Y541 C565 G585	P539-C583 PolarHBondContact O-SG 2.98Å; T540-C583 VanDerWaalsContact CA-SG 3.58Å; T540-C583 PolarHBondContact N-SG 2.92Å; T540-C583 PolarHBondContact O-SG 3.42Å; T540-C583 VanDerWaalsContact O-SG 3.4Å; Y541-C583 HydrophobicContact CD2-CB 3.74Å; Y541-C583 HydrophobicContact CE2-CB 3.54Å; Y541-C583 HydrophobicContact CG-CB 4.31Å; C565-C583 WeakPolarHBondContact CA-SG 3.46Å; C565-C583 HydrophobicContact CB-CB 3.85Å; C565-C583 WeakPolarHBondContact CB-SG 3.11Å; C565-C583 WeakPolarHBondContact SG-CB 3.48Å; C565-C583 PolarHBondContact SG-N 2.94Å; C565-C583 CovalentContact SG-SG 2.02Å; C565-C583 PolarHBondContact SG-SG 3.38Å; C583-G585 PolarHBondContact O-N 3.34Å
584	E	61.1	Low	69.2	Low	203 Å²	203	92.4 Å²	92.4	95%	0.949	49%	0.488	S	S	*	.			trans	-76.7	114.2	-179	-63.2	-164	145.4	0	0	111.4
585	G	61.9	Low	69.7	Low	56 Å²	56	89.4 Å²	89.4	58%	0.577	47%	0.469	S	S	*	.	S	Bend	trans	150	167.9	178.7	0	0	0	0	0	112.6	C583	C583-G585 PolarHBondContact O-N 3.34Å
586	K	58.8	Low	69.7	Low	207 Å²	207	90.5 Å²	90.5	90%	0.9	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-78.7	121.6	168.4	-74	-173.6	177	-179.5	0	109
587	K	70.4	Confident	69.7	Low	78 Å²	78	93.1 Å²	93.1	34%	0.339	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-49.4	123	175.4	-176	165.2	-170.8	155.8	0	110.7	Y541 Y563 N564 D580	Y541-K587 HydrophobicContact CD1-CB 4.35Å; Y541-K587 HydrophobicContact CD1-CD 4.48Å; Y541-K587 HydrophobicContact CD1-CG 4Å; Y541-K587 HydrophobicContact CE1-CB 3.76Å; Y541-K587 HydrophobicContact CE1-CD 3.85Å; Y541-K587 HydrophobicContact CE1-CG 3.64Å; Y541-K587 HydrophobicContact CE2-CB 4.45Å; Y563-K587 WeakPolarHBondContact O-CE 3.16Å; Y563-K587 PolarHBondContact O-NZ 3.33Å; N564-K587 PolarHBondContact OD1-NZ 2.98Å; D580-K587 IonicContact OD1-NZ 3.28Å; D580-K587 WeakPolarHBondContact OD2-CD 3.43Å; D580-K587 IonicContact OD2-NZ 2.78Å; D580-K587 PolarHBondContact OD2-NZ 2.02Å
588	P	71.9	Confident	69	Low	53 Å²	53	95.2 Å²	95.2	34%	0.344	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-60.1	149.4	175	-23.4	34.1	0	0	0	111.6	Y563	Y563-P588 HydrophobicContact CD1-CB 4.12Å; Y563-P588 HydrophobicContact CD1-CG 3.93Å; Y563-P588 HydrophobicContact CD2-CB 3.93Å; Y563-P588 HydrophobicContact CE1-CB 4.4Å; Y563-P588 HydrophobicContact CE1-CG 4.36Å; Y563-P588 HydrophobicContact CE2-CB 4.25Å; Y563-P588 HydrophobicContact CG-CB 3.88Å; Y563-P588 HydrophobicContact CG-CG 4.06Å
589	H	63.3	Low	68.1	Low	182 Å²	182	97.4 Å²	97.4	84%	0.843	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-67.1	139.5	173.2	-77.4	-68.3	0	0	0	111	E591	H589-E591 PolarHBondContact O-N 3.32Å
590	D	76.3	Confident	67.3	Low	67 Å²	67	96.2 Å²	96.2	36%	0.358	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-58.6	135.1	178.1	-57	-37.4	0	0	0	111.5	T562	T562-D590 WeakPolarHBondContact CA-OD1 2.99Å; T562-D590 WeakPolarHBondContact CG2-OD1 3.3Å
591	E	74.1	Confident	66.1	Low	70 Å²	70	101.4 Å²	101.4	33%	0.327	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	145.9	173.6	-77.1	177.3	-149.6	0	0	110.8	K543 W547 R560 R561 Y563 H589	K543-E591 VanDerWaalsContact CE-CD 3.49Å; K543-E591 VanDerWaalsContact CE-OE1 3.29Å; K543-E591 WeakPolarHBondContact CE-OE1 3.4Å; K543-E591 VanDerWaalsContact CE-OE2 3.24Å; K543-E591 WeakPolarHBondContact CE-OE2 3.5Å; K543-E591 IonicContact NZ-OE1 2.94Å; K543-E591 PolarHBondContact NZ-OE1 3.5Å; K543-E591 IonicContact NZ-OE2 2.77Å; K543-E591 PolarHBondContact NZ-OE2 3.07Å; W547-E591 HydrophobicContact CH2-CB 3.88Å; W547-E591 HydrophobicContact CZ3-CB 4.28Å; R560-E591 CarbonylContact C-O 3.55Å; R560-E591 VanDerWaalsContact CA-O 3.32Å; R560-E591 WeakPolarHBondContact CA-O 3.21Å; R561-E591 HydrophobicContact CB-CB 4.49Å; R561-E591 PolarHBondContact N-O 2.83Å; R561-E591 PolarHBondContact O-N 3.48Å; R561-E591 VanDerWaalsContact O-N 3.12Å; Y563-E591 HydrophobicContact CE2-CG 4.37Å; Y563-E591 PolarHBondContact OH-OE1 3.17Å; H589-E591 PolarHBondContact O-N 3.32Å
592	V	78.7	Confident	64.8	Low	73 Å²	73	104.5 Å²	104.5	44%	0.442	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.7	-179.4	-170.6	0	0	0	0	108.7	I558 R559 R560	I558-V592 HydrophobicContact CB-CG1 3.78Å; I558-V592 HydrophobicContact CD1-CG1 4.07Å; I558-V592 HydrophobicContact CG1-CG1 4.48Å; I558-V592 HydrophobicContact CG2-CG1 3.92Å; R559-V592 WeakPolarHBondContact O-CA 3.25Å; R560-V592 HydrophobicContact CG-CG2 4.33Å
593	E	75.2	Confident	63.6	Low	75 Å²	75	105.1 Å²	105.1	35%	0.35	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.7	179	-177.3	179.8	-134.6	0	0	109.4	W547 I558 R559 C595	W547-E593 HydrophobicContact CD2-CB 4.49Å; W547-E593 VanDerWaalsContact CE2-OE2 3.25Å; W547-E593 HydrophobicContact CE3-CB 4.1Å; W547-E593 HydrophobicContact CH2-CB 3.43Å; W547-E593 VanDerWaalsContact CH2-CB 3.43Å; W547-E593 HydrophobicContact CZ2-CB 3.81Å; W547-E593 HydrophobicContact CZ2-CG 4.47Å; W547-E593 HydrophobicContact CZ3-CB 3.56Å; W547-E593 PolarHBondContact NE1-OE2 2.75Å; I558-E593 WeakPolarHBondContact CA-O 3.02Å; R559-E593 HydrophobicContact CG-CB 4.21Å; R559-E593 IonicContact CZ-OE2 2.8Å; R559-E593 PolarHBondContact N-O 3.08Å; R559-E593 IonicContact NE-OE2 3Å; R559-E593 PolarHBondContact NE-OE2 2.9Å; R559-E593 IonicContact NH2-OE1 3.09Å; R559-E593 IonicContact NH2-OE2 3.15Å; R559-E593 PolarHBondContact NH2-OE2 3.39Å; R559-E593 PolarHBondContact O-N 2.81Å; E593-C595 PolarHBondContact O-N 3.09Å
594	R	69.6	Low	61.9	Low	203 Å²	203	110 Å²	110	77%	0.766	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.2	124.4	171.4	-92	179.5	-78.4	-125.7	-1.9	109.5	G557 I558	G557-R594 WeakPolarHBondContact O-CA 3.23Å; I558-R594 HydrophobicContact CG2-CG 4.23Å
595	C	72.5	Confident	60.8	Low	8 Å²	8	109 Å²	109	5%	0.054	58%	0.578	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.6	146.8	170.8	41.6	0	0	0	0	108.8	C550 G557 R559 E593	C550-C595 WeakPolarHBondContact CA-SG 3.43Å; C550-C595 HydrophobicContact CB-CB 3.86Å; C550-C595 WeakPolarHBondContact CB-SG 3.28Å; C550-C595 WeakPolarHBondContact SG-CB 3.45Å; C550-C595 CovalentContact SG-SG 2.03Å; C550-C595 PolarHBondContact SG-SG 2.87Å; G557-C595 VanDerWaalsContact C-SG 3.55Å; G557-C595 PolarHBondContact N-O 3.36Å; G557-C595 PolarHBondContact O-N 2.72Å; G557-C595 VanDerWaalsContact O-O 3.11Å; R559-C595 HydrophobicContact CG-CB 4.09Å; R559-C595 PolarHBondContact N-SG 2.94Å; E593-C595 PolarHBondContact O-N 3.09Å
596	V	71.4	Confident	59.4	Low	101 Å²	101	109.7 Å²	109.7	61%	0.612	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-124.7	105.1	174.1	-171.7	0	0	0	0	105.9	E556	E556-V596 HydrophobicContact CG-CG1 4.34Å; E556-V596 HydrophobicContact CG-CG2 4.1Å
597	E	71.3	Confident	58.2	Low	81 Å²	81	108.4 Å²	108.4	38%	0.379	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	166.4	167.1	-60.6	-60.8	153.7	0	0	108.7	C550 G555	C550-E597 HydrophobicContact CB-CG 3.81Å; C550-E597 VanDerWaalsContact CB-OE1 3.27Å; C550-E597 WeakPolarHBondContact CB-OE1 3.38Å; G555-E597 WeakPolarHBondContact CA-O 3.02Å; G555-E597 PolarHBondContact N-O 2.68Å; G555-E597 VanDerWaalsContact N-O 3.08Å; G555-E597 PolarHBondContact O-N 3.04Å
598	D	57	Low	56.4	Low	136 Å²	136	111.3 Å²	111.3	73%	0.727	60%	0.6	S	S	*	*	S	Bend	trans	-47.1	139.3	-178.1	-79.4	-43.5	0	0	0	112.3	C554 G555 C600	C554-D598 CarbonylContact C-O 3.57Å; C554-D598 WeakPolarHBondContact CA-O 2.9Å; C554-D598 WeakPolarHBondContact CB-O 3.38Å; G555-D598 PolarHBondContact N-O 2.91Å; D598-C600 PolarHBondContact O-N 3.01Å
599	P	54	Low	54.7	Low	90 Å²	90	115.1 Å²	115.1	58%	0.584	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-52.4	138.2	-178.3	-27.7	34.9	0	0	0	112.5	M601	P599-M601 HydrophobicContact CB-CG 4.44Å; P599-M601 WeakPolarHBondContact O-CG 3.38Å; P599-M601 PolarHBondContact O-N 3.14Å
600	C	52.4	Low	53.6	Low	82 Å²	82	113.7 Å²	113.7	55%	0.554	61%	0.611	S	S	*	*			trans	-68.7	73.3	179.2	-60.6	0	0	0	0	112.2	C554 D598 L602	C554-C600 HydrophobicContact CB-CB 3.96Å; C554-C600 WeakPolarHBondContact CB-SG 3.32Å; C554-C600 PolarHBondContact O-SG 2.86Å; C554-C600 VanDerWaalsContact SG-CA 3.59Å; C554-C600 WeakPolarHBondContact SG-CB 3.45Å; C554-C600 CovalentContact SG-SG 2.04Å; C554-C600 PolarHBondContact SG-SG 2.86Å; D598-C600 PolarHBondContact O-N 3.01Å; C600-L602 PolarHBondContact O-N 2.93Å
601	M	45.9	Very low	51.4	Low	160 Å²	160	120.2 Å²	120.2	79%	0.788	64%	0.636	S	S	*	*			trans	-72.1	109.7	-176.9	-67.7	-68.4	-88	0	0	111.1	P599	P599-M601 HydrophobicContact CB-CG 4.44Å; P599-M601 WeakPolarHBondContact O-CG 3.38Å; P599-M601 PolarHBondContact O-N 3.14Å
602	L	37.8	Very low	49.8	Very low	159 Å²	159	122.6 Å²	122.6	83%	0.832	66%	0.657	S	S	*	*			trans	-66.9	132.8	161.7	-72.9	171	0	0	0	108.9	C600 S604	C600-L602 PolarHBondContact O-N 2.93Å; L602-S604 PolarHBondContact O-N 3.12Å
603	P	40.3	Very low	48.1	Very low	117 Å²	117	130.2 Å²	130.2	76%	0.76	68%	0.678	S	S	*	*			trans	-78.7	110.6	-162.9	29	-35.8	0	0	0	113.5
604	S	35.4	Very low	46.2	Very low	109 Å²	109	133.2 Å²	133.2	76%	0.762	70%	0.697	S	S	*	*			trans	-91.9	123.2	154.6	56.9	0	0	0	0	109.8	L602 G606	L602-S604 PolarHBondContact O-N 3.12Å; S604-G606 PolarHBondContact O-N 2.03Å
605	H	39	Very low	45	Very low	181 Å²	181	128.4 Å²	128.4	84%	0.838	69%	0.694	S	S	*	*			trans	-70.2	121.5	-179.8	-89.5	-87.3	0	0	0	112.6
606	G	32.1	Very low	43.3	Very low	71 Å²	71	135.6 Å²	135.6	73%	0.732	73%	0.731	S	S	*	*			trans	-124.6	145.8	156.6	0	0	0	0	0	108.9	S604	S604-G606 PolarHBondContact O-N 2.03Å
607	F	33.3	Very low	42	Very low	181 Å²	181	140.8 Å²	140.8	79%	0.794	75%	0.745	S	S	*	*			trans	-105.6	158.7	-173.3	-117.2	-103.3	0	0	0	112.1
608	D	32	Very low	40.3	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	77%	0.766	S	S	*	*			trans	64.4	133.8	170.1	-68.3	-4.8	0	0	0	117.5
609	D	36.4	Very low	39.5	Very low	132 Å²	132	140.2 Å²	140.2	71%	0.706	77%	0.765	S	S	*	*			cis	-156.2	173.6	-9.4	-166	1.9	0	0	0	109.7
610	Q	40.1	Very low	38.8	Very low	153 Å²	153	142.3 Å²	142.3	72%	0.715	78%	0.776	S	S	*	*			trans	78.7	87.5	169.2	-114.1	85.6	121.1	0	0	117.8
611	F	30.5	Very low	38.3	Very low	204 Å²	204	142.6 Å²	142.6	90%	0.895	78%	0.779	S	S	*	*			trans	-121.7	141.3	152.9	-96.3	-82.8	0	0	0	111
612	P	41	Very low	38.4	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	77%	0.767	S	S	*	*			trans	-62.6	157.1	162.4	-19.5	33.1	0	0	0	111.7
613	R	43.7	Very low	38.7	Very low	234 Å²	234	139.4 Å²	139.4	88%	0.883	77%	0.77	S	S	*	*			trans	-69.1	139.7	175.8	-69.6	175.7	171.4	-109	-2.8	110.8
614	D	35.4	Very low	39.6	Very low	138 Å²	138	138 Å²	138	74%	0.738	78%	0.776	S	S	*	*				-158.6	139.7	91.5	-123.3	-38.3	0	0	0	118.7
615	S	43.5	Very low	40.8	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	76%	0.755	S	S	*	*			trans	47.3	75.3	145.1	-67.8	0	0	0	0	122.8
616	I	37.6	Very low	42.5	Very low	160 Å²	160	131.5 Å²	131.5	82%	0.821	74%	0.739	S	S	*	*			trans	-124	120	138.4	-61	-178.6	0	0	0	109.8
617	K	43.6	Very low	45	Very low	210 Å²	210	130.7 Å²	130.7	91%	0.913	71%	0.714	S	S	*	*			trans	-91.1	104	175.5	-77.2	-177.7	177.6	175.5	0	111.2
618	V	35.8	Very low	47.5	Very low	135 Å²	135	125.3 Å²	125.3	82%	0.818	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-77.9	127	161.3	-176	0	0	0	0	108.6
619	G	39.7	Very low	50.1	Low	69 Å²	69	120.1 Å²	120.1	71%	0.711	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-76.6	134	179.6	0	0	0	0	0	112.2
620	V	39.4	Very low	52.4	Low	134 Å²	134	120.1 Å²	120.1	81%	0.812	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-62.9	147.1	170.6	179.3	0	0	0	0	109.8	E622	V620-E622 PolarHBondContact O-N 3.28Å
621	S	40.9	Very low	54.6	Low	89 Å²	89	117.8 Å²	117.8	62%	0.622	65%	0.645	S	S	*	*			trans	-63.3	111	-180	50.1	0	0	0	0	112.7
622	E	48.5	Very low	56.8	Low	114 Å²	114	113.2 Å²	113.2	53%	0.533	63%	0.627	S	S	.	*			trans	-69.6	129.5	167	-63.1	175.3	125.1	0	0	110	V620 G624 K625	V620-E622 PolarHBondContact O-N 3.28Å; E622-G624 PolarHBondContact O-N 3.48Å; E622-K625 VanDerWaalsContact OE2-CE 3.24Å; E622-K625 WeakPolarHBondContact OE2-CE 3.28Å; E622-K625 IonicContact OE2-NZ 2.63Å; E622-K625 PolarHBondContact OE2-NZ 3.27Å
623	P	44.7	Very low	58.7	Low	138 Å²	138	109.1 Å²	109.1	90%	0.896	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	129.9	174.5	-22.6	33.9	0	0	0	111.7
624	G	58.6	Low	60.7	Low	86 Å²	86	100.7 Å²	100.7	89%	0.887	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.8	17.1	172.9	0	0	0	0	0	116.9	E622	E622-G624 PolarHBondContact O-N 3.48Å
625	K	60.8	Low	62.9	Low	72 Å²	72	96.7 Å²	96.7	31%	0.313	56%	0.555	S	S	.	*			trans	-110.2	141.2	174.8	-67.3	-173.7	175	-177.3	0	112.9	E622 Y627 D656	E622-K625 VanDerWaalsContact OE2-CE 3.24Å; E622-K625 WeakPolarHBondContact OE2-CE 3.28Å; E622-K625 IonicContact OE2-NZ 2.63Å; E622-K625 PolarHBondContact OE2-NZ 3.27Å; K625-Y627 VanDerWaalsContact O-CE2 3.28Å; K625-Y627 WeakPolarHBondContact O-CE2 3.42Å; K625-D656 WeakPolarHBondContact CE-OD2 3.36Å; K625-D656 IonicContact NZ-OD2 2.68Å; K625-D656 PolarHBondContact NZ-OD2 3.25Å
626	T	75.6	Confident	64.9	Low	82 Å²	82	97.3 Å²	97.3	50%	0.503	56%	0.559	S	S	.	*			trans	-96.8	151.2	-178.2	38.6	0	0	0	0	112.7	E655	T626-E655 VanDerWaalsContact CB-OE2 3.23Å; T626-E655 WeakPolarHBondContact CB-OE2 3.4Å; T626-E655 PolarHBondContact O-N 3Å; T626-E655 VanDerWaalsContact O-N 3.12Å; T626-E655 PolarHBondContact OG1-OE2 3.13Å
627	Y	83.4	Confident	67.1	Low	55 Å²	55	90.8 Å²	90.8	22%	0.216	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133	-176.9	-54.2	-85.2	0	0	0	108.9	K625 R654 V661 L665	K625-Y627 VanDerWaalsContact O-CE2 3.28Å; K625-Y627 WeakPolarHBondContact O-CE2 3.42Å; Y627-R654 HydrophobicContact CD1-CB 4.04Å; Y627-R654 HydrophobicContact CD1-CG 3.74Å; Y627-R654 HydrophobicContact CE1-CB 4.13Å; Y627-R654 HydrophobicContact CE1-CG 3.51Å; Y627-V661 HydrophobicContact CD1-CG2 3.83Å; Y627-V661 HydrophobicContact CE1-CG2 4.25Å; Y627-L665 WeakPolarHBondContact CB-O 3.32Å; Y627-L665 HydrophobicContact CD1-CB 4Å; Y627-L665 HydrophobicContact CD1-CD1 4.39Å; Y627-L665 HydrophobicContact CD2-CB 4.26Å; Y627-L665 HydrophobicContact CE1-CB 4.27Å; Y627-L665 HydrophobicContact CE1-CD1 3.94Å; Y627-L665 HydrophobicContact CG-CB 4Å
628	V	86.2	Confident	68.9	Low	67 Å²	67	84.7 Å²	84.7	41%	0.406	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	141.9	-172.4	-175	0	0	0	0	109.4	V653 C666	V628-V653 PolarHBondContact N-O 3.17Å; V628-V653 VanDerWaalsContact O-CG2 3.24Å; V628-V653 WeakPolarHBondContact O-CG2 3.48Å; V628-V653 PolarHBondContact O-N 2.02Å; V628-C666 VanDerWaalsContact C-SG 3.53Å; V628-C666 PolarHBondContact N-SG 2.85Å; V628-C666 VanDerWaalsContact N-SG 3.45Å
629	W	86.4	Confident	70.8	Confident	31 Å²	31	79.9 Å²	79.9	12%	0.117	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.8	172.8	-65.7	102	0	0	0	111.3	I650 C652 P663 C666 S667 T670 K671 P672	W629-I650 HydrophobicContact CD2-CG2 4.5Å; W629-I650 HydrophobicContact CE3-CG2 3.84Å; W629-I650 HydrophobicContact CZ3-CG2 4.45Å; W629-C652 HydrophobicContact CD2-CB 4.45Å; W629-C652 HydrophobicContact CE3-CB 3.98Å; W629-C652 HydrophobicContact CH2-CB 4.31Å; W629-C652 HydrophobicContact CZ3-CB 3.91Å; W629-P663 HydrophobicContact CH2-CB 3.97Å; W629-C666 HydrophobicContact CD2-CB 3.91Å; W629-C666 VanDerWaalsContact CE2-CB 3.44Å; W629-C666 HydrophobicContact CG-CB 4.13Å; W629-C666 HydrophobicContact CZ2-CB 3.87Å; W629-C666 VanDerWaalsContact NE1-CB 3.35Å; W629-S667 PolarHBondContact NE1-O 3.43Å; W629-T670 VanDerWaalsContact CD1-C 3.43Å; W629-T670 VanDerWaalsContact CD1-O 3.23Å; W629-K671 HydrophobicContact CD2-CB 4.23Å; W629-K671 HydrophobicContact CD2-CG 3.97Å; W629-K671 HydrophobicContact CE3-CG 4.24Å; W629-K671 HydrophobicContact CG-CB 4.44Å; W629-K671 HydrophobicContact CG-CG 4.49Å; W629-K671 HydrophobicContact CH2-CD 4.11Å; W629-K671 HydrophobicContact CH2-CG 4.24Å; W629-K671 HydrophobicContact CZ2-CB 4.13Å; W629-K671 HydrophobicContact CZ2-CD 4.11Å; W629-K671 HydrophobicContact CZ2-CG 3.99Å; W629-K671 HydrophobicContact CZ3-CD 4.48Å; W629-K671 HydrophobicContact CZ3-CG 4.36Å; W629-P672 VanDerWaalsContact CB-CD 3.46Å; W629-P672 HydrophobicContact CB-CG 4.17Å
630	R	84.1	Confident	72.6	Confident	132 Å²	132	81.6 Å²	81.6	50%	0.498	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.3	176.4	-170.7	178.8	-64	-179	2.1	111	N651 V653	R630-N651 PolarHBondContact N-O 2.82Å; R630-N651 PolarHBondContact O-N 2.75Å; R630-V653 HydrophobicContact CB-CG1 4.4Å; R630-V653 HydrophobicContact CB-CG2 3.71Å
631	E	86.4	Confident	74.3	Confident	103 Å²	103	76.5 Å²	76.5	48%	0.481	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.3	167.8	-64.3	175	-152.8	0	0	109.3	L648 I649 I650	E631-L648 HydrophobicContact CB-CD1 4.27Å; E631-L648 HydrophobicContact CG-CD1 4.25Å; E631-L648 HydrophobicContact CG-CD2 4.05Å; E631-L648 HydrophobicContact CG-CG 4.31Å; E631-I649 CarbonylContact C-O 3.58Å; E631-I649 WeakPolarHBondContact CA-O 3Å; E631-I650 HydrophobicContact CG-CG1 4.38Å
632	Q	77.7	Confident	75.9	Confident	109 Å²	109	73.8 Å²	73.8	51%	0.509	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-7.6	-178.7	-87.2	-170	-34.6	0	0	114.6	I649 N651	Q632-I649 HydrophobicContact CB-CG2 4.21Å; Q632-I649 PolarHBondContact N-O 3.49Å; Q632-N651 PolarHBondContact OE1-ND2 2.87Å
633	G	81.6	Confident	77.1	Confident	32 Å²	32	68.5 Å²	68.5	33%	0.33	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	137.8	-160.2	-178.2	0	0	0	0	0	111.3	I649	G633-I649 PolarHBondContact O-N 3.44Å
634	Y	84.9	Confident	78.6	Confident	58 Å²	58	61.9 Å²	61.9	23%	0.227	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	153.8	174.7	-78.2	-96	0	0	0	110.4	E646 E647 L648 R677	Y634-E646 HydrophobicContact CD1-CB 4.14Å; Y634-E647 CarbonylContact C-O 3.27Å; Y634-E647 VanDerWaalsContact CA-O 3.27Å; Y634-E647 WeakPolarHBondContact CA-O 3.41Å; Y634-L648 HydrophobicContact CD1-CB 4.37Å; Y634-L648 HydrophobicContact CD2-CD1 4.22Å; Y634-L648 HydrophobicContact CE1-CB 3.86Å; Y634-L648 HydrophobicContact CE1-CD1 4.35Å; Y634-L648 HydrophobicContact CE2-CD1 3.64Å; Y634-R677 HydrophobicContact CD1-CG 4.36Å; Y634-R677 HydrophobicContact CE1-CG 3.72Å; Y634-R677 PolarHBondContact OH-NE 2.88Å; Y634-R677 PolarHBondContact OH-NH2 2.7Å
635	T	82.6	Confident	79.8	Confident	53 Å²	53	60.2 Å²	60.2	33%	0.325	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65.6	162.3	168.4	58.1	0	0	0	0	111	E646 E647 I649	T635-E646 VanDerWaalsContact O-CG 3.24Å; T635-E646 WeakPolarHBondContact O-CG 3.31Å; T635-E647 HydrophobicContact CG2-CB 4.36Å; T635-E647 PolarHBondContact N-O 3.32Å; T635-E647 PolarHBondContact OG1-N 2.81Å; T635-I649 HydrophobicContact CG2-CD1 4.12Å; T635-I649 HydrophobicContact CG2-CG1 3.85Å
636	S	84.8	Confident	80.9	Confident	114 Å²	114	59.5 Å²	59.5	80%	0.797	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-67.5	138.3	172.6	-53.4	0	0	0	0	111.2	S638	S636-S638 PolarHBondContact O-N 2.91Å
637	C	83.2	Confident	81.3	Confident	24 Å²	24	60.8 Å²	60.8	16%	0.162	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-48.6	127.6	-179.6	-171.8	0	0	0	0	114.2	A639 E646 C679 N680	C637-A639 PolarHBondContact O-N 3.24Å; C637-A639 PolarHBondContact SG-O 2.96Å; C637-E646 VanDerWaalsContact CA-CG 3.47Å; C637-E646 HydrophobicContact CB-CG 3.89Å; C637-E646 WeakPolarHBondContact CB-OE1 3.07Å; C637-E646 PolarHBondContact N-OE1 2.95Å; C637-C679 VanDerWaalsContact CA-SG 3.54Å; C637-C679 HydrophobicContact CB-CB 3.75Å; C637-C679 WeakPolarHBondContact CB-SG 3.46Å; C637-C679 WeakPolarHBondContact SG-CB 3.37Å; C637-C679 CovalentContact SG-SG 2.02Å; C637-C679 PolarHBondContact SG-SG 3.44Å; C637-N680 PolarHBondContact SG-ND2 3.46Å
638	S	82.2	Confident	81.3	Confident	82 Å²	82	59 Å²	59	57%	0.573	33%	0.333	S	S	*	.	S	Bend	trans	-66.4	-3.7	-175	81.6	0	0	0	0	116	S636 G644 V645	S636-S638 PolarHBondContact O-N 2.91Å; S638-G644 WeakPolarHBondContact OG-CA 3.33Å; S638-V645 PolarHBondContact N-O 3.35Å; S638-V645 PolarHBondContact OG-N 2.04Å
639	A	75.3	Confident	81.1	Confident	33 Å²	33	58.5 Å²	58.5	27%	0.273	33%	0.327	S	S	.	.			trans	-152.3	147.4	176.2	0	0	0	0	0	110	C637 N680	C637-A639 PolarHBondContact O-N 3.24Å; C637-A639 PolarHBondContact SG-O 2.96Å; A639-N680 WeakPolarHBondContact O-CB 3.49Å; A639-N680 PolarHBondContact O-ND2 2.63Å
640	S	78	Confident	81.1	Confident	105 Å²	105	58.1 Å²	58.1	73%	0.734	33%	0.327	S	S	*	.	S	Bend	trans	-84.7	-19.7	-179.1	50.4	0	0	0	0	114.2
641	C	74.4	Confident	81.2	Confident	27 Å²	27	54.1 Å²	54.1	18%	0.182	32%	0.316	C	S	.	.	S	Bend	trans	-156.7	170.3	177.5	51.3	0	0	0	0	110.1	G643 N680 R682 C684	C641-G643 PolarHBondContact O-N 2.76Å; C641-N680 CarbonylContact C-O 3.43Å; C641-N680 WeakPolarHBondContact CA-O 3.2Å; C641-R682 WeakPolarHBondContact CB-O 3.46Å; C641-C684 HydrophobicContact CB-CB 3.98Å; C641-C684 WeakPolarHBondContact CB-SG 3.06Å; C641-C684 VanDerWaalsContact SG-CA 3.55Å; C641-C684 WeakPolarHBondContact SG-CB 3.46Å; C641-C684 CovalentContact SG-SG 2.04Å; C641-C684 PolarHBondContact SG-SG 3.42Å
642	L	74.8	Confident	81.1	Confident	32 Å²	32	49.2 Å²	49.2	17%	0.168	29%	0.293	C	S	.	.	S	Bend	trans	55.9	25.9	-175.3	-66.4	171.4	0	0	0	115.1	N680 R682 C684 E714 R717	L642-N680 PolarHBondContact N-O 2.95Å; L642-R682 PolarHBondContact N-O 2.96Å; L642-C684 HydrophobicContact CD1-CB 4.47Å; L642-E714 HydrophobicContact CD1-CB 3.83Å; L642-R717 HydrophobicContact CB-CB 4.38Å; L642-R717 WeakPolarHBondContact O-CB 3.37Å; L642-R717 WeakPolarHBondContact O-CD 3.13Å; L642-R717 VanDerWaalsContact O-CG 3.23Å; L642-R717 WeakPolarHBondContact O-CG 3.44Å; L642-R717 PolarHBondContact O-NE 2.93Å
643	G	72.5	Confident	81.6	Confident	3 Å²	3	44.1 Å²	44.1	3%	0.031	27%	0.269	C	S	.	.			trans	84.8	126.4	176.6	0	0	0	0	0	113.2	C641 C679 N680 D681 R717	C641-G643 PolarHBondContact O-N 2.76Å; G643-C679 CarbonylContact C-O 3.51Å; G643-C679 WeakPolarHBondContact CA-O 3.24Å; G643-N680 PolarHBondContact N-O 2.88Å; G643-D681 WeakPolarHBondContact CA-OD1 3.31Å; G643-R717 VanDerWaalsContact C-NH2 3.27Å; G643-R717 PolarHBondContact O-NE 3Å; G643-R717 PolarHBondContact O-NH2 2.87Å
644	G	78	Confident	81.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-168.6	167.2	0	0	0	0	0	111.4	S638 C679	S638-G644 WeakPolarHBondContact OG-CA 3.33Å; G644-C679 PolarHBondContact N-O 2.92Å; G644-C679 PolarHBondContact O-N 3.06Å; G644-C679 PolarHBondContact O-SG 3.46Å
645	V	82.9	Confident	81.3	Confident	50 Å²	50	48.2 Å²	48.2	30%	0.303	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.9	168.2	-68.3	0	0	0	0	112.5	S638 V676 R677 C679	S638-V645 PolarHBondContact N-O 3.35Å; S638-V645 PolarHBondContact OG-N 2.04Å; V645-V676 HydrophobicContact CB-CG1 3.75Å; V645-V676 HydrophobicContact CG1-CG1 4Å; V645-V676 HydrophobicContact CG2-CG1 4.46Å; V645-R677 CarbonylContact C-O 3.58Å; V645-R677 WeakPolarHBondContact CA-O 3.47Å; V645-C679 VanDerWaalsContact C-SG 3.59Å; V645-C679 PolarHBondContact N-SG 2.79Å; V645-C679 VanDerWaalsContact N-SG 3.41Å
646	E	83.7	Confident	80.9	Confident	57 Å²	57	49.7 Å²	49.7	27%	0.266	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.6	173.3	-69.7	-176.1	162.5	0	0	109.8	Y634 T635 C637 V676 R677 C679	Y634-E646 HydrophobicContact CD1-CB 4.14Å; T635-E646 VanDerWaalsContact O-CG 3.24Å; T635-E646 WeakPolarHBondContact O-CG 3.31Å; C637-E646 VanDerWaalsContact CA-CG 3.47Å; C637-E646 HydrophobicContact CB-CG 3.89Å; C637-E646 WeakPolarHBondContact CB-OE1 3.07Å; C637-E646 PolarHBondContact N-OE1 2.95Å; E646-V676 CarbonylContact O-C 3.5Å; E646-V676 WeakPolarHBondContact O-CA 3.43Å; E646-R677 PolarHBondContact N-O 3.47Å; E646-R677 PolarHBondContact O-N 2.83Å; E646-C679 HydrophobicContact CG-CB 4.08Å
647	E	83.9	Confident	80.6	Confident	110 Å²	110	47.7 Å²	47.7	51%	0.514	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.5	-174.5	-54.3	-163.8	146.7	0	0	111.9	Y634 T635 I649 V676	Y634-E647 CarbonylContact C-O 3.27Å; Y634-E647 VanDerWaalsContact CA-O 3.27Å; Y634-E647 WeakPolarHBondContact CA-O 3.41Å; T635-E647 HydrophobicContact CG2-CB 4.36Å; T635-E647 PolarHBondContact N-O 3.32Å; T635-E647 PolarHBondContact OG1-N 2.81Å; E647-I649 PolarHBondContact O-N 3.23Å; E647-V676 HydrophobicContact CG-CG1 4.44Å; E647-V676 HydrophobicContact CG-CG2 4.19Å
648	L	83.1	Confident	80.2	Confident	16 Å²	16	47.9 Å²	47.9	8%	0.084	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	117.3	-179.5	-177.1	69.5	0	0	0	111.5	E631 Y634 I650 R675	E631-L648 HydrophobicContact CB-CD1 4.27Å; E631-L648 HydrophobicContact CG-CD1 4.25Å; E631-L648 HydrophobicContact CG-CD2 4.05Å; E631-L648 HydrophobicContact CG-CG 4.31Å; Y634-L648 HydrophobicContact CD1-CB 4.37Å; Y634-L648 HydrophobicContact CD2-CD1 4.22Å; Y634-L648 HydrophobicContact CE1-CB 3.86Å; Y634-L648 HydrophobicContact CE1-CD1 4.35Å; Y634-L648 HydrophobicContact CE2-CD1 3.64Å; L648-I650 HydrophobicContact CD2-CD1 4.12Å; L648-I650 HydrophobicContact CD2-CG1 4.14Å; L648-I650 HydrophobicContact CG-CD1 4.36Å; L648-I650 HydrophobicContact CG-CG1 4.01Å; L648-I650 PolarHBondContact O-N 3.03Å; L648-R675 HydrophobicContact CB-CB 4.11Å; L648-R675 VanDerWaalsContact CB-O 3.3Å; L648-R675 WeakPolarHBondContact CB-O 2.98Å; L648-R675 HydrophobicContact CD2-CB 4.01Å; L648-R675 HydrophobicContact CD2-CG 4.03Å; L648-R675 PolarHBondContact N-O 3.36Å
649	I	82.5	Confident	80	Confident	58 Å²	58	52.7 Å²	52.7	30%	0.297	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	113	179.1	-56.5	174.4	0	0	0	109.2	E631 Q632 G633 T635 E647	E631-I649 CarbonylContact C-O 3.58Å; E631-I649 WeakPolarHBondContact CA-O 3Å; Q632-I649 HydrophobicContact CB-CG2 4.21Å; Q632-I649 PolarHBondContact N-O 3.49Å; G633-I649 PolarHBondContact O-N 3.44Å; T635-I649 HydrophobicContact CG2-CD1 4.12Å; T635-I649 HydrophobicContact CG2-CG1 3.85Å; E647-I649 PolarHBondContact O-N 3.23Å
650	I	87.2	Confident	80.2	Confident	22 Å²	22	54.6 Å²	54.6	11%	0.113	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	107.7	-176.6	-59.9	161.5	0	0	0	109.1	W629 E631 L648 K671 P672 E673 A674	W629-I650 HydrophobicContact CD2-CG2 4.5Å; W629-I650 HydrophobicContact CE3-CG2 3.84Å; W629-I650 HydrophobicContact CZ3-CG2 4.45Å; E631-I650 HydrophobicContact CG-CG1 4.38Å; L648-I650 HydrophobicContact CD2-CD1 4.12Å; L648-I650 HydrophobicContact CD2-CG1 4.14Å; L648-I650 HydrophobicContact CG-CD1 4.36Å; L648-I650 HydrophobicContact CG-CG1 4.01Å; L648-I650 PolarHBondContact O-N 3.03Å; I650-K671 HydrophobicContact CG2-CG 4.37Å; I650-P672 HydrophobicContact CD1-CB 4.16Å; I650-P672 HydrophobicContact CG1-CB 4.48Å; I650-P672 HydrophobicContact CG2-CB 4.35Å; I650-P672 HydrophobicContact CG2-CG 4.12Å; I650-E673 WeakPolarHBondContact CD1-O 3.49Å; I650-A674 HydrophobicContact CD1-CB 4.49Å
651	N	85.2	Confident	80.5	Confident	48 Å²	48	51.2 Å²	51.2	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.5	-175	-83.8	-34.2	0	0	0	112.1	R630 Q632 V653 V660	R630-N651 PolarHBondContact N-O 2.82Å; R630-N651 PolarHBondContact O-N 2.75Å; Q632-N651 PolarHBondContact OE1-ND2 2.87Å; N651-V653 PolarHBondContact O-N 3.46Å; N651-V660 HydrophobicContact CB-CG1 4Å; N651-V660 HydrophobicContact CB-CG2 3.97Å
652	C	85.4	Confident	80.5	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	120.3	169.3	176.9	0	0	0	0	108.5	W629 V660 V661 C666	W629-C652 HydrophobicContact CD2-CB 4.45Å; W629-C652 HydrophobicContact CE3-CB 3.98Å; W629-C652 HydrophobicContact CH2-CB 4.31Å; W629-C652 HydrophobicContact CZ3-CB 3.91Å; C652-V660 WeakPolarHBondContact O-CA 2.99Å; C652-V661 HydrophobicContact CB-CG2 4.48Å; C652-V661 PolarHBondContact O-N 3.47Å; C652-C666 WeakPolarHBondContact CA-SG 3.43Å; C652-C666 HydrophobicContact CB-CB 3.83Å; C652-C666 WeakPolarHBondContact CB-SG 3.31Å; C652-C666 WeakPolarHBondContact SG-CB 3.03Å; C652-C666 PolarHBondContact SG-N 3.3Å; C652-C666 CovalentContact SG-SG 2.03Å; C652-C666 PolarHBondContact SG-SG 3.13Å
653	V	86.6	Confident	80.6	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.3	-179.6	-63.9	0	0	0	0	111.5	V628 R630 N651 R659 V660	V628-V653 PolarHBondContact N-O 3.17Å; V628-V653 VanDerWaalsContact O-CG2 3.24Å; V628-V653 WeakPolarHBondContact O-CG2 3.48Å; V628-V653 PolarHBondContact O-N 2.02Å; R630-V653 HydrophobicContact CB-CG1 4.4Å; R630-V653 HydrophobicContact CB-CG2 3.71Å; N651-V653 PolarHBondContact O-N 3.46Å; V653-R659 VanDerWaalsContact CA-O 3.31Å; V653-R659 WeakPolarHBondContact CA-O 3.37Å; V653-V660 HydrophobicContact CG1-CG2 4.14Å
654	R	82.5	Confident	80.9	Confident	60 Å²	60	63.6 Å²	63.6	23%	0.226	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.1	174.2	-158.5	171.2	77.8	176.9	17.7	110.1	Y627 D656 N657 G658 R659 V661	Y627-R654 HydrophobicContact CD1-CB 4.04Å; Y627-R654 HydrophobicContact CD1-CG 3.74Å; Y627-R654 HydrophobicContact CE1-CB 4.13Å; Y627-R654 HydrophobicContact CE1-CG 3.51Å; R654-D656 VanDerWaalsContact C-N 3.32Å; R654-D656 IonicContact CZ-OD1 3.58Å; R654-D656 VanDerWaalsContact CZ-OD1 3.28Å; R654-D656 IonicContact CZ-OD2 3.45Å; R654-D656 IonicContact NE-OD1 3.78Å; R654-D656 PolarHBondContact NE-OD1 3.26Å; R654-D656 IonicContact NE-OD2 3.48Å; R654-D656 PolarHBondContact NE-OD2 2.91Å; R654-D656 VanDerWaalsContact NH2-CG 3.32Å; R654-D656 IonicContact NH2-OD1 3.55Å; R654-D656 PolarHBondContact NH2-OD1 3.14Å; R654-D656 IonicContact NH2-OD2 3.17Å; R654-D656 PolarHBondContact NH2-OD2 3.06Å; R654-D656 PolarHBondContact O-N 3.08Å; R654-N657 PolarHBondContact NH2-ND2 3.22Å; R654-N657 VanDerWaalsContact NH2-ND2 3.19Å; R654-G658 WeakPolarHBondContact O-CA 3.44Å; R654-G658 PolarHBondContact O-N 2.69Å; R654-R659 PolarHBondContact N-O 3.47Å; R654-V661 HydrophobicContact CB-CG1 4.08Å
655	E	79.1	Confident	81	Confident	116 Å²	116	67.5 Å²	67.5	54%	0.542	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27.4	-168.3	-164.2	164.4	-139	0	0	113.3	T626 N657	T626-E655 VanDerWaalsContact CB-OE2 3.23Å; T626-E655 WeakPolarHBondContact CB-OE2 3.4Å; T626-E655 PolarHBondContact O-N 3Å; T626-E655 VanDerWaalsContact O-N 3.12Å; T626-E655 PolarHBondContact OG1-OE2 3.13Å; E655-N657 PolarHBondContact O-N 3.44Å
656	D	74.2	Confident	81	Confident	83 Å²	83	65.4 Å²	65.4	44%	0.444	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.8	-177.7	76.3	-16	0	0	0	115.1	K625 R654	K625-D656 WeakPolarHBondContact CE-OD2 3.36Å; K625-D656 IonicContact NZ-OD2 2.68Å; K625-D656 PolarHBondContact NZ-OD2 3.25Å; R654-D656 VanDerWaalsContact C-N 3.32Å; R654-D656 IonicContact CZ-OD1 3.58Å; R654-D656 VanDerWaalsContact CZ-OD1 3.28Å; R654-D656 IonicContact CZ-OD2 3.45Å; R654-D656 IonicContact NE-OD1 3.78Å; R654-D656 PolarHBondContact NE-OD1 3.26Å; R654-D656 IonicContact NE-OD2 3.48Å; R654-D656 PolarHBondContact NE-OD2 2.91Å; R654-D656 VanDerWaalsContact NH2-CG 3.32Å; R654-D656 IonicContact NH2-OD1 3.55Å; R654-D656 PolarHBondContact NH2-OD1 3.14Å; R654-D656 IonicContact NH2-OD2 3.17Å; R654-D656 PolarHBondContact NH2-OD2 3.06Å; R654-D656 PolarHBondContact O-N 3.08Å
657	N	77.8	Confident	81	Confident	73 Å²	73	65.9 Å²	65.9	39%	0.39	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.6	0.1	-173	72	9.1	0	0	0	115.2	R654 E655 R659	R654-N657 PolarHBondContact NH2-ND2 3.22Å; R654-N657 VanDerWaalsContact NH2-ND2 3.19Å; E655-N657 PolarHBondContact O-N 3.44Å; N657-R659 PolarHBondContact O-N 3.32Å; N657-R659 VanDerWaalsContact O-N 3.09Å; N657-R659 WeakPolarHBondContact OD1-CB 3.48Å; N657-R659 PolarHBondContact OD1-N 2.02Å
658	G	75	Confident	80.8	Confident	28 Å²	28	65.7 Å²	65.7	29%	0.289	35%	0.35	S	S	.	.			trans	65.5	7.1	178.6	0	0	0	0	0	115.6	R654	R654-G658 WeakPolarHBondContact O-CA 3.44Å; R654-G658 PolarHBondContact O-N 2.69Å
659	R	77.4	Confident	80.4	Confident	182 Å²	182	73.6 Å²	73.6	69%	0.687	39%	0.386	S	S	*	.			trans	-71	140	177.6	-69.5	-170.6	174.9	-160	-2.4	110.4	V653 R654 N657	V653-R659 VanDerWaalsContact CA-O 3.31Å; V653-R659 WeakPolarHBondContact CA-O 3.37Å; R654-R659 PolarHBondContact N-O 3.47Å; N657-R659 PolarHBondContact O-N 3.32Å; N657-R659 VanDerWaalsContact O-N 3.09Å; N657-R659 WeakPolarHBondContact OD1-CB 3.48Å; N657-R659 PolarHBondContact OD1-N 2.02Å
660	V	80.5	Confident	80.4	Confident	73 Å²	73	75 Å²	75	44%	0.442	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-62.7	135.4	167.6	-176.8	0	0	0	0	108.8	N651 C652 V653	N651-V660 HydrophobicContact CB-CG1 4Å; N651-V660 HydrophobicContact CB-CG2 3.97Å; C652-V660 WeakPolarHBondContact O-CA 2.99Å; V653-V660 HydrophobicContact CG1-CG2 4.14Å
661	V	82.9	Confident	80.1	Confident	35 Å²	35	79.5 Å²	79.5	21%	0.212	42%	0.416	C	S	.	.			trans	-131.5	177.5	177.2	-61.9	0	0	0	0	109.9	Y627 C652 R654 L665	Y627-V661 HydrophobicContact CD1-CG2 3.83Å; Y627-V661 HydrophobicContact CE1-CG2 4.25Å; C652-V661 HydrophobicContact CB-CG2 4.48Å; C652-V661 PolarHBondContact O-N 3.47Å; R654-V661 HydrophobicContact CB-CG1 4.08Å; V661-L665 HydrophobicContact CB-CD1 4.09Å; V661-L665 HydrophobicContact CG2-CB 4.33Å; V661-L665 HydrophobicContact CG2-CD1 4.01Å
662	S	75.2	Confident	80	Confident	59 Å²	59	78.9 Å²	78.9	41%	0.413	42%	0.415	S	S	.	.			trans	-54.4	130.5	179.9	-176.2	0	0	0	0	111.8	F664 L665	S662-F664 PolarHBondContact O-N 3.28Å; S662-F664 WeakPolarHBondContact OG-CD2 3.33Å; S662-L665 PolarHBondContact O-N 3.43Å
663	P	77.5	Confident	79.7	Confident	73 Å²	73	86.5 Å²	86.5	47%	0.474	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-49.1	-30.9	177.7	-32.7	37.9	0	0	0	114.8	W629 L665 C666	W629-P663 HydrophobicContact CH2-CB 3.97Å; P663-L665 PolarHBondContact O-N 3.44Å; P663-C666 PolarHBondContact O-N 2.89Å
664	F	78.4	Confident	79	Confident	190 Å²	190	90.5 Å²	90.5	83%	0.833	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-73.8	-4.4	-178.6	-53.1	-69	0	0	0	114.8	S662	S662-F664 PolarHBondContact O-N 3.28Å; S662-F664 WeakPolarHBondContact OG-CD2 3.33Å
665	L	80.4	Confident	79	Confident	82 Å²	82	94.2 Å²	94.2	43%	0.429	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-89.6	-15.8	175.5	-63.8	175.7	0	0	0	113.3	Y627 V661 S662 P663	Y627-L665 WeakPolarHBondContact CB-O 3.32Å; Y627-L665 HydrophobicContact CD1-CB 4Å; Y627-L665 HydrophobicContact CD1-CD1 4.39Å; Y627-L665 HydrophobicContact CD2-CB 4.26Å; Y627-L665 HydrophobicContact CE1-CB 4.27Å; Y627-L665 HydrophobicContact CE1-CD1 3.94Å; Y627-L665 HydrophobicContact CG-CB 4Å; V661-L665 HydrophobicContact CB-CD1 4.09Å; V661-L665 HydrophobicContact CG2-CB 4.33Å; V661-L665 HydrophobicContact CG2-CD1 4.01Å; S662-L665 PolarHBondContact O-N 3.43Å; P663-L665 PolarHBondContact O-N 3.44Å
666	C	83.4	Confident	79.1	Confident	5 Å²	5	92.7 Å²	92.7	3%	0.034	50%	0.496	C	S	.	.	S	Bend	trans	-99.5	139.4	172.4	-65.9	0	0	0	0	109.9	V628 W629 C652 P663	V628-C666 VanDerWaalsContact C-SG 3.53Å; V628-C666 PolarHBondContact N-SG 2.85Å; V628-C666 VanDerWaalsContact N-SG 3.45Å; W629-C666 HydrophobicContact CD2-CB 3.91Å; W629-C666 VanDerWaalsContact CE2-CB 3.44Å; W629-C666 HydrophobicContact CG-CB 4.13Å; W629-C666 HydrophobicContact CZ2-CB 3.87Å; W629-C666 VanDerWaalsContact NE1-CB 3.35Å; C652-C666 WeakPolarHBondContact CA-SG 3.43Å; C652-C666 HydrophobicContact CB-CB 3.83Å; C652-C666 WeakPolarHBondContact CB-SG 3.31Å; C652-C666 WeakPolarHBondContact SG-CB 3.03Å; C652-C666 PolarHBondContact SG-N 3.3Å; C652-C666 CovalentContact SG-SG 2.03Å; C652-C666 PolarHBondContact SG-SG 3.13Å; P663-C666 PolarHBondContact O-N 2.89Å
667	S	83.5	Confident	79.4	Confident	67 Å²	67	95.1 Å²	95.1	47%	0.469	50%	0.499	S	S	.	.			trans	-59.4	130.7	179.2	-57.4	0	0	0	0	111.3	W629 E669 T670	W629-S667 PolarHBondContact NE1-O 3.43Å; S667-E669 PolarHBondContact O-N 2.87Å; S667-T670 PolarHBondContact O-N 3.37Å; S667-T670 VanDerWaalsContact O-N 3.14Å; S667-T670 PolarHBondContact O-OG1 2.04Å
668	P	78.3	Confident	79.6	Confident	106 Å²	106	96.3 Å²	96.3	69%	0.688	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-65.9	-28.9	-179.4	26	-33.9	0	0	0	112.3	T670 K671	P668-T670 PolarHBondContact O-N 2.94Å; P668-K671 WeakPolarHBondContact O-CB 3.33Å; P668-K671 PolarHBondContact O-N 3.46Å
669	E	76	Confident	79.8	Confident	182 Å²	182	95.6 Å²	95.6	85%	0.85	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20.4	174.6	-64.2	162.8	-173.1	0	0	113.8	S667	S667-E669 PolarHBondContact O-N 2.87Å
670	T	81.1	Confident	79.7	Confident	88 Å²	88	90.5 Å²	90.5	54%	0.54	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-107.1	10.6	-179.8	62.5	0	0	0	0	113.1	W629 S667 P668 P672	W629-T670 VanDerWaalsContact CD1-C 3.43Å; W629-T670 VanDerWaalsContact CD1-O 3.23Å; S667-T670 PolarHBondContact O-N 3.37Å; S667-T670 VanDerWaalsContact O-N 3.14Å; S667-T670 PolarHBondContact O-OG1 2.04Å; P668-T670 PolarHBondContact O-N 2.94Å; T670-P672 WeakPolarHBondContact O-CD 3.03Å
671	K	82.8	Confident	79.2	Confident	116 Å²	116	92.4 Å²	92.4	50%	0.504	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-74.7	125.6	-179.8	-169.6	-175.9	175.7	-173.4	0	111	W629 I650 P668	W629-K671 HydrophobicContact CD2-CB 4.23Å; W629-K671 HydrophobicContact CD2-CG 3.97Å; W629-K671 HydrophobicContact CE3-CG 4.24Å; W629-K671 HydrophobicContact CG-CB 4.44Å; W629-K671 HydrophobicContact CG-CG 4.49Å; W629-K671 HydrophobicContact CH2-CD 4.11Å; W629-K671 HydrophobicContact CH2-CG 4.24Å; W629-K671 HydrophobicContact CZ2-CB 4.13Å; W629-K671 HydrophobicContact CZ2-CD 4.11Å; W629-K671 HydrophobicContact CZ2-CG 3.99Å; W629-K671 HydrophobicContact CZ3-CD 4.48Å; W629-K671 HydrophobicContact CZ3-CG 4.36Å; I650-K671 HydrophobicContact CG2-CG 4.37Å; P668-K671 WeakPolarHBondContact O-CB 3.33Å; P668-K671 PolarHBondContact O-N 3.46Å
672	P	81.8	Confident	78.7	Confident	36 Å²	36	100.5 Å²	100.5	23%	0.234	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-57.2	155.3	171.9	-25.7	33.9	0	0	0	113.5	W629 I650 T670	W629-P672 VanDerWaalsContact CB-CD 3.46Å; W629-P672 HydrophobicContact CB-CG 4.17Å; I650-P672 HydrophobicContact CD1-CB 4.16Å; I650-P672 HydrophobicContact CG1-CB 4.48Å; I650-P672 HydrophobicContact CG2-CB 4.35Å; I650-P672 HydrophobicContact CG2-CG 4.12Å; T670-P672 WeakPolarHBondContact O-CD 3.03Å
673	E	78.9	Confident	78.4	Confident	160 Å²	160	101.3 Å²	101.3	75%	0.748	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-65.3	134.8	174.1	-64	-176.2	154.5	0	0	111	I650 R675	I650-E673 WeakPolarHBondContact CD1-O 3.49Å; E673-R675 PolarHBondContact O-N 3.37Å
674	A	72	Confident	78.3	Confident	86 Å²	86	98.4 Å²	98.4	71%	0.711	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-71.6	121.3	170.5	0	0	0	0	0	109.5	I650	I650-A674 HydrophobicContact CD1-CB 4.49Å
675	R	83.6	Confident	78.4	Confident	138 Å²	138	94.2 Å²	94.2	52%	0.521	50%	0.498	S	S	.	.			trans	-115.9	132.1	-175.9	-59.6	173.7	75.6	179	7.4	109.6	L648 E673	L648-R675 HydrophobicContact CB-CB 4.11Å; L648-R675 VanDerWaalsContact CB-O 3.3Å; L648-R675 WeakPolarHBondContact CB-O 2.98Å; L648-R675 HydrophobicContact CD2-CB 4.01Å; L648-R675 HydrophobicContact CD2-CG 4.03Å; L648-R675 PolarHBondContact N-O 3.36Å; E673-R675 PolarHBondContact O-N 3.37Å
676	V	80.5	Confident	78.5	Confident	84 Å²	84	92 Å²	92	51%	0.509	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.3	177.9	-173.2	0	0	0	0	109.2	V645 E646 E647	V645-V676 HydrophobicContact CB-CG1 3.75Å; V645-V676 HydrophobicContact CG1-CG1 4Å; V645-V676 HydrophobicContact CG2-CG1 4.46Å; E646-V676 CarbonylContact O-C 3.5Å; E646-V676 WeakPolarHBondContact O-CA 3.43Å; E647-V676 HydrophobicContact CG-CG1 4.44Å; E647-V676 HydrophobicContact CG-CG2 4.19Å
677	R	80.8	Confident	78.5	Confident	135 Å²	135	97.1 Å²	97.1	51%	0.509	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.5	175.3	-63.6	-177.6	-175.7	-165.9	3.5	110.3	Y634 V645 E646	Y634-R677 HydrophobicContact CD1-CG 4.36Å; Y634-R677 HydrophobicContact CE1-CG 3.72Å; Y634-R677 PolarHBondContact OH-NE 2.88Å; Y634-R677 PolarHBondContact OH-NH2 2.7Å; V645-R677 CarbonylContact C-O 3.58Å; V645-R677 WeakPolarHBondContact CA-O 3.47Å; E646-R677 PolarHBondContact N-O 3.47Å; E646-R677 PolarHBondContact O-N 2.83Å
678	T	81.3	Confident	78.7	Confident	97 Å²	97	95.6 Å²	95.6	60%	0.595	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	154	165.1	44.2	0	0	0	0	111.3
679	C	80.2	Confident	79.1	Confident	13 Å²	13	94.3 Å²	94.3	9%	0.088	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	159	-171.5	53.2	0	0	0	0	109.8	C637 G643 G644 V645 E646 D681	C637-C679 VanDerWaalsContact CA-SG 3.54Å; C637-C679 HydrophobicContact CB-CB 3.75Å; C637-C679 WeakPolarHBondContact CB-SG 3.46Å; C637-C679 WeakPolarHBondContact SG-CB 3.37Å; C637-C679 CovalentContact SG-SG 2.02Å; C637-C679 PolarHBondContact SG-SG 3.44Å; G643-C679 CarbonylContact C-O 3.51Å; G643-C679 WeakPolarHBondContact CA-O 3.24Å; G644-C679 PolarHBondContact N-O 2.92Å; G644-C679 PolarHBondContact O-N 3.06Å; G644-C679 PolarHBondContact O-SG 3.46Å; V645-C679 VanDerWaalsContact C-SG 3.59Å; V645-C679 PolarHBondContact N-SG 2.79Å; V645-C679 VanDerWaalsContact N-SG 3.41Å; E646-C679 HydrophobicContact CG-CB 4.08Å; C679-D681 VanDerWaalsContact C-N 3.34Å; C679-D681 PolarHBondContact O-N 2.82Å
680	N	75.6	Confident	79.5	Confident	76 Å²	76	91.5 Å²	91.5	41%	0.406	46%	0.46	S	S	.	.			trans	54.3	39.3	174.5	-63.8	-18.4	0	0	0	115.9	C637 A639 C641 L642 G643 R682	C637-N680 PolarHBondContact SG-ND2 3.46Å; A639-N680 WeakPolarHBondContact O-CB 3.49Å; A639-N680 PolarHBondContact O-ND2 2.63Å; C641-N680 CarbonylContact C-O 3.43Å; C641-N680 WeakPolarHBondContact CA-O 3.2Å; L642-N680 PolarHBondContact N-O 2.95Å; G643-N680 PolarHBondContact N-O 2.88Å; N680-R682 PolarHBondContact O-N 2.86Å
681	D	69.9	Low	79.4	Confident	113 Å²	113	89.7 Å²	89.7	60%	0.604	45%	0.452	S	S	*	.			trans	-71.2	29	178.5	-55.3	-58	0	0	0	114.8	G643 C679	G643-D681 WeakPolarHBondContact CA-OD1 3.31Å; C679-D681 VanDerWaalsContact C-N 3.34Å; C679-D681 PolarHBondContact O-N 2.82Å
682	R	71.9	Confident	79.4	Confident	204 Å²	204	90.8 Å²	90.8	77%	0.77	46%	0.463	S	S	*	.	S	Bend	trans	-98.5	144	178.4	-64.5	-173	179.5	-149.3	-0.7	111.1	C641 L642 N680	C641-R682 WeakPolarHBondContact CB-O 3.46Å; L642-R682 PolarHBondContact N-O 2.96Å; N680-R682 PolarHBondContact O-N 2.86Å
683	P	67.8	Low	79.4	Confident	76 Å²	76	92 Å²	92	49%	0.494	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-57.4	147.7	172.6	-24.2	34.5	0	0	0	112.7
684	C	76.4	Confident	79.5	Confident	12 Å²	12	87.3 Å²	87.3	8%	0.081	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	138.3	178.4	-62.1	0	0	0	0	110.8	C641 L642 H713	C641-C684 HydrophobicContact CB-CB 3.98Å; C641-C684 WeakPolarHBondContact CB-SG 3.06Å; C641-C684 VanDerWaalsContact SG-CA 3.55Å; C641-C684 WeakPolarHBondContact SG-CB 3.46Å; C641-C684 CovalentContact SG-SG 2.04Å; C641-C684 PolarHBondContact SG-SG 3.42Å; L642-C684 HydrophobicContact CD1-CB 4.47Å; C684-H713 PolarHBondContact O-CE1 2.98Å; C684-H713 PolarHBondContact O-ND1 3.24Å
685	P	80.4	Confident	80	Confident	103 Å²	103	87.9 Å²	87.9	67%	0.669	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.6	149.5	177.5	-26.2	35	0	0	0	113.2
686	P	83.1	Confident	79.9	Confident	35 Å²	35	82.8 Å²	82.8	23%	0.227	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	141.7	175.5	-20.3	31.7	0	0	0	112.1	I712 H713 V725 M729	P686-I712 CarbonylContact C-O 3.52Å; P686-I712 WeakPolarHBondContact CA-O 3.22Å; P686-H713 HydrophobicContact CB-CB 4.32Å; P686-H713 HydrophobicContact CG-CB 4.25Å; P686-V725 HydrophobicContact CB-CG2 4.36Å; P686-M729 HydrophobicContact CB-CB 4.44Å; P686-M729 HydrophobicContact CG-CB 4.31Å
687	R	83.6	Confident	80.1	Confident	112 Å²	112	82.6 Å²	82.6	42%	0.423	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157.1	-179.1	68.6	172.8	-175	-93.4	-1.1	111.7	N689 I712 E714 C730	R687-N689 PolarHBondContact O-N 2.86Å; R687-I712 HydrophobicContact CG-CD1 4.43Å; R687-I712 HydrophobicContact CG-CG1 4.04Å; R687-I712 PolarHBondContact N-O 3.26Å; R687-I712 WeakPolarHBondContact O-CG1 3.42Å; R687-I712 PolarHBondContact O-N 2.77Å; R687-E714 IonicContact CZ-OE1 2.72Å; R687-E714 IonicContact CZ-OE2 2.89Å; R687-E714 IonicContact NH1-OE1 2.95Å; R687-E714 PolarHBondContact NH1-OE1 3.24Å; R687-E714 IonicContact NH1-OE2 3.48Å; R687-E714 PolarHBondContact NH1-OE2 3.5Å; R687-E714 IonicContact NH2-OE1 2.69Å; R687-E714 PolarHBondContact NH2-OE1 3.34Å; R687-E714 IonicContact NH2-OE2 2.64Å; R687-C730 PolarHBondContact O-SG 3.46Å
688	W	86.4	Confident	79.8	Confident	35 Å²	35	80.3 Å²	80.3	13%	0.133	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	120.4	171.1	-66.2	112.8	0	0	0	110.3	Y690 V709 C711 N727 C730 P731 P734 P735	W688-Y690 HydrophobicContact CB-CD1 4.1Å; W688-V709 HydrophobicContact CD2-CG1 4.38Å; W688-V709 HydrophobicContact CE3-CG1 3.71Å; W688-V709 HydrophobicContact CZ3-CG1 4.03Å; W688-C711 HydrophobicContact CE3-CB 4.05Å; W688-C711 HydrophobicContact CH2-CB 4.43Å; W688-C711 HydrophobicContact CZ3-CB 3.85Å; W688-N727 HydrophobicContact CH2-CB 3.69Å; W688-N727 WeakPolarHBondContact CH2-O 2.82Å; W688-N727 HydrophobicContact CZ3-CB 4.2Å; W688-C730 HydrophobicContact CD2-CB 3.74Å; W688-C730 HydrophobicContact CE3-CB 4.24Å; W688-C730 HydrophobicContact CG-CB 4.2Å; W688-C730 HydrophobicContact CH2-CB 4.14Å; W688-C730 HydrophobicContact CZ2-CB 3.61Å; W688-C730 HydrophobicContact CZ3-CB 4.43Å; W688-P731 PolarHBondContact NE1-O 2.76Å; W688-P734 HydrophobicContact CH2-CB 3.69Å; W688-P734 HydrophobicContact CZ2-CB 3.68Å; W688-P734 HydrophobicContact CZ3-CB 4.37Å; W688-P735 HydrophobicContact CB-CG 4.01Å; W688-P735 HydrophobicContact CD2-CG 4.23Å; W688-P735 HydrophobicContact CG-CG 3.78Å
689	N	87.1	Confident	79.7	Confident	79 Å²	79	80.5 Å²	80.5	42%	0.422	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.4	155	-166.5	37.6	0	0	0	107.4	R687 Q710 I712	R687-N689 PolarHBondContact O-N 2.86Å; N689-Q710 CarbonylContact C-O 3.53Å; N689-Q710 PolarHBondContact N-O 3.39Å; N689-Q710 PolarHBondContact O-N 3.27Å; N689-I712 HydrophobicContact CB-CB 4.38Å; N689-I712 HydrophobicContact CB-CD1 3.87Å; N689-I712 HydrophobicContact CB-CG1 3.88Å; N689-I712 HydrophobicContact CB-CG2 3.63Å
690	Y	83.4	Confident	79.5	Confident	123 Å²	123	81.1 Å²	81.1	48%	0.482	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	144.5	172.2	49.9	-100.4	0	0	0	109.2	W688 E708 P735	W688-Y690 HydrophobicContact CB-CD1 4.1Å; Y690-E708 CarbonylContact C-O 3.59Å; Y690-E708 WeakPolarHBondContact CA-O 3.47Å; Y690-E708 WeakPolarHBondContact CB-O 3.33Å; Y690-P735 HydrophobicContact CD1-CB 4.39Å; Y690-P735 HydrophobicContact CD1-CG 4.04Å; Y690-P735 HydrophobicContact CE1-CG 4.45Å
691	S	80.8	Confident	79.6	Confident	51 Å²	51	77.6 Å²	77.6	36%	0.357	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-71.5	164.6	167.3	74.4	0	0	0	0	109.6	R707 E708	S691-R707 WeakPolarHBondContact O-CB 3.31Å; S691-R707 VanDerWaalsContact O-CD 3.32Å; S691-R707 WeakPolarHBondContact O-CD 3.09Å; S691-R707 WeakPolarHBondContact OG-CB 3.2Å; S691-E708 PolarHBondContact N-O 3.49Å; S691-E708 PolarHBondContact OG-N 2.04Å
692	D	82.1	Confident	80.2	Confident	138 Å²	138	74.6 Å²	74.6	74%	0.738	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-61.5	163.6	157.4	-67.1	-66.5	0	0	0	111.1	R707	D692-R707 WeakPolarHBondContact O-CB 3.03Å
693	Y	82.4	Confident	80.5	Confident	61 Å²	61	64.9 Å²	64.9	24%	0.239	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-72.2	134.7	175.5	-73	-82.4	0	0	0	110.7	K705 T706 R707 A736 Q739	Y693-K705 HydrophobicContact CD1-CB 4.39Å; Y693-K705 HydrophobicContact CD1-CD 4.3Å; Y693-K705 HydrophobicContact CD1-CG 3.87Å; Y693-K705 HydrophobicContact CD2-CD 4.5Å; Y693-K705 HydrophobicContact CG-CD 3.96Å; Y693-K705 HydrophobicContact CG-CG 4.04Å; Y693-T706 CarbonylContact C-O 3.46Å; Y693-T706 WeakPolarHBondContact CA-O 3.49Å; Y693-R707 HydrophobicContact CD1-CB 3.99Å; Y693-R707 HydrophobicContact CD1-CG 3.88Å; Y693-R707 HydrophobicContact CE1-CB 4.39Å; Y693-R707 HydrophobicContact CE1-CG 3.76Å; Y693-R707 HydrophobicContact CG-CB 4.32Å; Y693-R707 HydrophobicContact CG-CG 4.42Å; Y693-R707 PolarHBondContact OH-NE 2.89Å; Y693-R707 PolarHBondContact OH-NH2 3.16Å; Y693-A736 PolarHBondContact OH-O 2.93Å; Y693-Q739 HydrophobicContact CE1-CB 4.05Å
694	T	81.4	Confident	81.1	Confident	62 Å²	62	64.9 Å²	64.9	38%	0.38	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-51.7	156.7	167.7	61.1	0	0	0	0	111.2	K705 T706	T694-K705 VanDerWaalsContact O-CB 3.25Å; T694-K705 WeakPolarHBondContact O-CB 3.3Å; T694-T706 WeakPolarHBondContact CG2-O 3.27Å; T694-T706 PolarHBondContact N-O 2.87Å; T694-T706 PolarHBondContact OG1-N 3.47Å; T694-T706 PolarHBondContact OG1-O 2.96Å; T694-T706 PolarHBondContact OG1-OG1 2.76Å; T694-T706 VanDerWaalsContact OG1-OG1 3.1Å
695	P	80.7	Confident	81.3	Confident	98 Å²	98	67.1 Å²	67.1	64%	0.636	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-48.1	148.8	166.3	-28.4	36.1	0	0	0	112.6	S697	P695-S697 PolarHBondContact O-N 2.84Å
696	C	81.3	Confident	81.3	Confident	32 Å²	32	65 Å²	65	22%	0.216	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-69.5	130.1	-176.5	-169.2	0	0	0	0	111.3	K698 G703 C741 N742	C696-K698 PolarHBondContact O-N 2.57Å; C696-K698 PolarHBondContact SG-O 2.83Å; C696-K698 VanDerWaalsContact SG-O 3.38Å; C696-G703 VanDerWaalsContact SG-CA 3.58Å; C696-C741 VanDerWaalsContact CA-SG 3.55Å; C696-C741 HydrophobicContact CB-CB 3.92Å; C696-C741 WeakPolarHBondContact CB-SG 3.32Å; C696-C741 WeakPolarHBondContact SG-CB 3.44Å; C696-C741 CovalentContact SG-SG 2.02Å; C696-C741 PolarHBondContact SG-SG 3.2Å; C696-N742 WeakPolarHBondContact CB-ND2 3.46Å
697	S	85.3	Confident	81.3	Confident	80 Å²	80	65.5 Å²	65.5	56%	0.559	35%	0.347	S	S	*	.	S	Bend	trans	-64.1	-7	-172.7	71.1	0	0	0	0	116.4	P695 I704	P695-S697 PolarHBondContact O-N 2.84Å; S697-I704 VanDerWaalsContact CB-O 3.29Å; S697-I704 WeakPolarHBondContact CB-O 3.16Å; S697-I704 PolarHBondContact N-O 2.83Å; S697-I704 PolarHBondContact OG-N 2.86Å; S697-I704 PolarHBondContact OG-O 2.84Å
698	K	75.8	Confident	81.1	Confident	86 Å²	86	66.1 Å²	66.1	37%	0.374	36%	0.355	S	S	.	.			trans	-145.3	147.6	168.2	-52.7	-174.1	-155.9	163.5	0	109.4	C696 C700 I702 N742 E780	C696-K698 PolarHBondContact O-N 2.57Å; C696-K698 PolarHBondContact SG-O 2.83Å; C696-K698 VanDerWaalsContact SG-O 3.38Å; K698-C700 WeakPolarHBondContact CB-O 3.42Å; K698-I702 WeakPolarHBondContact CD-O 3.34Å; K698-I702 WeakPolarHBondContact CE-O 3.47Å; K698-I702 PolarHBondContact NZ-O 3.22Å; K698-I702 VanDerWaalsContact NZ-O 3.07Å; K698-N742 WeakPolarHBondContact O-CB 3.39Å; K698-N742 PolarHBondContact O-ND2 2.97Å; K698-E780 IonicContact NZ-OE1 2.68Å; K698-E780 PolarHBondContact NZ-OE1 2.68Å
699	S	78.1	Confident	81.1	Confident	102 Å²	102	66 Å²	66	71%	0.713	36%	0.358	S	S	*	.	S	Bend	trans	-80.6	-18.1	172.3	49.1	0	0	0	0	113.8
700	C	76.6	Confident	81.1	Confident	26 Å²	26	65.3 Å²	65.3	18%	0.176	35%	0.353	C	S	.	.	S	Bend	trans	-156.2	171.6	176.8	64.1	0	0	0	0	111.1	K698 C746	K698-C700 WeakPolarHBondContact CB-O 3.42Å; C700-C746 VanDerWaalsContact C-SG 3.52Å; C700-C746 HydrophobicContact CB-CB 3.87Å; C700-C746 WeakPolarHBondContact CB-SG 3.06Å; C700-C746 WeakPolarHBondContact SG-CA 3.03Å; C700-C746 WeakPolarHBondContact SG-CB 3.34Å; C700-C746 CovalentContact SG-SG 2.04Å; C700-C746 PolarHBondContact SG-SG 3.2Å
701	G	77.6	Confident	81.2	Confident	2 Å²	2	59.5 Å²	59.5	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	83.2	-110.8	-168.3	0	0	0	0	0	109.8	N742 V743 L744 A778	G701-N742 CarbonylContact C-O 3.59Å; G701-N742 VanDerWaalsContact O-O 3.09Å; G701-V743 WeakPolarHBondContact O-CA 3.44Å; G701-L744 WeakPolarHBondContact CA-O 3.28Å; G701-L744 PolarHBondContact N-O 2.61Å; G701-L744 PolarHBondContact O-N 3Å; G701-A778 WeakPolarHBondContact O-CA 3.29Å
702	I	82	Confident	81.4	Confident	50 Å²	50	57.4 Å²	57.4	26%	0.256	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	117.7	166.8	-56	177.8	0	0	0	108.2	K698 Y740 V743 A778 E780	K698-I702 WeakPolarHBondContact CD-O 3.34Å; K698-I702 WeakPolarHBondContact CE-O 3.47Å; K698-I702 PolarHBondContact NZ-O 3.22Å; K698-I702 VanDerWaalsContact NZ-O 3.07Å; I702-Y740 HydrophobicContact CG2-CD1 3.73Å; I702-Y740 HydrophobicContact CG2-CE1 4.34Å; I702-V743 HydrophobicContact CG2-CG2 4.37Å; I702-A778 WeakPolarHBondContact CD1-O 3.43Å; I702-A778 WeakPolarHBondContact CG1-O 3.32Å; I702-E780 HydrophobicContact CD1-CG 4.35Å; I702-E780 HydrophobicContact CG1-CG 4.36Å
703	G	79.6	Confident	81.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	168.5	169	0	0	0	0	0	112.5	C696 C741	C696-G703 VanDerWaalsContact SG-CA 3.58Å; G703-C741 CarbonylContact C-O 3.55Å; G703-C741 VanDerWaalsContact C-SG 3.59Å; G703-C741 WeakPolarHBondContact CA-O 3.38Å; G703-C741 PolarHBondContact N-O 2.82Å; G703-C741 PolarHBondContact O-N 3.17Å
704	I	80.4	Confident	81.1	Confident	75 Å²	75	52.1 Å²	52.1	39%	0.385	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.7	174.1	-57.1	175	0	0	0	107.5	S697 T706 R738 Q739 Y740	S697-I704 VanDerWaalsContact CB-O 3.29Å; S697-I704 WeakPolarHBondContact CB-O 3.16Å; S697-I704 PolarHBondContact N-O 2.83Å; S697-I704 PolarHBondContact OG-N 2.86Å; S697-I704 PolarHBondContact OG-O 2.84Å; I704-T706 HydrophobicContact CG2-CG2 4.43Å; I704-R738 HydrophobicContact CG2-CB 4.37Å; I704-Q739 WeakPolarHBondContact CA-O 3.48Å; I704-Y740 HydrophobicContact CD1-CE1 4.33Å; I704-Y740 HydrophobicContact CG1-CD1 4.03Å; I704-Y740 HydrophobicContact CG1-CE1 4.18Å
705	K	80.5	Confident	80.4	Confident	59 Å²	59	52.6 Å²	52.6	26%	0.257	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.7	168.7	62.2	-179.1	-167.4	173.7	0	110	Y693 T694 R738 Q739 C741	Y693-K705 HydrophobicContact CD1-CB 4.39Å; Y693-K705 HydrophobicContact CD1-CD 4.3Å; Y693-K705 HydrophobicContact CD1-CG 3.87Å; Y693-K705 HydrophobicContact CD2-CD 4.5Å; Y693-K705 HydrophobicContact CG-CD 3.96Å; Y693-K705 HydrophobicContact CG-CG 4.04Å; T694-K705 VanDerWaalsContact O-CB 3.25Å; T694-K705 WeakPolarHBondContact O-CB 3.3Å; K705-R738 CarbonylContact O-C 3.54Å; K705-R738 VanDerWaalsContact O-CA 3.31Å; K705-R738 WeakPolarHBondContact O-CA 3.46Å; K705-Q739 HydrophobicContact CG-CB 4.07Å; K705-Q739 PolarHBondContact N-O 2.92Å; K705-Q739 PolarHBondContact O-N 2.87Å; K705-C741 HydrophobicContact CD-CB 4.21Å; K705-C741 HydrophobicContact CG-CB 4.28Å; K705-C741 PolarHBondContact N-SG 2.96Å; K705-C741 VanDerWaalsContact N-SG 3.37Å
706	T	80.4	Confident	79.6	Confident	58 Å²	58	51 Å²	51	36%	0.356	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.9	-173.2	41.5	0	0	0	0	111.1	Y693 T694 I704 D737 R738	Y693-T706 CarbonylContact C-O 3.46Å; Y693-T706 WeakPolarHBondContact CA-O 3.49Å; T694-T706 WeakPolarHBondContact CG2-O 3.27Å; T694-T706 PolarHBondContact N-O 2.87Å; T694-T706 PolarHBondContact OG1-N 3.47Å; T694-T706 PolarHBondContact OG1-O 2.96Å; T694-T706 PolarHBondContact OG1-OG1 2.76Å; T694-T706 VanDerWaalsContact OG1-OG1 3.1Å; I704-T706 HydrophobicContact CG2-CG2 4.43Å; T706-D737 CarbonylContact C-O 3.55Å; T706-D737 WeakPolarHBondContact CA-O 3.42Å; T706-R738 HydrophobicContact CG2-CB 4Å
707	R	81.2	Confident	78.5	Confident	46 Å²	46	56.9 Å²	56.9	17%	0.174	30%	0.296	C	S	.	.			trans	-141	155.6	173.5	60.2	175.8	169.7	174.6	-7.7	111.9	S691 D692 Y693 V709 A736 D737	S691-R707 WeakPolarHBondContact O-CB 3.31Å; S691-R707 VanDerWaalsContact O-CD 3.32Å; S691-R707 WeakPolarHBondContact O-CD 3.09Å; S691-R707 WeakPolarHBondContact OG-CB 3.2Å; D692-R707 WeakPolarHBondContact O-CB 3.03Å; Y693-R707 HydrophobicContact CD1-CB 3.99Å; Y693-R707 HydrophobicContact CD1-CG 3.88Å; Y693-R707 HydrophobicContact CE1-CB 4.39Å; Y693-R707 HydrophobicContact CE1-CG 3.76Å; Y693-R707 HydrophobicContact CG-CB 4.32Å; Y693-R707 HydrophobicContact CG-CG 4.42Å; Y693-R707 PolarHBondContact OH-NE 2.89Å; Y693-R707 PolarHBondContact OH-NH2 3.16Å; R707-V709 HydrophobicContact CG-CG2 3.96Å; R707-A736 PolarHBondContact NE-O 3.47Å; R707-A736 PolarHBondContact NH2-O 3.5Å; R707-A736 VanDerWaalsContact NH2-O 3.08Å; R707-D737 PolarHBondContact N-O 3.2Å
708	E	80.2	Confident	77.1	Confident	126 Å²	126	56.1 Å²	56.1	59%	0.589	30%	0.301	S	S	*	.			trans	-76.1	140.8	167.5	-63.4	-161.5	-172.5	0	0	110.4	Y690 S691 Q710	Y690-E708 CarbonylContact C-O 3.59Å; Y690-E708 WeakPolarHBondContact CA-O 3.47Å; Y690-E708 WeakPolarHBondContact CB-O 3.33Å; S691-E708 PolarHBondContact N-O 3.49Å; S691-E708 PolarHBondContact OG-N 2.04Å; E708-Q710 PolarHBondContact OE2-NE2 3.46Å; E708-Q710 VanDerWaalsContact OE2-NE2 3.07Å
709	V	86.9	Confident	76.1	Confident	31 Å²	31	54.3 Å²	54.3	19%	0.188	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	117.8	179.4	-176.1	0	0	0	0	108	W688 R707 P735	W688-V709 HydrophobicContact CD2-CG1 4.38Å; W688-V709 HydrophobicContact CE3-CG1 3.71Å; W688-V709 HydrophobicContact CZ3-CG1 4.03Å; R707-V709 HydrophobicContact CG-CG2 3.96Å; V709-P735 HydrophobicContact CG1-CB 4.14Å; V709-P735 HydrophobicContact CG1-CG 4.11Å; V709-P735 HydrophobicContact CG2-CB 4.42Å
710	Q	86.3	Confident	75	Confident	66 Å²	66	56.8 Å²	56.8	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.1	-173.5	-53.9	-177.4	15.2	0	0	109.1	N689 E708 V724	N689-Q710 CarbonylContact C-O 3.53Å; N689-Q710 PolarHBondContact N-O 3.39Å; N689-Q710 PolarHBondContact O-N 3.27Å; E708-Q710 PolarHBondContact OE2-NE2 3.46Å; E708-Q710 VanDerWaalsContact OE2-NE2 3.07Å; Q710-V724 HydrophobicContact CB-CG1 4.46Å
711	C	86.3	Confident	74.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.3	172	-178.2	0	0	0	0	109.3	W688 V724 V725 C730	W688-C711 HydrophobicContact CE3-CB 4.05Å; W688-C711 HydrophobicContact CH2-CB 4.43Å; W688-C711 HydrophobicContact CZ3-CB 3.85Å; C711-V724 WeakPolarHBondContact O-CA 3.14Å; C711-V725 HydrophobicContact CB-CG2 4.17Å; C711-V725 WeakPolarHBondContact CB-O 3.41Å; C711-V725 PolarHBondContact O-N 3.25Å; C711-V725 WeakPolarHBondContact SG-CG2 3.43Å; C711-C730 WeakPolarHBondContact CA-SG 3.49Å; C711-C730 HydrophobicContact CB-CB 3.87Å; C711-C730 WeakPolarHBondContact CB-SG 3.2Å; C711-C730 WeakPolarHBondContact SG-CB 3.46Å; C711-C730 PolarHBondContact SG-N 3.08Å; C711-C730 VanDerWaalsContact SG-N 3.36Å; C711-C730 CovalentContact SG-SG 2.02Å; C711-C730 PolarHBondContact SG-SG 3.44Å
712	I	85.6	Confident	73.8	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.036	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	154.4	-178.6	65.7	163.3	0	0	0	112.3	P686 R687 N689 T722 M723 V724	P686-I712 CarbonylContact C-O 3.52Å; P686-I712 WeakPolarHBondContact CA-O 3.22Å; R687-I712 HydrophobicContact CG-CD1 4.43Å; R687-I712 HydrophobicContact CG-CG1 4.04Å; R687-I712 PolarHBondContact N-O 3.26Å; R687-I712 WeakPolarHBondContact O-CG1 3.42Å; R687-I712 PolarHBondContact O-N 2.77Å; N689-I712 HydrophobicContact CB-CB 4.38Å; N689-I712 HydrophobicContact CB-CD1 3.87Å; N689-I712 HydrophobicContact CB-CG1 3.88Å; N689-I712 HydrophobicContact CB-CG2 3.63Å; I712-T722 HydrophobicContact CD1-CG2 3.99Å; I712-M723 CarbonylContact C-O 3.5Å; I712-M723 VanDerWaalsContact CA-O 3.31Å; I712-M723 WeakPolarHBondContact CA-O 3.05Å; I712-V724 HydrophobicContact CG2-CG2 4.36Å
713	H	82.3	Confident	73.5	Confident	49 Å²	49	67 Å²	67	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.2	174.5	-175.3	45.2	0	0	0	110.3	C684 P686 M723 V725	C684-H713 PolarHBondContact O-CE1 2.98Å; C684-H713 PolarHBondContact O-ND1 3.24Å; P686-H713 HydrophobicContact CB-CB 4.32Å; P686-H713 HydrophobicContact CG-CB 4.25Å; H713-M723 PolarHBondContact N-O 3.32Å; H713-M723 PolarHBondContact O-N 2.93Å; H713-V725 HydrophobicContact CB-CG1 4.05Å; H713-V725 HydrophobicContact CB-CG2 4.43Å
714	E	74.5	Confident	73.6	Confident	39 Å²	39	71.4 Å²	71.4	18%	0.182	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	117.3	179.6	-74.3	172.2	161	0	0	110.3	L642 R687 T722	L642-E714 HydrophobicContact CD1-CB 3.83Å; R687-E714 IonicContact CZ-OE1 2.72Å; R687-E714 IonicContact CZ-OE2 2.89Å; R687-E714 IonicContact NH1-OE1 2.95Å; R687-E714 PolarHBondContact NH1-OE1 3.24Å; R687-E714 IonicContact NH1-OE2 3.48Å; R687-E714 PolarHBondContact NH1-OE2 3.5Å; R687-E714 IonicContact NH2-OE1 2.69Å; R687-E714 PolarHBondContact NH2-OE1 3.34Å; R687-E714 IonicContact NH2-OE2 2.64Å; E714-T722 HydrophobicContact CG-CG2 3.75Å
715	V	67.3	Low	73.7	Confident	73 Å²	73	68.7 Å²	68.7	44%	0.442	38%	0.379	S	S	.	.			trans	-106.3	-20.9	-170.2	-169.2	0	0	0	0	112.4
716	T	63.4	Low	73.9	Confident	63 Å²	63	69.8 Å²	69.8	39%	0.387	39%	0.392	S	S	.	.	S	Bend	trans	-135	143.7	179.6	66.8	0	0	0	0	112.6	G718 N721	T716-G718 PolarHBondContact O-N 2.97Å; T716-N721 VanDerWaalsContact OG1-CB 3.27Å; T716-N721 WeakPolarHBondContact OG1-CB 3.14Å; T716-N721 PolarHBondContact OG1-ND2 2.96Å
717	R	58	Low	74	Confident	157 Å²	157	70.8 Å²	70.8	59%	0.592	40%	0.395	S	S	*	.	S	Bend	trans	-62.3	114.5	175.4	-161.8	-176.6	-154.6	-160.7	3	110.7	L642 G643	L642-R717 HydrophobicContact CB-CB 4.38Å; L642-R717 WeakPolarHBondContact O-CB 3.37Å; L642-R717 WeakPolarHBondContact O-CD 3.13Å; L642-R717 VanDerWaalsContact O-CG 3.23Å; L642-R717 WeakPolarHBondContact O-CG 3.44Å; L642-R717 PolarHBondContact O-NE 2.93Å; G643-R717 VanDerWaalsContact C-NH2 3.27Å; G643-R717 PolarHBondContact O-NE 3Å; G643-R717 PolarHBondContact O-NH2 2.87Å
718	G	56.3	Low	74	Confident	63 Å²	63	73.2 Å²	73.2	65%	0.649	42%	0.419	S	S	*	.	S	Bend	trans	141.6	12	176.5	0	0	0	0	0	118.2	T716 D720	T716-G718 PolarHBondContact O-N 2.97Å; G718-D720 PolarHBondContact O-N 2.97Å
719	G	54.6	Low	74	Confident	49 Å²	49	72.1 Å²	72.1	51%	0.505	42%	0.415	S	S	.	.	S	Bend	trans	78	-50.9	170.4	0	0	0	0	0	116.1	N721	G719-N721 VanDerWaalsContact C-N 3.25Å; G719-N721 PolarHBondContact O-N 3.4Å; G719-N721 VanDerWaalsContact O-N 3.14Å
720	D	54.3	Low	74	Confident	154 Å²	154	71 Å²	71	82%	0.824	41%	0.409	S	S	*	.	S	Bend	trans	-72.9	-10	-166	-61.5	-26.6	0	0	0	115.1	G718	G718-D720 PolarHBondContact O-N 2.97Å
721	N	59.5	Low	73.8	Confident	102 Å²	102	72.1 Å²	72.1	55%	0.545	42%	0.422	S	S	.	.			trans	-111.3	67.1	-176.5	-67.3	-34.9	0	0	0	111.9	T716 G719	T716-N721 VanDerWaalsContact OG1-CB 3.27Å; T716-N721 WeakPolarHBondContact OG1-CB 3.14Å; T716-N721 PolarHBondContact OG1-ND2 2.96Å; G719-N721 VanDerWaalsContact C-N 3.25Å; G719-N721 PolarHBondContact O-N 3.4Å; G719-N721 VanDerWaalsContact O-N 3.14Å
722	T	70.9	Confident	73.6	Confident	72 Å²	72	77.6 Å²	77.6	44%	0.442	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.9	167.6	49.1	0	0	0	0	110.5	I712 E714	I712-T722 HydrophobicContact CD1-CG2 3.99Å; E714-T722 HydrophobicContact CG-CG2 3.75Å
723	M	74.7	Confident	73.3	Confident	118 Å²	118	82.7 Å²	82.7	58%	0.581	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	127.3	172.6	-173.4	176	-68.4	0	0	109.6	I712 H713 V725	I712-M723 CarbonylContact C-O 3.5Å; I712-M723 VanDerWaalsContact CA-O 3.31Å; I712-M723 WeakPolarHBondContact CA-O 3.05Å; H713-M723 PolarHBondContact N-O 3.32Å; H713-M723 PolarHBondContact O-N 2.93Å; M723-V725 HydrophobicContact CG-CG1 4.27Å
724	V	81.9	Confident	73.3	Confident	92 Å²	92	83.2 Å²	83.2	56%	0.558	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.1	170.5	-177.7	0	0	0	0	108.7	Q710 C711 I712	Q710-V724 HydrophobicContact CB-CG1 4.46Å; C711-V724 WeakPolarHBondContact O-CA 3.14Å; I712-V724 HydrophobicContact CG2-CG2 4.36Å
725	V	83.1	Confident	73.7	Confident	18 Å²	18	82.9 Å²	82.9	11%	0.109	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158.2	-176.1	-59.2	0	0	0	0	110.9	P686 C711 H713 M723 N727 M729	P686-V725 HydrophobicContact CB-CG2 4.36Å; C711-V725 HydrophobicContact CB-CG2 4.17Å; C711-V725 WeakPolarHBondContact CB-O 3.41Å; C711-V725 PolarHBondContact O-N 3.25Å; C711-V725 WeakPolarHBondContact SG-CG2 3.43Å; H713-V725 HydrophobicContact CB-CG1 4.05Å; H713-V725 HydrophobicContact CB-CG2 4.43Å; M723-V725 HydrophobicContact CG-CG1 4.27Å; V725-N727 PolarHBondContact O-N 2.65Å; V725-M729 HydrophobicContact CB-CE 3.89Å; V725-M729 HydrophobicContact CG2-CB 4.3Å; V725-M729 HydrophobicContact CG2-CE 4.4Å
726	P	84.5	Confident	74.3	Confident	82 Å²	82	82 Å²	82	53%	0.532	49%	0.49	S	S	.	.			trans	-47.9	135	174.3	-33.4	34.1	0	0	0	115.1	S728 M729	P726-S728 PolarHBondContact O-N 3.42Å; P726-M729 HydrophobicContact CB-CE 4Å; P726-M729 HydrophobicContact CG-CE 3.88Å; P726-M729 PolarHBondContact O-N 2.9Å
727	N	82.2	Confident	75.2	Confident	80 Å²	80	82.2 Å²	82.2	43%	0.428	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-48.8	-28.8	-178.5	-80.3	21.3	0	0	0	115.3	W688 V725 M729 C730 Q732	W688-N727 HydrophobicContact CH2-CB 3.69Å; W688-N727 WeakPolarHBondContact CH2-O 2.82Å; W688-N727 HydrophobicContact CZ3-CB 4.2Å; V725-N727 PolarHBondContact O-N 2.65Å; N727-M729 VanDerWaalsContact C-N 3.27Å; N727-M729 PolarHBondContact O-N 2.04Å; N727-C730 PolarHBondContact O-N 2.58Å; N727-Q732 PolarHBondContact O-NE2 3.36Å
728	S	81.8	Confident	76.4	Confident	96 Å²	96	82.1 Å²	82.1	67%	0.671	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-69.9	-15.6	179	50.4	0	0	0	0	114.8	P726 C730	P726-S728 PolarHBondContact O-N 3.42Å; S728-C730 VanDerWaalsContact C-N 3.35Å
729	M	79.5	Confident	77.6	Confident	104 Å²	104	83.6 Å²	83.6	51%	0.512	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-84.9	-7.4	175	-78.4	-176.6	-86.5	0	0	113.6	P686 V725 P726 N727	P686-M729 HydrophobicContact CB-CB 4.44Å; P686-M729 HydrophobicContact CG-CB 4.31Å; V725-M729 HydrophobicContact CB-CE 3.89Å; V725-M729 HydrophobicContact CG2-CB 4.3Å; V725-M729 HydrophobicContact CG2-CE 4.4Å; P726-M729 HydrophobicContact CB-CE 4Å; P726-M729 HydrophobicContact CG-CE 3.88Å; P726-M729 PolarHBondContact O-N 2.9Å; N727-M729 VanDerWaalsContact C-N 3.27Å; N727-M729 PolarHBondContact O-N 2.04Å
730	C	86.4	Confident	78.8	Confident	7 Å²	7	89.4 Å²	89.4	5%	0.047	49%	0.486	C	S	.	.	S	Bend	trans	-98	159.9	171.9	-76.7	0	0	0	0	111.7	R687 W688 C711 N727 S728 Q732	R687-C730 PolarHBondContact O-SG 3.46Å; W688-C730 HydrophobicContact CD2-CB 3.74Å; W688-C730 HydrophobicContact CE3-CB 4.24Å; W688-C730 HydrophobicContact CG-CB 4.2Å; W688-C730 HydrophobicContact CH2-CB 4.14Å; W688-C730 HydrophobicContact CZ2-CB 3.61Å; W688-C730 HydrophobicContact CZ3-CB 4.43Å; C711-C730 WeakPolarHBondContact CA-SG 3.49Å; C711-C730 HydrophobicContact CB-CB 3.87Å; C711-C730 WeakPolarHBondContact CB-SG 3.2Å; C711-C730 WeakPolarHBondContact SG-CB 3.46Å; C711-C730 PolarHBondContact SG-N 3.08Å; C711-C730 VanDerWaalsContact SG-N 3.36Å; C711-C730 CovalentContact SG-SG 2.02Å; C711-C730 PolarHBondContact SG-SG 3.44Å; N727-C730 PolarHBondContact O-N 2.58Å; S728-C730 VanDerWaalsContact C-N 3.35Å; C730-Q732 PolarHBondContact O-N 3.19Å; C730-Q732 PolarHBondContact O-NE2 2.93Å
731	P	83	Confident	79.9	Confident	90 Å²	90	82.9 Å²	82.9	58%	0.584	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-57.8	133	176.6	-24.4	34.7	0	0	0	112.3	W688	W688-P731 PolarHBondContact NE1-O 2.76Å
732	Q	82	Confident	80.6	Confident	115 Å²	115	81.1 Å²	81.1	54%	0.537	44%	0.443	S	S	.	.	S	Bend	trans	-94.4	151.6	179.1	-58	-56.3	-63	0	0	111.4	N727 C730	N727-Q732 PolarHBondContact O-NE2 3.36Å; C730-Q732 PolarHBondContact O-N 3.19Å; C730-Q732 PolarHBondContact O-NE2 2.93Å
733	P	79.9	Confident	80.9	Confident	113 Å²	113	81.6 Å²	81.6	73%	0.734	45%	0.446	S	S	*	.	S	Bend	cis	-74.5	162.4	-3.2	32.6	-36.6	0	0	0	113.1
734	P	80.6	Confident	81	Confident	61 Å²	61	80.8 Å²	80.8	40%	0.396	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-63.1	146.7	171.9	28.3	-35.6	0	0	0	111.3	W688 A736	W688-P734 HydrophobicContact CH2-CB 3.69Å; W688-P734 HydrophobicContact CZ2-CB 3.68Å; W688-P734 HydrophobicContact CZ3-CB 4.37Å; P734-A736 PolarHBondContact O-N 2.92Å
735	P	84.9	Confident	80.9	Confident	31 Å²	31	80.2 Å²	80.2	20%	0.201	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-52.8	134.7	168.4	-24.9	32.5	0	0	0	111.1	W688 Y690 V709 D737	W688-P735 HydrophobicContact CB-CG 4.01Å; W688-P735 HydrophobicContact CD2-CG 4.23Å; W688-P735 HydrophobicContact CG-CG 3.78Å; Y690-P735 HydrophobicContact CD1-CB 4.39Å; Y690-P735 HydrophobicContact CD1-CG 4.04Å; Y690-P735 HydrophobicContact CE1-CG 4.45Å; V709-P735 HydrophobicContact CG1-CB 4.14Å; V709-P735 HydrophobicContact CG1-CG 4.11Å; V709-P735 HydrophobicContact CG2-CB 4.42Å; P735-D737 PolarHBondContact O-N 2.85Å
736	A	79.8	Confident	80.9	Confident	55 Å²	55	79.8 Å²	79.8	46%	0.455	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-58.8	129.8	-178.5	0	0	0	0	0	111.5	Y693 R707 P734 R738	Y693-A736 PolarHBondContact OH-O 2.93Å; R707-A736 PolarHBondContact NE-O 3.47Å; R707-A736 PolarHBondContact NH2-O 3.5Å; R707-A736 VanDerWaalsContact NH2-O 3.08Å; P734-A736 PolarHBondContact O-N 2.92Å; A736-R738 VanDerWaalsContact C-N 3.32Å
737	D	80.7	Confident	80.9	Confident	68 Å²	68	80.5 Å²	80.5	36%	0.364	44%	0.439	S	S	.	.	S	Bend	trans	-80	-14.1	-178.4	74.9	-42.6	0	0	0	113.1	T706 R707 P735	T706-D737 CarbonylContact C-O 3.55Å; T706-D737 WeakPolarHBondContact CA-O 3.42Å; R707-D737 PolarHBondContact N-O 3.2Å; P735-D737 PolarHBondContact O-N 2.85Å
738	R	82.9	Confident	80.9	Confident	155 Å²	155	78.6 Å²	78.6	59%	0.585	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	146.4	-175.1	65.9	-164.8	63.6	-142.6	-7	112.4	I704 K705 T706 A736	I704-R738 HydrophobicContact CG2-CB 4.37Å; K705-R738 CarbonylContact O-C 3.54Å; K705-R738 VanDerWaalsContact O-CA 3.31Å; K705-R738 WeakPolarHBondContact O-CA 3.46Å; T706-R738 HydrophobicContact CG2-CB 4Å; A736-R738 VanDerWaalsContact C-N 3.32Å
739	Q	81.5	Confident	81.1	Confident	93 Å²	93	80.6 Å²	80.6	44%	0.435	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	145.5	177.5	-163.2	-176.5	9.4	0	0	110.3	Y693 I704 K705	Y693-Q739 HydrophobicContact CE1-CB 4.05Å; I704-Q739 WeakPolarHBondContact CA-O 3.48Å; K705-Q739 HydrophobicContact CG-CB 4.07Å; K705-Q739 PolarHBondContact N-O 2.92Å; K705-Q739 PolarHBondContact O-N 2.87Å
740	Y	79.8	Confident	81.5	Confident	171 Å²	171	77.5 Å²	77.5	67%	0.671	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	148.9	168.1	-63.6	-69.8	0	0	0	111.1	I702 I704	I702-Y740 HydrophobicContact CG2-CD1 3.73Å; I702-Y740 HydrophobicContact CG2-CE1 4.34Å; I704-Y740 HydrophobicContact CD1-CE1 4.33Å; I704-Y740 HydrophobicContact CG1-CD1 4.03Å; I704-Y740 HydrophobicContact CG1-CE1 4.18Å
741	C	77.4	Confident	81.4	Confident	18 Å²	18	80.4 Å²	80.4	12%	0.122	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	163.7	-179.6	49.2	0	0	0	0	110.3	C696 G703 K705 V743	C696-C741 VanDerWaalsContact CA-SG 3.55Å; C696-C741 HydrophobicContact CB-CB 3.92Å; C696-C741 WeakPolarHBondContact CB-SG 3.32Å; C696-C741 WeakPolarHBondContact SG-CB 3.44Å; C696-C741 CovalentContact SG-SG 2.02Å; C696-C741 PolarHBondContact SG-SG 3.2Å; G703-C741 CarbonylContact C-O 3.55Å; G703-C741 VanDerWaalsContact C-SG 3.59Å; G703-C741 WeakPolarHBondContact CA-O 3.38Å; G703-C741 PolarHBondContact N-O 2.82Å; G703-C741 PolarHBondContact O-N 3.17Å; K705-C741 HydrophobicContact CD-CB 4.21Å; K705-C741 HydrophobicContact CG-CB 4.28Å; K705-C741 PolarHBondContact N-SG 2.96Å; K705-C741 VanDerWaalsContact N-SG 3.37Å; C741-V743 VanDerWaalsContact C-N 3.27Å; C741-V743 PolarHBondContact O-N 2.85Å
742	N	75.8	Confident	81.7	Confident	64 Å²	64	79.3 Å²	79.3	34%	0.342	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.5	44.9	177.8	-59	-7	0	0	0	113.7	C696 K698 G701 L744	C696-N742 WeakPolarHBondContact CB-ND2 3.46Å; K698-N742 WeakPolarHBondContact O-CB 3.39Å; K698-N742 PolarHBondContact O-ND2 2.97Å; G701-N742 CarbonylContact C-O 3.59Å; G701-N742 VanDerWaalsContact O-O 3.09Å; N742-L744 PolarHBondContact O-N 2.91Å
743	V	76.8	Confident	81.8	Confident	83 Å²	83	75.3 Å²	75.3	50%	0.503	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	74.6	174.2	-175.5	0	0	0	0	108.4	G701 I702 C741 A778	G701-V743 WeakPolarHBondContact O-CA 3.44Å; I702-V743 HydrophobicContact CG2-CG2 4.37Å; C741-V743 VanDerWaalsContact C-N 3.27Å; C741-V743 PolarHBondContact O-N 2.85Å; V743-A778 HydrophobicContact CG1-CB 4.09Å
744	L	77.1	Confident	82.2	Confident	101 Å²	101	78.7 Å²	78.7	53%	0.529	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.6	-166.2	-65.3	173.4	0	0	0	110.6	G701 N742 C746	G701-L744 WeakPolarHBondContact CA-O 3.28Å; G701-L744 PolarHBondContact N-O 2.61Å; G701-L744 PolarHBondContact O-N 3Å; N742-L744 PolarHBondContact O-N 2.91Å; L744-C746 PolarHBondContact O-N 2.03Å
745	D	79.6	Confident	82.5	Confident	80 Å²	80	79.4 Å²	79.4	43%	0.428	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-65.1	125.8	172.1	-69.2	-16.6	0	0	0	110.1	M777 A778	D745-M777 VanDerWaalsContact CG-CE 3.46Å; D745-M777 WeakPolarHBondContact OD1-CA 3.49Å; D745-M777 WeakPolarHBondContact OD1-CE 3.38Å; D745-M777 WeakPolarHBondContact OD2-CE 3.24Å; D745-A778 PolarHBondContact OD1-N 3.36Å
746	C	83.6	Confident	82.7	Confident	8 Å²	8	80.6 Å²	80.6	5%	0.054	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-65.3	151.4	172.1	-69.4	0	0	0	0	111.4	C700 L744 Q775 I776	C700-C746 VanDerWaalsContact C-SG 3.52Å; C700-C746 HydrophobicContact CB-CB 3.87Å; C700-C746 WeakPolarHBondContact CB-SG 3.06Å; C700-C746 WeakPolarHBondContact SG-CA 3.03Å; C700-C746 WeakPolarHBondContact SG-CB 3.34Å; C700-C746 CovalentContact SG-SG 2.04Å; C700-C746 PolarHBondContact SG-SG 3.2Å; L744-C746 PolarHBondContact O-N 2.03Å; C746-Q775 WeakPolarHBondContact O-CG 3.46Å; C746-Q775 PolarHBondContact O-NE2 2.88Å; C746-I776 HydrophobicContact CB-CB 3.98Å; C746-I776 WeakPolarHBondContact CB-O 3.34Å; C746-I776 PolarHBondContact N-O 3.15Å
747	P	83.3	Confident	82.9	Confident	97 Å²	97	87.5 Å²	87.5	63%	0.63	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-62.7	150.4	171.8	26.5	-34.5	0	0	0	112.1	R749	P747-R749 PolarHBondContact O-N 3.01Å
748	V	83.5	Confident	83.3	Confident	40 Å²	40	85.8 Å²	85.8	24%	0.242	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-63.2	124.4	175.3	-82.9	0	0	0	0	111.3	Q775 R785 M789	V748-Q775 HydrophobicContact CG1-CB 3.92Å; V748-Q775 HydrophobicContact CG1-CG 3.94Å; V748-R785 HydrophobicContact CG1-CB 4.24Å; V748-R785 HydrophobicContact CG1-CG 3.8Å; V748-M789 HydrophobicContact CG2-CB 4.36Å; V748-M789 WeakPolarHBondContact CG2-O 3.21Å
749	R	84.3	Confident	83.4	Confident	138 Å²	138	81.6 Å²	81.6	52%	0.521	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	156	-173.5	65.5	-178	-170.2	162.3	2.3	113	P747 E751 K774 C790	P747-R749 PolarHBondContact O-N 3.01Å; R749-E751 PolarHBondContact O-N 2.89Å; R749-K774 PolarHBondContact N-O 3.02Å; R749-K774 PolarHBondContact O-N 3.29Å; R749-C790 PolarHBondContact N-SG 3.34Å
750	W	88.2	Confident	83.4	Confident	40 Å²	40	82.2 Å²	82.2	15%	0.152	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	106	175.2	-66	110	0	0	0	111.3	V771 E772 C773 E787 C790 P791 K794 P795	W750-V771 HydrophobicContact CD2-CG1 4.3Å; W750-V771 HydrophobicContact CE3-CG1 3.72Å; W750-V771 HydrophobicContact CZ3-CG1 4.27Å; W750-E772 CarbonylContact C-O 3.53Å; W750-E772 WeakPolarHBondContact CA-O 3.33Å; W750-C773 HydrophobicContact CE3-CB 4.33Å; W750-C773 HydrophobicContact CZ3-CB 4.21Å; W750-E787 HydrophobicContact CH2-CB 3.77Å; W750-E787 HydrophobicContact CH2-CG 3.77Å; W750-E787 HydrophobicContact CZ3-CB 4.45Å; W750-E787 HydrophobicContact CZ3-CG 4.01Å; W750-C790 HydrophobicContact CD2-CB 3.85Å; W750-C790 VanDerWaalsContact CE2-CB 3.46Å; W750-C790 HydrophobicContact CE3-CB 4.44Å; W750-C790 HydrophobicContact CG-CB 4.23Å; W750-C790 HydrophobicContact CH2-CB 4.4Å; W750-C790 HydrophobicContact CZ2-CB 3.78Å; W750-P791 PolarHBondContact NE1-O 2.93Å; W750-K794 HydrophobicContact CD2-CG 4.35Å; W750-K794 HydrophobicContact CE3-CG 4.31Å; W750-K794 HydrophobicContact CH2-CB 4.13Å; W750-K794 HydrophobicContact CH2-CD 3.67Å; W750-K794 HydrophobicContact CH2-CG 3.64Å; W750-K794 HydrophobicContact CZ2-CB 3.69Å; W750-K794 HydrophobicContact CZ2-CD 4.14Å; W750-K794 HydrophobicContact CZ2-CG 3.7Å; W750-K794 HydrophobicContact CZ3-CD 4.1Å; W750-K794 HydrophobicContact CZ3-CG 3.97Å; W750-P795 HydrophobicContact CB-CG 3.72Å; W750-P795 VanDerWaalsContact CD1-CD 3.45Å; W750-P795 HydrophobicContact CG-CG 3.97Å
751	E	85.4	Confident	83.3	Confident	67 Å²	67	80.3 Å²	80.3	31%	0.313	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121	167.1	-175.2	150.3	-138.8	0	0	109	R749 E772 K774 K782	R749-E751 PolarHBondContact O-N 2.89Å; E751-E772 PolarHBondContact N-O 2.87Å; E751-E772 PolarHBondContact O-N 2.82Å; E751-K774 HydrophobicContact CB-CB 4.2Å; E751-K774 HydrophobicContact CB-CD 4.02Å; E751-K774 HydrophobicContact CB-CG 4.46Å; E751-K774 HydrophobicContact CG-CD 4.43Å; E751-K774 VanDerWaalsContact OE2-CD 3.24Å; E751-K774 WeakPolarHBondContact OE2-CD 3.42Å; E751-K782 IonicContact OE1-NZ 2.75Å; E751-K782 PolarHBondContact OE1-NZ 3.13Å; E751-K782 IonicContact OE2-NZ 2.63Å; E751-K782 PolarHBondContact OE2-NZ 2.04Å
752	V	87.7	Confident	83.3	Confident	67 Å²	67	81.4 Å²	81.4	41%	0.406	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.3	-176.2	-70.4	0	0	0	0	110.5	V771 P795	V752-V771 HydrophobicContact CG1-CG1 4.15Å; V752-V771 HydrophobicContact CG1-CG2 4.26Å; V752-P795 HydrophobicContact CG1-CB 3.77Å; V752-P795 HydrophobicContact CG1-CG 3.97Å
753	G	84.1	Confident	83	Confident	31 Å²	31	80.1 Å²	80.1	32%	0.32	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	172.4	175.3	0	0	0	0	0	113.1	K770	G753-K770 PolarHBondContact N-O 2.89Å
754	E	89.1	Confident	83.3	Confident	184 Å²	184	82 Å²	82	86%	0.86	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	154	173.8	-67.1	-149.4	124.3	0	0	112.7	R769	E754-R769 WeakPolarHBondContact O-CB 3.42Å
755	W	86.8	Confident	83.7	Confident	77 Å²	77	77.1 Å²	77.1	29%	0.292	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131.1	173.1	-66.6	97.5	0	0	0	111.5	K767 R769 A796 D797 K799	W755-K767 HydrophobicContact CB-CD 3.85Å; W755-K767 HydrophobicContact CB-CG 4.46Å; W755-K767 VanDerWaalsContact CB-NZ 3.33Å; W755-K767 HydrophobicContact CD2-CD 4.13Å; W755-K767 VanDerWaalsContact CD2-CE 3.46Å; W755-K767 HydrophobicContact CD2-CG 4.26Å; W755-K767 HydrophobicContact CE3-CB 4.35Å; W755-K767 HydrophobicContact CE3-CD 4.14Å; W755-K767 HydrophobicContact CE3-CG 3.75Å; W755-K767 HydrophobicContact CG-CD 4.06Å; W755-K767 HydrophobicContact CZ3-CG 4.38Å; W755-K767 VanDerWaalsContact CZ3-O 3.32Å; W755-K767 WeakPolarHBondContact CZ3-O 3.31Å; W755-R769 HydrophobicContact CD2-CB 4.16Å; W755-R769 HydrophobicContact CD2-CG 4.12Å; W755-R769 HydrophobicContact CE3-CB 3.92Å; W755-R769 HydrophobicContact CE3-CG 3.81Å; W755-R769 HydrophobicContact CH2-CG 3.98Å; W755-R769 HydrophobicContact CZ2-CG 4.28Å; W755-R769 VanDerWaalsContact CZ2-NE 3.29Å; W755-R769 HydrophobicContact CZ3-CB 4.32Å; W755-R769 HydrophobicContact CZ3-CG 3.73Å; W755-A796 WeakPolarHBondContact CH2-O 3.38Å; W755-D797 WeakPolarHBondContact CZ3-O 3.41Å; W755-K799 HydrophobicContact CE3-CB 4.37Å; W755-K799 HydrophobicContact CH2-CB 3.47Å; W755-K799 VanDerWaalsContact CH2-CB 3.47Å; W755-K799 HydrophobicContact CH2-CD 4.46Å; W755-K799 HydrophobicContact CZ2-CB 4.12Å; W755-K799 HydrophobicContact CZ2-CD 4.29Å; W755-K799 HydrophobicContact CZ3-CB 3.62Å
756	S	88.4	Confident	83.9	Confident	55 Å²	55	77.9 Å²	77.9	39%	0.385	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-59.9	163.6	171.7	72.4	0	0	0	0	112.8	C758 K767 D768	S756-C758 PolarHBondContact O-N 3.07Å; S756-K767 WeakPolarHBondContact O-CB 3.02Å; S756-D768 WeakPolarHBondContact CB-O 3.4Å; S756-D768 PolarHBondContact N-O 3.25Å; S756-D768 PolarHBondContact OG-N 3.11Å; S756-D768 PolarHBondContact OG-O 2.87Å; S756-D768 VanDerWaalsContact OG-O 3.12Å
757	K	85.9	Confident	84.1	Confident	201 Å²	201	80 Å²	80	87%	0.874	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-63.1	130.8	172.1	-66.2	168.8	-175.8	165.5	0	108.8	S759	K757-S759 PolarHBondContact O-N 2.9Å
758	C	87.7	Confident	84.4	Confident	32 Å²	32	78.2 Å²	78.2	22%	0.216	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-54	130.2	-179.2	-169	0	0	0	0	111.7	S756 H760 F766 C801 N802	S756-C758 PolarHBondContact O-N 3.07Å; C758-H760 PolarHBondContact O-N 2.92Å; C758-H760 VanDerWaalsContact O-N 3.08Å; C758-H760 PolarHBondContact SG-O 3.31Å; C758-F766 CarbonylContact C-O 3.47Å; C758-F766 WeakPolarHBondContact CA-O 3.38Å; C758-C801 VanDerWaalsContact CA-SG 3.57Å; C758-C801 HydrophobicContact CB-CB 3.94Å; C758-C801 WeakPolarHBondContact CB-SG 3.46Å; C758-C801 WeakPolarHBondContact SG-CB 3.01Å; C758-C801 CovalentContact SG-SG 2.03Å; C758-C801 PolarHBondContact SG-SG 3.08Å; C758-N802 PolarHBondContact SG-ND2 2.9Å; C758-N802 VanDerWaalsContact SG-ND2 3.38Å
759	S	86.5	Confident	84.6	Confident	66 Å²	66	78.8 Å²	78.8	46%	0.462	40%	0.4	S	S	.	.	S	Bend	trans	-55.1	-31.1	-174	68.3	0	0	0	0	113.8	K757 G765 F766	K757-S759 PolarHBondContact O-N 2.9Å; S759-G765 WeakPolarHBondContact OG-CA 3.26Å; S759-F766 PolarHBondContact N-O 2.82Å; S759-F766 PolarHBondContact OG-N 3.02Å
760	H	79.6	Confident	84.7	Confident	107 Å²	107	78.4 Å²	78.4	50%	0.495	40%	0.402	S	S	.	.			trans	-131.7	137.5	177.4	-55.3	-40	0	0	0	110.3	C758 C762 Y764 N802	C758-H760 PolarHBondContact O-N 2.92Å; C758-H760 VanDerWaalsContact O-N 3.08Å; C758-H760 PolarHBondContact SG-O 3.31Å; H760-C762 VanDerWaalsContact C-N 3.26Å; H760-C762 WeakPolarHBondContact CB-O 3.05Å; H760-C762 PolarHBondContact O-N 2.87Å; H760-Y764 PolarHBondContact CD2-O 2.78Å; H760-N802 WeakPolarHBondContact O-CB 3.39Å; H760-N802 PolarHBondContact O-ND2 3.19Å
761	T	78.8	Confident	84.8	Confident	131 Å²	131	77.1 Å²	77.1	80%	0.804	40%	0.398	S	S	*	.	S	Bend	trans	-74.9	-13.7	-179.1	49.5	0	0	0	0	113.9
762	C	77.9	Confident	84.9	Confident	40 Å²	40	75.8 Å²	75.8	27%	0.27	39%	0.392	S	S	.	.	S	Bend	trans	-159.1	169.3	172.3	60.8	0	0	0	0	108.9	H760 C806	H760-C762 VanDerWaalsContact C-N 3.26Å; H760-C762 WeakPolarHBondContact CB-O 3.05Å; H760-C762 PolarHBondContact O-N 2.87Å; C762-C806 HydrophobicContact CB-CB 3.91Å; C762-C806 WeakPolarHBondContact CB-SG 3.34Å; C762-C806 PolarHBondContact O-SG 2.97Å; C762-C806 VanDerWaalsContact SG-CA 3.56Å; C762-C806 WeakPolarHBondContact SG-CB 3.36Å; C762-C806 CovalentContact SG-SG 2.05Å; C762-C806 PolarHBondContact SG-SG 3.43Å
763	G	69.5	Low	84.9	Confident	37 Å²	37	72.8 Å²	72.8	38%	0.381	37%	0.374	S	S	.	.	S	Bend	trans	77.6	36.1	168.1	0	0	0	0	0	115	N802 K804 C806	G763-N802 PolarHBondContact N-O 2.74Å; G763-K804 PolarHBondContact N-O 2.03Å; G763-C806 PolarHBondContact N-SG 3.33Å
764	Y	82.4	Confident	85	Confident	122 Å²	122	72.7 Å²	72.7	48%	0.478	37%	0.365	S	S	.	.	S	Bend	trans	68.6	91.4	178.5	-153.8	-63.7	0	0	0	113.3	H760 F766 P800 N802 V803	H760-Y764 PolarHBondContact CD2-O 2.78Å; Y764-F766 HydrophobicContact CD1-CE2 4.31Å; Y764-F766 HydrophobicContact CD1-CZ 4.34Å; Y764-F766 HydrophobicContact CE1-CE1 4.02Å; Y764-F766 HydrophobicContact CE1-CE2 4.06Å; Y764-F766 AromaticContact CE1-CZ 3.64Å; Y764-F766 HydrophobicContact CE1-CZ 3.64Å; Y764-P800 HydrophobicContact CE1-CB 3.87Å; Y764-N802 PolarHBondContact N-O 3.49Å; Y764-V803 HydrophobicContact CD2-CB 4.14Å; Y764-V803 HydrophobicContact CD2-CG1 3.82Å; Y764-V803 HydrophobicContact CE2-CB 4.49Å; Y764-V803 HydrophobicContact CE2-CG1 3.88Å; Y764-V803 HydrophobicContact CG-CG1 4.24Å
765	G	85.1	Confident	84.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	176.9	168.7	0	0	0	0	0	112.2	S759 P800 C801	S759-G765 WeakPolarHBondContact OG-CA 3.26Å; G765-P800 WeakPolarHBondContact O-CA 3.33Å; G765-C801 CarbonylContact C-O 3.42Å; G765-C801 PolarHBondContact N-O 3.47Å; G765-C801 PolarHBondContact O-N 2.81Å
766	F	84.6	Confident	84.7	Confident	95 Å²	95	63.2 Å²	63.2	42%	0.417	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	153.3	171.2	-64.6	-89.1	0	0	0	110.1	C758 S759 Y764 C801	C758-F766 CarbonylContact C-O 3.47Å; C758-F766 WeakPolarHBondContact CA-O 3.38Å; S759-F766 PolarHBondContact N-O 2.82Å; S759-F766 PolarHBondContact OG-N 3.02Å; Y764-F766 HydrophobicContact CD1-CE2 4.31Å; Y764-F766 HydrophobicContact CD1-CZ 4.34Å; Y764-F766 HydrophobicContact CE1-CE1 4.02Å; Y764-F766 HydrophobicContact CE1-CE2 4.06Å; Y764-F766 AromaticContact CE1-CZ 3.64Å; Y764-F766 HydrophobicContact CE1-CZ 3.64Å; F766-C801 PolarHBondContact O-SG 3.38Å
767	K	87.1	Confident	84.3	Confident	52 Å²	52	62.4 Å²	62.4	23%	0.226	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.7	164.4	58.2	177.3	-155.3	150.4	0	108.4	W755 S756 K798 K799 C801	W755-K767 HydrophobicContact CB-CD 3.85Å; W755-K767 HydrophobicContact CB-CG 4.46Å; W755-K767 VanDerWaalsContact CB-NZ 3.33Å; W755-K767 HydrophobicContact CD2-CD 4.13Å; W755-K767 VanDerWaalsContact CD2-CE 3.46Å; W755-K767 HydrophobicContact CD2-CG 4.26Å; W755-K767 HydrophobicContact CE3-CB 4.35Å; W755-K767 HydrophobicContact CE3-CD 4.14Å; W755-K767 HydrophobicContact CE3-CG 3.75Å; W755-K767 HydrophobicContact CG-CD 4.06Å; W755-K767 HydrophobicContact CZ3-CG 4.38Å; W755-K767 VanDerWaalsContact CZ3-O 3.32Å; W755-K767 WeakPolarHBondContact CZ3-O 3.31Å; S756-K767 WeakPolarHBondContact O-CB 3.02Å; K767-K798 CarbonylContact O-C 3.5Å; K767-K798 WeakPolarHBondContact O-CA 3.48Å; K767-K799 HydrophobicContact CG-CB 4.36Å; K767-K799 WeakPolarHBondContact CG-O 3.32Å; K767-K799 PolarHBondContact N-O 3.08Å; K767-K799 PolarHBondContact O-N 3.38Å; K767-C801 HydrophobicContact CD-CB 4.31Å; K767-C801 HydrophobicContact CG-CB 4.22Å; K767-C801 PolarHBondContact N-SG 2.89Å; K767-C801 VanDerWaalsContact N-SG 3.41Å
768	D	89.4	Confident	83.6	Confident	60 Å²	60	53.8 Å²	53.8	32%	0.321	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	155.3	-174.8	-57.6	-103.1	0	0	0	108.8	S756 D797 K798	S756-D768 WeakPolarHBondContact CB-O 3.4Å; S756-D768 PolarHBondContact N-O 3.25Å; S756-D768 PolarHBondContact OG-N 3.11Å; S756-D768 PolarHBondContact OG-O 2.87Å; S756-D768 VanDerWaalsContact OG-O 3.12Å; D768-D797 CarbonylContact C-O 3.59Å; D768-D797 VanDerWaalsContact CA-O 3.26Å; D768-D797 WeakPolarHBondContact CA-O 3.37Å; D768-K798 WeakPolarHBondContact OD1-CD 3.07Å; D768-K798 IonicContact OD1-NZ 3.44Å; D768-K798 PolarHBondContact OD1-NZ 3.29Å
769	R	88	Confident	82.8	Confident	53 Å²	53	59.3 Å²	59.3	20%	0.2	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	154.8	170.9	60.2	171.8	172.8	173.8	1	110.8	E754 W755 V771 A796 D797	E754-R769 WeakPolarHBondContact O-CB 3.42Å; W755-R769 HydrophobicContact CD2-CB 4.16Å; W755-R769 HydrophobicContact CD2-CG 4.12Å; W755-R769 HydrophobicContact CE3-CB 3.92Å; W755-R769 HydrophobicContact CE3-CG 3.81Å; W755-R769 HydrophobicContact CH2-CG 3.98Å; W755-R769 HydrophobicContact CZ2-CG 4.28Å; W755-R769 VanDerWaalsContact CZ2-NE 3.29Å; W755-R769 HydrophobicContact CZ3-CB 4.32Å; W755-R769 HydrophobicContact CZ3-CG 3.73Å; R769-V771 HydrophobicContact CG-CG2 3.87Å; R769-A796 VanDerWaalsContact CZ-O 3.28Å; R769-A796 PolarHBondContact NE-O 2.97Å; R769-A796 PolarHBondContact NH2-O 2.88Å; R769-D797 PolarHBondContact N-O 3.12Å
770	K	86.3	Confident	81.6	Confident	129 Å²	129	61.2 Å²	61.2	56%	0.561	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	137	166.8	-136.7	-178.2	-176.6	-140.9	0	108.5	G753 E772	G753-K770 PolarHBondContact N-O 2.89Å; K770-E772 VanDerWaalsContact CD-CD 3.46Å; K770-E772 HydrophobicContact CD-CG 4.16Å; K770-E772 WeakPolarHBondContact CD-OE1 3.49Å; K770-E772 WeakPolarHBondContact CD-OE2 3.43Å; K770-E772 VanDerWaalsContact CE-CD 3.41Å; K770-E772 WeakPolarHBondContact CE-OE1 3.4Å; K770-E772 HydrophobicContact CG-CG 3.92Å; K770-E772 IonicContact NZ-OE1 3.94Å; K770-E772 PolarHBondContact NZ-OE1 3.43Å; K770-E772 IonicContact NZ-OE2 2.78Å; K770-E772 PolarHBondContact NZ-OE2 3.13Å
771	V	90.4	Very high	81.2	Confident	14 Å²	14	62.2 Å²	62.2	9%	0.085	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	112	176.1	-179.1	0	0	0	0	106.8	W750 V752 R769 K794 P795 D797	W750-V771 HydrophobicContact CD2-CG1 4.3Å; W750-V771 HydrophobicContact CE3-CG1 3.72Å; W750-V771 HydrophobicContact CZ3-CG1 4.27Å; V752-V771 HydrophobicContact CG1-CG1 4.15Å; V752-V771 HydrophobicContact CG1-CG2 4.26Å; R769-V771 HydrophobicContact CG-CG2 3.87Å; V771-K794 HydrophobicContact CG1-CG 4.24Å; V771-P795 HydrophobicContact CG1-CB 4.24Å; V771-P795 HydrophobicContact CG1-CG 4.33Å; V771-D797 HydrophobicContact CG2-CB 4.18Å
772	E	87.1	Confident	81.3	Confident	38 Å²	38	61.6 Å²	61.6	18%	0.178	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.7	-164.6	-48.2	-162.8	106.4	0	0	110.7	W750 E751 K770 K774	W750-E772 CarbonylContact C-O 3.53Å; W750-E772 WeakPolarHBondContact CA-O 3.33Å; E751-E772 PolarHBondContact N-O 2.87Å; E751-E772 PolarHBondContact O-N 2.82Å; K770-E772 VanDerWaalsContact CD-CD 3.46Å; K770-E772 HydrophobicContact CD-CG 4.16Å; K770-E772 WeakPolarHBondContact CD-OE1 3.49Å; K770-E772 WeakPolarHBondContact CD-OE2 3.43Å; K770-E772 VanDerWaalsContact CE-CD 3.41Å; K770-E772 WeakPolarHBondContact CE-OE1 3.4Å; K770-E772 HydrophobicContact CG-CG 3.92Å; K770-E772 IonicContact NZ-OE1 3.94Å; K770-E772 PolarHBondContact NZ-OE1 3.43Å; K770-E772 IonicContact NZ-OE2 2.78Å; K770-E772 PolarHBondContact NZ-OE2 3.13Å; E772-K774 HydrophobicContact CB-CD 4.32Å; E772-K774 HydrophobicContact CB-CG 4.39Å; E772-K774 IonicContact OE2-NZ 2.65Å; E772-K774 PolarHBondContact OE2-NZ 3.33Å
773	C	87.9	Confident	81.6	Confident	4 Å²	4	62.5 Å²	62.5	3%	0.027	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	117.4	173.4	-175	0	0	0	0	109.3	W750 R785 C790	W750-C773 HydrophobicContact CE3-CB 4.33Å; W750-C773 HydrophobicContact CZ3-CB 4.21Å; C773-R785 WeakPolarHBondContact CB-O 3.46Å; C773-R785 PolarHBondContact O-N 3.06Å; C773-C790 WeakPolarHBondContact CA-SG 3.44Å; C773-C790 HydrophobicContact CB-CB 3.76Å; C773-C790 WeakPolarHBondContact CB-SG 3.28Å; C773-C790 WeakPolarHBondContact SG-CB 3.43Å; C773-C790 PolarHBondContact SG-N 2.77Å; C773-C790 VanDerWaalsContact SG-N 3.44Å; C773-C790 CovalentContact SG-SG 2.03Å; C773-C790 PolarHBondContact SG-SG 3.43Å
774	K	86.3	Confident	82.3	Confident	30 Å²	30	66.4 Å²	66.4	13%	0.13	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.9	-173.8	-78.1	178.7	169.8	169.6	0	111.7	R749 E751 E772 I783 E784	R749-K774 PolarHBondContact N-O 3.02Å; R749-K774 PolarHBondContact O-N 3.29Å; E751-K774 HydrophobicContact CB-CB 4.2Å; E751-K774 HydrophobicContact CB-CD 4.02Å; E751-K774 HydrophobicContact CB-CG 4.46Å; E751-K774 HydrophobicContact CG-CD 4.43Å; E751-K774 VanDerWaalsContact OE2-CD 3.24Å; E751-K774 WeakPolarHBondContact OE2-CD 3.42Å; E772-K774 HydrophobicContact CB-CD 4.32Å; E772-K774 HydrophobicContact CB-CG 4.39Å; E772-K774 IonicContact OE2-NZ 2.65Å; E772-K774 PolarHBondContact OE2-NZ 3.33Å; K774-I783 WeakPolarHBondContact CA-O 3.39Å; K774-E784 HydrophobicContact CD-CG 4.25Å; K774-E784 WeakPolarHBondContact CE-OE1 3.42Å; K774-E784 HydrophobicContact CG-CG 4Å; K774-E784 IonicContact NZ-OE1 3.39Å; K774-E784 PolarHBondContact NZ-OE1 3.15Å
775	Q	85.2	Confident	82.5	Confident	29 Å²	29	64.9 Å²	64.9	14%	0.136	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.5	172.5	-155	176.7	-1.9	0	0	109.2	C746 V748 M777 K782 I783 R785	C746-Q775 WeakPolarHBondContact O-CG 3.46Å; C746-Q775 PolarHBondContact O-NE2 2.88Å; V748-Q775 HydrophobicContact CG1-CB 3.92Å; V748-Q775 HydrophobicContact CG1-CG 3.94Å; Q775-M777 HydrophobicContact CG-SD 4.39Å; Q775-K782 CarbonylContact O-C 3.56Å; Q775-K782 WeakPolarHBondContact O-CA 3.42Å; Q775-I783 PolarHBondContact N-O 3.43Å; Q775-I783 PolarHBondContact O-N 3.19Å; Q775-R785 HydrophobicContact CB-CG 4.12Å; Q775-R785 VanDerWaalsContact OE1-CZ 3.28Å
776	I	83.9	Confident	82.4	Confident	33 Å²	33	68 Å²	68	17%	0.169	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.1	169.6	-59.1	166.7	0	0	0	106.3	C746 K782	C746-I776 HydrophobicContact CB-CB 3.98Å; C746-I776 WeakPolarHBondContact CB-O 3.34Å; C746-I776 PolarHBondContact N-O 3.15Å; I776-K782 HydrophobicContact CG1-CG 4.14Å
777	M	81.7	Confident	82.3	Confident	37 Å²	37	68.4 Å²	68.4	18%	0.182	32%	0.323	C	S	.	.			trans	-80.6	165.4	-179.5	-53.6	-57.3	-72.7	0	0	111.3	D745 Q775 Q779 E780 H781 I783	D745-M777 VanDerWaalsContact CG-CE 3.46Å; D745-M777 WeakPolarHBondContact OD1-CA 3.49Å; D745-M777 WeakPolarHBondContact OD1-CE 3.38Å; D745-M777 WeakPolarHBondContact OD2-CE 3.24Å; Q775-M777 HydrophobicContact CG-SD 4.39Å; M777-Q779 PolarHBondContact O-N 2.72Å; M777-E780 WeakPolarHBondContact O-CA 3.33Å; M777-E780 PolarHBondContact O-N 3.35Å; M777-H781 WeakPolarHBondContact CG-O 3.06Å; M777-H781 PolarHBondContact N-O 2.86Å; M777-I783 HydrophobicContact CE-CD1 4.21Å; M777-I783 HydrophobicContact CG-CD1 3.66Å; M777-I783 HydrophobicContact CG-CG1 3.91Å; M777-I783 HydrophobicContact SD-CD1 3.69Å; M777-I783 HydrophobicContact SD-CG1 4.22Å
778	A	70.8	Confident	82	Confident	20 Å²	20	71.2 Å²	71.2	17%	0.165	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-9.7	173.1	0	0	0	0	0	114.3	G701 I702 V743 D745	G701-A778 WeakPolarHBondContact O-CA 3.29Å; I702-A778 WeakPolarHBondContact CD1-O 3.43Å; I702-A778 WeakPolarHBondContact CG1-O 3.32Å; V743-A778 HydrophobicContact CG1-CB 4.09Å; D745-A778 PolarHBondContact OD1-N 3.36Å
779	Q	70.8	Confident	81.6	Confident	149 Å²	149	73.6 Å²	73.6	70%	0.696	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	19.4	175.7	-59.3	176	0.1	0	0	112.2	M777 H781	M777-Q779 PolarHBondContact O-N 2.72Å; Q779-H781 PolarHBondContact O-N 3.37Å; Q779-H781 PolarHBondContact O-ND1 2.99Å
780	E	61	Low	81.3	Confident	105 Å²	105	71.5 Å²	71.5	49%	0.491	35%	0.353	S	S	.	.	S	Bend	trans	59.8	-5.4	-172.9	-51.2	-149.7	122.9	0	0	116.8	K698 I702 M777	K698-E780 IonicContact NZ-OE1 2.68Å; K698-E780 PolarHBondContact NZ-OE1 2.68Å; I702-E780 HydrophobicContact CD1-CG 4.35Å; I702-E780 HydrophobicContact CG1-CG 4.36Å; M777-E780 WeakPolarHBondContact O-CA 3.33Å; M777-E780 PolarHBondContact O-N 3.35Å
781	H	71.4	Confident	81	Confident	128 Å²	128	69.2 Å²	69.2	59%	0.593	35%	0.351	S	S	*	.			trans	-64.1	136.4	177.5	-74.6	64.4	0	0	0	111.2	M777 Q779	M777-H781 WeakPolarHBondContact CG-O 3.06Å; M777-H781 PolarHBondContact N-O 2.86Å; Q779-H781 PolarHBondContact O-N 3.37Å; Q779-H781 PolarHBondContact O-ND1 2.99Å
782	K	81.3	Confident	80.2	Confident	118 Å²	118	74.7 Å²	74.7	51%	0.513	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.3	177.3	-73	-174.4	174.7	-171	0	111	E751 Q775 I776	E751-K782 IonicContact OE1-NZ 2.75Å; E751-K782 PolarHBondContact OE1-NZ 3.13Å; E751-K782 IonicContact OE2-NZ 2.63Å; E751-K782 PolarHBondContact OE2-NZ 2.04Å; Q775-K782 CarbonylContact O-C 3.56Å; Q775-K782 WeakPolarHBondContact O-CA 3.42Å; I776-K782 HydrophobicContact CG1-CG 4.14Å
783	I	84.3	Confident	79.8	Confident	60 Å²	60	77 Å²	77	31%	0.308	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.3	176.3	-60.1	-174	0	0	0	109.6	K774 Q775 M777	K774-I783 WeakPolarHBondContact CA-O 3.39Å; Q775-I783 PolarHBondContact N-O 3.43Å; Q775-I783 PolarHBondContact O-N 3.19Å; M777-I783 HydrophobicContact CE-CD1 4.21Å; M777-I783 HydrophobicContact CG-CD1 3.66Å; M777-I783 HydrophobicContact CG-CG1 3.91Å; M777-I783 HydrophobicContact SD-CD1 3.69Å; M777-I783 HydrophobicContact SD-CG1 4.22Å
784	E	83.7	Confident	79.7	Confident	119 Å²	119	81 Å²	81	56%	0.556	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.5	171.3	-76	-175	-167	0	0	110.6	K774	K774-E784 HydrophobicContact CD-CG 4.25Å; K774-E784 WeakPolarHBondContact CE-OE1 3.42Å; K774-E784 HydrophobicContact CG-CG 4Å; K774-E784 IonicContact NZ-OE1 3.39Å; K774-E784 PolarHBondContact NZ-OE1 3.15Å
785	R	85.6	Confident	79.7	Confident	89 Å²	89	81.3 Å²	81.3	34%	0.336	44%	0.438	S	S	.	.			trans	-127.9	152.9	-175.9	-64.3	-62.3	-163.7	-162.6	2.6	109.7	V748 C773 Q775 M789	V748-R785 HydrophobicContact CG1-CB 4.24Å; V748-R785 HydrophobicContact CG1-CG 3.8Å; C773-R785 WeakPolarHBondContact CB-O 3.46Å; C773-R785 PolarHBondContact O-N 3.06Å; Q775-R785 HydrophobicContact CB-CG 4.12Å; Q775-R785 VanDerWaalsContact OE1-CZ 3.28Å; R785-M789 HydrophobicContact CB-SD 4.32Å
786	P	84.8	Confident	79.6	Confident	67 Å²	67	82.8 Å²	82.8	44%	0.435	46%	0.455	S	S	.	.			trans	-63.7	147.9	176.8	26.8	-35.2	0	0	0	111.4	S788 M789	P786-S788 PolarHBondContact O-N 2.03Å; P786-M789 HydrophobicContact CG-CE 3.9Å; P786-M789 HydrophobicContact CG-CG 3.96Å; P786-M789 HydrophobicContact CG-SD 3.72Å; P786-M789 PolarHBondContact O-N 3.41Å
787	E	81.9	Confident	79.7	Confident	103 Å²	103	84.4 Å²	84.4	48%	0.481	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-55.9	-28.1	-176.4	-68.4	-160.4	-179.2	0	0	114.2	W750 M789 C790 K794	W750-E787 HydrophobicContact CH2-CB 3.77Å; W750-E787 HydrophobicContact CH2-CG 3.77Å; W750-E787 HydrophobicContact CZ3-CB 4.45Å; W750-E787 HydrophobicContact CZ3-CG 4.01Å; E787-M789 PolarHBondContact O-N 3.44Å; E787-C790 PolarHBondContact O-N 3.21Å; E787-K794 IonicContact OE1-NZ 3.63Å; E787-K794 PolarHBondContact OE1-NZ 3.36Å; E787-K794 WeakPolarHBondContact OE2-CE 2.99Å; E787-K794 IonicContact OE2-NZ 3.4Å; E787-K794 PolarHBondContact OE2-NZ 2.81Å
788	S	80.1	Confident	80	Confident	111 Å²	111	87.8 Å²	87.8	78%	0.776	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-68.7	-13	177.4	53.7	0	0	0	0	114.9	P786	P786-S788 PolarHBondContact O-N 2.03Å
789	M	80.8	Confident	80.8	Confident	110 Å²	110	92.5 Å²	92.5	54%	0.542	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-89.1	-18.4	174.8	-70.3	178.3	179.8	0	0	112.7	V748 R785 P786 E787	V748-M789 HydrophobicContact CG2-CB 4.36Å; V748-M789 WeakPolarHBondContact CG2-O 3.21Å; R785-M789 HydrophobicContact CB-SD 4.32Å; P786-M789 HydrophobicContact CG-CE 3.9Å; P786-M789 HydrophobicContact CG-CG 3.96Å; P786-M789 HydrophobicContact CG-SD 3.72Å; P786-M789 PolarHBondContact O-N 3.41Å; E787-M789 PolarHBondContact O-N 3.44Å
790	C	83.2	Confident	81.5	Confident	9 Å²	9	88.1 Å²	88.1	6%	0.061	48%	0.479	C	S	.	.	S	Bend	trans	-89.2	158	177.7	-82.3	0	0	0	0	112.3	R749 W750 C773 E787 S792	R749-C790 PolarHBondContact N-SG 3.34Å; W750-C790 HydrophobicContact CD2-CB 3.85Å; W750-C790 VanDerWaalsContact CE2-CB 3.46Å; W750-C790 HydrophobicContact CE3-CB 4.44Å; W750-C790 HydrophobicContact CG-CB 4.23Å; W750-C790 HydrophobicContact CH2-CB 4.4Å; W750-C790 HydrophobicContact CZ2-CB 3.78Å; C773-C790 WeakPolarHBondContact CA-SG 3.44Å; C773-C790 HydrophobicContact CB-CB 3.76Å; C773-C790 WeakPolarHBondContact CB-SG 3.28Å; C773-C790 WeakPolarHBondContact SG-CB 3.43Å; C773-C790 PolarHBondContact SG-N 2.77Å; C773-C790 VanDerWaalsContact SG-N 3.44Å; C773-C790 CovalentContact SG-SG 2.03Å; C773-C790 PolarHBondContact SG-SG 3.43Å; E787-C790 PolarHBondContact O-N 3.21Å; C790-S792 PolarHBondContact O-N 2.86Å
791	P	80	Confident	82.5	Confident	80 Å²	80	84 Å²	84	52%	0.519	46%	0.462	S	S	.	.			trans	-55.1	137.9	-178.6	-27.3	35.1	0	0	0	113.1	W750 A793	W750-P791 PolarHBondContact NE1-O 2.93Å; P791-A793 PolarHBondContact O-N 3Å
792	S	71.8	Confident	82.9	Confident	130 Å²	130	81.5 Å²	81.5	91%	0.909	45%	0.453	S	S	*	.	S	Bend	trans	-54.8	-22.4	-170.6	-44.3	0	0	0	0	115.3	C790 K794	C790-S792 PolarHBondContact O-N 2.86Å; S792-K794 VanDerWaalsContact C-N 3.27Å; S792-K794 PolarHBondContact O-N 2.85Å
793	A	79.1	Confident	82.7	Confident	85 Å²	85	79.8 Å²	79.8	70%	0.702	45%	0.452	S	S	*	.	S	Bend	trans	-77.8	67.2	174.8	0	0	0	0	0	112.3	P791 P795	P791-A793 PolarHBondContact O-N 3Å; A793-P795 WeakPolarHBondContact O-CD 3.43Å
794	K	85.5	Confident	82.1	Confident	88 Å²	88	85 Å²	85	38%	0.383	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-54.9	121.2	176.1	-174.2	174.5	-171.2	177.2	0	111	W750 V771 E787 S792 A796	W750-K794 HydrophobicContact CD2-CG 4.35Å; W750-K794 HydrophobicContact CE3-CG 4.31Å; W750-K794 HydrophobicContact CH2-CB 4.13Å; W750-K794 HydrophobicContact CH2-CD 3.67Å; W750-K794 HydrophobicContact CH2-CG 3.64Å; W750-K794 HydrophobicContact CZ2-CB 3.69Å; W750-K794 HydrophobicContact CZ2-CD 4.14Å; W750-K794 HydrophobicContact CZ2-CG 3.7Å; W750-K794 HydrophobicContact CZ3-CD 4.1Å; W750-K794 HydrophobicContact CZ3-CG 3.97Å; V771-K794 HydrophobicContact CG1-CG 4.24Å; E787-K794 IonicContact OE1-NZ 3.63Å; E787-K794 PolarHBondContact OE1-NZ 3.36Å; E787-K794 WeakPolarHBondContact OE2-CE 2.99Å; E787-K794 IonicContact OE2-NZ 3.4Å; E787-K794 PolarHBondContact OE2-NZ 2.81Å; S792-K794 VanDerWaalsContact C-N 3.27Å; S792-K794 PolarHBondContact O-N 2.85Å; K794-A796 PolarHBondContact O-N 3.21Å
795	P	86.1	Confident	81.1	Confident	37 Å²	37	84.9 Å²	84.9	24%	0.24	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-60.3	133.1	177.4	-25	34.2	0	0	0	111.2	W750 V752 V771 A793 D797	W750-P795 HydrophobicContact CB-CG 3.72Å; W750-P795 VanDerWaalsContact CD1-CD 3.45Å; W750-P795 HydrophobicContact CG-CG 3.97Å; V752-P795 HydrophobicContact CG1-CB 3.77Å; V752-P795 HydrophobicContact CG1-CG 3.97Å; V771-P795 HydrophobicContact CG1-CB 4.24Å; V771-P795 HydrophobicContact CG1-CG 4.33Å; A793-P795 WeakPolarHBondContact O-CD 3.43Å; P795-D797 PolarHBondContact O-N 2.84Å; P795-D797 VanDerWaalsContact O-N 3.16Å
796	A	84	Confident	80.2	Confident	60 Å²	60	83.3 Å²	83.3	50%	0.496	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-52	122.7	-176.7	0	0	0	0	0	112.3	W755 R769 K794	W755-A796 WeakPolarHBondContact CH2-O 3.38Å; R769-A796 VanDerWaalsContact CZ-O 3.28Å; R769-A796 PolarHBondContact NE-O 2.97Å; R769-A796 PolarHBondContact NH2-O 2.88Å; K794-A796 PolarHBondContact O-N 3.21Å
797	D	86.8	Confident	79.3	Confident	68 Å²	68	85.1 Å²	85.1	36%	0.364	50%	0.495	S	S	.	.	S	Bend	trans	-74.9	-29.4	176.4	70.4	-48.4	0	0	0	111.4	W755 D768 R769 V771 P795	W755-D797 WeakPolarHBondContact CZ3-O 3.41Å; D768-D797 CarbonylContact C-O 3.59Å; D768-D797 VanDerWaalsContact CA-O 3.26Å; D768-D797 WeakPolarHBondContact CA-O 3.37Å; R769-D797 PolarHBondContact N-O 3.12Å; V771-D797 HydrophobicContact CG2-CB 4.18Å; P795-D797 PolarHBondContact O-N 2.84Å; P795-D797 VanDerWaalsContact O-N 3.16Å
798	K	86.8	Confident	78	Confident	107 Å²	107	85.7 Å²	85.7	47%	0.465	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.4	178	-38.9	-158.9	-178.2	-54.1	0	112	K767 D768	K767-K798 CarbonylContact O-C 3.5Å; K767-K798 WeakPolarHBondContact O-CA 3.48Å; D768-K798 WeakPolarHBondContact OD1-CD 3.07Å; D768-K798 IonicContact OD1-NZ 3.44Å; D768-K798 PolarHBondContact OD1-NZ 3.29Å
799	K	87.3	Confident	76.6	Confident	119 Å²	119	88.6 Å²	88.6	52%	0.517	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	134.4	171.9	-175.6	166.1	-175.7	164.1	0	111.1	W755 K767	W755-K799 HydrophobicContact CE3-CB 4.37Å; W755-K799 HydrophobicContact CH2-CB 3.47Å; W755-K799 VanDerWaalsContact CH2-CB 3.47Å; W755-K799 HydrophobicContact CH2-CD 4.46Å; W755-K799 HydrophobicContact CZ2-CB 4.12Å; W755-K799 HydrophobicContact CZ2-CD 4.29Å; W755-K799 HydrophobicContact CZ3-CB 3.62Å; K767-K799 HydrophobicContact CG-CB 4.36Å; K767-K799 WeakPolarHBondContact CG-O 3.32Å; K767-K799 PolarHBondContact N-O 3.08Å; K767-K799 PolarHBondContact O-N 3.38Å
800	P	85.3	Confident	74.9	Confident	58 Å²	58	90.1 Å²	90.1	38%	0.377	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	142.5	173.4	27.4	-35.6	0	0	0	111.3	Y764 G765 V803	Y764-P800 HydrophobicContact CE1-CB 3.87Å; G765-P800 WeakPolarHBondContact O-CA 3.33Å; P800-V803 HydrophobicContact CB-CG1 3.88Å
801	C	83.8	Confident	73.5	Confident	18 Å²	18	94.9 Å²	94.9	12%	0.122	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-143.2	159.1	-178.4	51.6	0	0	0	0	109.9	C758 G765 F766 K767 V803	C758-C801 VanDerWaalsContact CA-SG 3.57Å; C758-C801 HydrophobicContact CB-CB 3.94Å; C758-C801 WeakPolarHBondContact CB-SG 3.46Å; C758-C801 WeakPolarHBondContact SG-CB 3.01Å; C758-C801 CovalentContact SG-SG 2.03Å; C758-C801 PolarHBondContact SG-SG 3.08Å; G765-C801 CarbonylContact C-O 3.42Å; G765-C801 PolarHBondContact N-O 3.47Å; G765-C801 PolarHBondContact O-N 2.81Å; F766-C801 PolarHBondContact O-SG 3.38Å; K767-C801 HydrophobicContact CD-CB 4.31Å; K767-C801 HydrophobicContact CG-CB 4.22Å; K767-C801 PolarHBondContact N-SG 2.89Å; K767-C801 VanDerWaalsContact N-SG 3.41Å; C801-V803 PolarHBondContact O-N 3.03Å
802	N	79.4	Confident	72.3	Confident	75 Å²	75	97.9 Å²	97.9	40%	0.401	56%	0.556	S	S	.	*			trans	51.3	33.2	-178.6	-62.8	-25.3	0	0	0	114.2	C758 H760 G763 Y764 K804	C758-N802 PolarHBondContact SG-ND2 2.9Å; C758-N802 VanDerWaalsContact SG-ND2 3.38Å; H760-N802 WeakPolarHBondContact O-CB 3.39Å; H760-N802 PolarHBondContact O-ND2 3.19Å; G763-N802 PolarHBondContact N-O 2.74Å; Y764-N802 PolarHBondContact N-O 3.49Å; N802-K804 PolarHBondContact O-N 3.48Å; N802-K804 VanDerWaalsContact O-O 3.06Å
803	V	77.8	Confident	71.9	Confident	82 Å²	82	92.5 Å²	92.5	50%	0.497	52%	0.517	S	S	.	.			trans	-64	-4.1	-180	-62.5	0	0	0	0	115	Y764 P800 C801	Y764-V803 HydrophobicContact CD2-CB 4.14Å; Y764-V803 HydrophobicContact CD2-CG1 3.82Å; Y764-V803 HydrophobicContact CE2-CB 4.49Å; Y764-V803 HydrophobicContact CE2-CG1 3.88Å; Y764-V803 HydrophobicContact CG-CG1 4.24Å; P800-V803 HydrophobicContact CB-CG1 3.88Å; C801-V803 PolarHBondContact O-N 3.03Å
804	K	69.8	Low	71.7	Confident	171 Å²	171	93.7 Å²	93.7	74%	0.743	52%	0.516	S	S	*	.	S	Bend	trans	-69.8	134.2	167.6	-68.1	-177.9	179.1	178.4	0	108.1	G763 N802 C806	G763-K804 PolarHBondContact N-O 2.03Å; N802-K804 PolarHBondContact O-N 3.48Å; N802-K804 VanDerWaalsContact O-O 3.06Å; K804-C806 PolarHBondContact O-N 2.97Å
805	P	63.6	Low	71.5	Confident	115 Å²	115	90.2 Å²	90.2	75%	0.747	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-48.6	140.6	169.5	-26.7	34.5	0	0	0	110.2
806	C	67.2	Low	71.2	Confident	57 Å²	57	93 Å²	93	39%	0.385	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-53.1	144.8	167.9	-72.2	0	0	0	0	109.3	C762 G763 K804	C762-C806 HydrophobicContact CB-CB 3.91Å; C762-C806 WeakPolarHBondContact CB-SG 3.34Å; C762-C806 PolarHBondContact O-SG 2.97Å; C762-C806 VanDerWaalsContact SG-CA 3.56Å; C762-C806 WeakPolarHBondContact SG-CB 3.36Å; C762-C806 CovalentContact SG-SG 2.05Å; C762-C806 PolarHBondContact SG-SG 3.43Å; G763-C806 PolarHBondContact N-SG 3.33Å; K804-C806 PolarHBondContact O-N 2.97Å
807	P	64.6	Low	71	Confident	104 Å²	104	94.4 Å²	94.4	68%	0.675	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-48.7	132.9	159.2	-20.7	32.2	0	0	0	107.6	E809	P807-E809 PolarHBondContact O-N 3.46Å
808	P	55.2	Low	70.4	Confident	116 Å²	116	94.1 Å²	94.1	75%	0.753	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-54.8	137.5	175.3	25	-34	0	0	0	108.1	D810	P808-D810 PolarHBondContact O-N 3.19Å; P808-D810 VanDerWaalsContact O-N 3.08Å
809	E	50.5	Low	69.9	Low	172 Å²	172	95.7 Å²	95.7	80%	0.804	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-50.1	123.3	-180	-78.4	-142.8	130.1	0	0	109.7	P807 P811	P807-E809 PolarHBondContact O-N 3.46Å; E809-P811 WeakPolarHBondContact O-CD 3.09Å
810	D	44.8	Very low	69.3	Low	142 Å²	142	92.8 Å²	92.8	76%	0.759	52%	0.516	S	S	*	.			trans	-55.6	104.7	-172.6	-135.2	-12.7	0	0	0	108	P808 K812	P808-D810 PolarHBondContact O-N 3.19Å; P808-D810 VanDerWaalsContact O-N 3.08Å; D810-K812 PolarHBondContact O-N 3.41Å
811	P	54.3	Low	69.2	Low	109 Å²	109	94.8 Å²	94.8	71%	0.708	53%	0.527	S	S	*	.			trans	-64.5	117.9	-157.7	21.5	-33.2	0	0	0	109.7	E809 P813	E809-P811 WeakPolarHBondContact O-CD 3.09Å; P811-P813 WeakPolarHBondContact O-CA 3.46Å
812	K	54	Low	69.1	Low	143 Å²	143	97.5 Å²	97.5	62%	0.622	54%	0.538	S	S	*	.			trans	-26.1	99.9	-169.9	-103.9	-177.8	176.7	175.1	0	111.2	D810 V814 L904 S905	D810-K812 PolarHBondContact O-N 3.41Å; K812-V814 PolarHBondContact O-N 2.99Å; K812-L904 WeakPolarHBondContact CE-O 3.47Å; K812-L904 HydrophobicContact CG-CB 4.11Å; K812-S905 VanDerWaalsContact C-OG 3.28Å
813	P	64.4	Low	69.4	Low	16 Å²	16	97.5 Å²	97.5	10%	0.104	54%	0.537	C	S	.	.			trans	-67.6	112.6	-162.1	24.4	-34.6	0	0	0	109.5	P811 I815 Y857 A902 S905	P811-P813 WeakPolarHBondContact O-CA 3.46Å; P813-I815 PolarHBondContact O-N 3.04Å; P813-I815 VanDerWaalsContact O-N 3.09Å; P813-Y857 HydrophobicContact CB-CD2 4.13Å; P813-Y857 HydrophobicContact CB-CG 4.24Å; P813-Y857 HydrophobicContact CG-CD2 3.81Å; P813-Y857 HydrophobicContact CG-CE2 4.36Å; P813-Y857 HydrophobicContact CG-CG 4.19Å; P813-A902 HydrophobicContact CG-CB 4.34Å; P813-A902 WeakPolarHBondContact CG-O 3.44Å; P813-S905 WeakPolarHBondContact CD-OG 3.39Å; P813-S905 VanDerWaalsContact N-OG 3.16Å; P813-S905 VanDerWaalsContact O-CB 3.24Å; P813-S905 WeakPolarHBondContact O-CB 3.31Å; P813-S905 PolarHBondContact O-OG 2.82Å
814	V	75.1	Confident	69.7	Low	110 Å²	110	94 Å²	94	67%	0.667	52%	0.515	S	S	*	.			trans	-64.4	114.4	-170.7	-177.6	0	0	0	0	110.2	K812	K812-V814 PolarHBondContact O-N 2.99Å
815	I	81.6	Confident	70.1	Confident	15 Å²	15	93.8 Å²	93.8	8%	0.077	52%	0.517	C	S	.	.	B	Isolated β-bridge	trans	-80.9	124.5	170.9	-57.6	162.6	0	0	0	107.4	P813 I817 P853 V854 A907	P813-I815 PolarHBondContact O-N 3.04Å; P813-I815 VanDerWaalsContact O-N 3.09Å; I815-I817 HydrophobicContact CG2-CG1 4.44Å; I815-I817 PolarHBondContact O-N 2.89Å; I815-P853 HydrophobicContact CG2-CG 4.39Å; I815-V854 HydrophobicContact CG1-CG1 3.68Å; I815-A907 HydrophobicContact CB-CB 4.13Å; I815-A907 HydrophobicContact CD1-CB 3.77Å; I815-A907 HydrophobicContact CG2-CB 3.77Å
816	Q	78.4	Confident	71	Confident	96 Å²	96	91.8 Å²	91.8	45%	0.449	50%	0.5	S	S	.	.			trans	-81.5	80.9	178.7	-60.6	-160	-81.6	0	0	111.5	P853 K855	Q816-P853 HydrophobicContact CB-CB 4.42Å; Q816-P853 HydrophobicContact CB-CG 4.1Å; Q816-P853 PolarHBondContact N-O 3.28Å; Q816-P853 VanDerWaalsContact N-O 3.12Å; Q816-P853 WeakPolarHBondContact O-CG 3.3Å; Q816-K855 VanDerWaalsContact NE2-NZ 3.18Å
817	I	79.6	Confident	71.5	Confident	89 Å²	89	91.1 Å²	91.1	46%	0.456	49%	0.494	S	S	.	.			trans	-60.7	143.1	178.3	-48.9	-173.1	0	0	0	110.5	I815 N819 A907	I815-I817 HydrophobicContact CG2-CG1 4.44Å; I815-I817 PolarHBondContact O-N 2.89Å; I817-N819 VanDerWaalsContact CG2-OD1 3.27Å; I817-N819 WeakPolarHBondContact CG2-OD1 3.43Å; I817-A907 HydrophobicContact CD1-CB 3.66Å; I817-A907 HydrophobicContact CG1-CB 3.79Å
818	N	74.3	Confident	71.9	Confident	63 Å²	63	94.8 Å²	94.8	34%	0.337	50%	0.5	S	S	.	.			trans	-130.3	93.2	178.2	-167.8	103.6	0	0	0	110.1	S820 K835 V836 G837	N818-S820 VanDerWaalsContact C-N 3.26Å; N818-S820 WeakPolarHBondContact ND2-CB 3.06Å; N818-S820 PolarHBondContact ND2-OG 3.08Å; N818-S820 PolarHBondContact O-N 2.05Å; N818-K835 HydrophobicContact CB-CB 4.42Å; N818-K835 HydrophobicContact CB-CD 4.04Å; N818-V836 PolarHBondContact N-O 3.1Å; N818-G837 CarbonylContact O-C 3.6Å; N818-G837 VanDerWaalsContact O-C 3.27Å
819	N	76.6	Confident	73.2	Confident	140 Å²	140	94.5 Å²	94.5	75%	0.749	49%	0.487	S	S	*	.			trans	-73.5	73.6	-175.1	-70.6	-5.6	0	0	0	112.4	I817	I817-N819 VanDerWaalsContact CG2-OD1 3.27Å; I817-N819 WeakPolarHBondContact CG2-OD1 3.43Å
820	S	74.3	Confident	74.6	Confident	58 Å²	58	90.6 Å²	90.6	41%	0.406	48%	0.475	S	S	.	.			trans	-130.8	125.2	179.5	62.3	0	0	0	0	110.7	N818 H822	N818-S820 VanDerWaalsContact C-N 3.26Å; N818-S820 WeakPolarHBondContact ND2-CB 3.06Å; N818-S820 PolarHBondContact ND2-OG 3.08Å; N818-S820 PolarHBondContact O-N 2.05Å; S820-H822 PolarHBondContact O-N 3.33Å
821	T	83.3	Confident	76.5	Confident	100 Å²	100	90.2 Å²	90.2	61%	0.613	47%	0.466	S	S	*	.			trans	-74	115.9	172.8	-54.2	0	0	0	0	110.1	I823 A839	T821-I823 HydrophobicContact CG2-CG1 4.27Å; T821-A839 CarbonylContact C-O 3.56Å; T821-A839 VanDerWaalsContact CA-O 3.31Å; T821-A839 WeakPolarHBondContact CA-O 3.12Å; T821-A839 HydrophobicContact CG2-CB 4.24Å
822	H	83.4	Confident	78.2	Confident	74 Å²	74	85.3 Å²	85.3	34%	0.343	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.6	176.5	-175.2	71.8	0	0	0	110.7	S820 L834 A839 G840 L841	S820-H822 PolarHBondContact O-N 3.33Å; H822-L834 HydrophobicContact CB-CD2 3.64Å; H822-L834 VanDerWaalsContact CD2-CD2 3.43Å; H822-L834 WeakPolarHBondContact CD2-CD2 3.06Å; H822-A839 PolarHBondContact N-O 3.31Å; H822-G840 CarbonylContact O-C 3.58Å; H822-G840 WeakPolarHBondContact O-CA 3.31Å; H822-L841 PolarHBondContact O-N 3.15Å
823	I	84.8	Confident	79.9	Confident	75 Å²	75	81.8 Å²	81.8	39%	0.385	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.4	176.5	-58.5	178.6	0	0	0	109.6	T821 H825 L841	T821-I823 HydrophobicContact CG2-CG1 4.27Å; I823-H825 PolarHBondContact O-CD2 2.88Å; I823-H825 PolarHBondContact O-N 2.96Å; I823-L841 HydrophobicContact CG1-CB 4.37Å; I823-L841 HydrophobicContact CG1-CD2 4.31Å; I823-L841 HydrophobicContact CG2-CD2 4.16Å
824	Q	84.6	Confident	81.1	Confident	9 Å²	9	81.4 Å²	81.4	4%	0.042	42%	0.422	C	S	.	.			trans	-76.6	100.3	170.8	-177.5	170.7	-2.3	0	0	110.4	D826 K829 I832 L841 F843 T846	Q824-D826 WeakPolarHBondContact CG-O 3.47Å; Q824-D826 PolarHBondContact NE2-O 3.31Å; Q824-K829 PolarHBondContact NE2-O 2.86Å; Q824-K829 VanDerWaalsContact NE2-O 3.16Å; Q824-I832 HydrophobicContact CB-CD1 3.67Å; Q824-I832 HydrophobicContact CG-CD1 3.59Å; Q824-I832 VanDerWaalsContact OE1-CD1 3.24Å; Q824-L841 WeakPolarHBondContact CB-O 3.31Å; Q824-L841 PolarHBondContact N-O 3.41Å; Q824-F843 HydrophobicContact CB-CD2 4.14Å; Q824-F843 HydrophobicContact CB-CE2 4.37Å; Q824-F843 VanDerWaalsContact CD-CD2 3.46Å; Q824-F843 HydrophobicContact CG-CD2 3.54Å; Q824-F843 HydrophobicContact CG-CE2 3.93Å; Q824-F843 WeakPolarHBondContact O-CE2 3.13Å; Q824-T846 PolarHBondContact NE2-OG1 2.94Å; Q824-T846 PolarHBondContact OE1-OG1 3.38Å
825	H	78.4	Confident	81.8	Confident	167 Å²	167	81.3 Å²	81.3	77%	0.773	41%	0.412	S	S	*	.			trans	-79.8	-23.1	175.1	-63.1	-86	0	0	0	113.8	I823	I823-H825 PolarHBondContact O-CD2 2.88Å; I823-H825 PolarHBondContact O-N 2.96Å
826	D	82.5	Confident	82	Confident	73 Å²	73	80.6 Å²	80.6	39%	0.39	41%	0.409	S	S	.	.			trans	-106.8	110.4	-178.4	176.1	12.8	0	0	0	111.9	Q824 K828 K829	Q824-D826 WeakPolarHBondContact CG-O 3.47Å; Q824-D826 PolarHBondContact NE2-O 3.31Å; D826-K828 VanDerWaalsContact C-N 3.3Å; D826-K828 PolarHBondContact O-N 3.05Å; D826-K828 WeakPolarHBondContact OD1-CA 3.43Å; D826-K828 WeakPolarHBondContact OD1-CB 3.22Å; D826-K828 PolarHBondContact OD1-N 3.22Å; D826-K829 HydrophobicContact CB-CB 4.11Å; D826-K829 WeakPolarHBondContact O-CB 3.42Å; D826-K829 PolarHBondContact O-N 3.13Å
827	P	75.9	Confident	82.2	Confident	42 Å²	42	76.1 Å²	76.1	27%	0.273	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.3	177.5	30.7	-35.1	0	0	0	114.5	K829 F843 K916 P917	P827-K829 VanDerWaalsContact C-N 3.31Å; P827-F843 VanDerWaalsContact CA-CD2 3.5Å; P827-F843 HydrophobicContact CB-CD2 3.77Å; P827-F843 HydrophobicContact CB-CE2 3.75Å; P827-F843 HydrophobicContact CB-CG 4.42Å; P827-F843 HydrophobicContact CB-CZ 4.38Å; P827-F843 HydrophobicContact CG-CE2 4.43Å; P827-K916 HydrophobicContact CB-CB 4.41Å; P827-K916 HydrophobicContact CB-CD 4.34Å; P827-K916 HydrophobicContact CB-CG 4.3Å; P827-P917 HydrophobicContact CG-CG 4.36Å
828	K	74.2	Confident	82.4	Confident	182 Å²	182	73.4 Å²	73.4	79%	0.791	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15	175	-58.3	-179.2	-179.9	179	0	111.9	D826 T830	D826-K828 VanDerWaalsContact C-N 3.3Å; D826-K828 PolarHBondContact O-N 3.05Å; D826-K828 WeakPolarHBondContact OD1-CA 3.43Å; D826-K828 WeakPolarHBondContact OD1-CB 3.22Å; D826-K828 PolarHBondContact OD1-N 3.22Å; K828-T830 PolarHBondContact O-N 3.04Å
829	K	81.5	Confident	83	Confident	110 Å²	110	71.2 Å²	71.2	48%	0.478	37%	0.373	S	S	.	.			trans	-78.9	83.6	-176.8	-166.5	172.2	-174.1	171	0	113.3	Q824 D826 P827 K831	Q824-K829 PolarHBondContact NE2-O 2.86Å; Q824-K829 VanDerWaalsContact NE2-O 3.16Å; D826-K829 HydrophobicContact CB-CB 4.11Å; D826-K829 WeakPolarHBondContact O-CB 3.42Å; D826-K829 PolarHBondContact O-N 3.13Å; P827-K829 VanDerWaalsContact C-N 3.31Å; K829-K831 PolarHBondContact O-N 3.42Å
830	T	80.1	Confident	83.6	Confident	89 Å²	89	64.6 Å²	64.6	55%	0.546	34%	0.338	S	S	.	.			trans	-62.8	-5.9	-177.1	58.5	0	0	0	0	116.7	K828 Q847	K828-T830 PolarHBondContact O-N 3.04Å; T830-Q847 PolarHBondContact O-N 3.27Å
831	K	86.2	Confident	84.3	Confident	135 Å²	135	62.9 Å²	62.9	59%	0.587	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.4	122.5	-175.7	-77.1	160.1	-173.2	158.4	0	112.2	K829 Q847	K829-K831 PolarHBondContact O-N 3.42Å; K831-Q847 WeakPolarHBondContact CA-O 3.36Å; K831-Q847 HydrophobicContact CG-CB 4.01Å
832	I	89.7	Confident	84.6	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.8	178.6	-73.2	-174.6	0	0	0	111.1	Q824 L834 V842 T846 Q847 K849	Q824-I832 HydrophobicContact CB-CD1 3.67Å; Q824-I832 HydrophobicContact CG-CD1 3.59Å; Q824-I832 VanDerWaalsContact OE1-CD1 3.24Å; I832-L834 HydrophobicContact CG2-CD2 3.76Å; I832-L834 HydrophobicContact CG2-CG 4.04Å; I832-V842 HydrophobicContact CD1-CG1 4.03Å; I832-V842 HydrophobicContact CG2-CG1 4.48Å; I832-T846 HydrophobicContact CB-CG2 4.26Å; I832-T846 HydrophobicContact CD1-CG2 4.19Å; I832-T846 HydrophobicContact CG1-CG2 4.02Å; I832-Q847 PolarHBondContact N-O 3.02Å; I832-K849 WeakPolarHBondContact O-CB 3.34Å; I832-K849 PolarHBondContact O-N 2.57Å
833	T	89.3	Confident	84.9	Confident	69 Å²	69	56 Å²	56	42%	0.423	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	116.3	176.8	-68.8	0	0	0	0	110.6	K849 K851	T833-K849 CarbonylContact C-O 3.51Å; T833-K849 VanDerWaalsContact CA-O 3.25Å; T833-K849 WeakPolarHBondContact CA-O 3.14Å; T833-K849 HydrophobicContact CG2-CD 4.49Å; T833-K849 HydrophobicContact CG2-CG 4.49Å; T833-K851 HydrophobicContact CG2-CD 3.82Å; T833-K851 HydrophobicContact CG2-CG 4.2Å
834	L	89.8	Confident	84.9	Confident	9 Å²	9	53.5 Å²	53.5	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	163.6	-178.5	-55.5	178.3	0	0	0	110.8	H822 I832 V848 K849 I850 K851 I909 I911	H822-L834 HydrophobicContact CB-CD2 3.64Å; H822-L834 VanDerWaalsContact CD2-CD2 3.43Å; H822-L834 WeakPolarHBondContact CD2-CD2 3.06Å; I832-L834 HydrophobicContact CG2-CD2 3.76Å; I832-L834 HydrophobicContact CG2-CG 4.04Å; L834-V848 HydrophobicContact CD1-CG1 3.8Å; L834-V848 HydrophobicContact CG-CG1 4.25Å; L834-K849 PolarHBondContact N-O 2.89Å; L834-I850 HydrophobicContact CB-CG2 4.36Å; L834-K851 WeakPolarHBondContact O-CB 3.39Å; L834-K851 PolarHBondContact O-N 2.83Å; L834-I909 HydrophobicContact CB-CD1 4.17Å; L834-I909 HydrophobicContact CD1-CD1 3.94Å; L834-I911 HydrophobicContact CD1-CD1 3.4Å
835	K	88.9	Confident	84.8	Confident	108 Å²	108	54.1 Å²	54.1	47%	0.47	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	162.9	158.7	-62.6	177.9	-170.8	168.7	0	107.7	N818 K851 I909	N818-K835 HydrophobicContact CB-CB 4.42Å; N818-K835 HydrophobicContact CB-CD 4.04Å; K835-K851 WeakPolarHBondContact CA-O 3.24Å; K835-I909 VanDerWaalsContact O-CD1 3.29Å; K835-I909 WeakPolarHBondContact O-CD1 3.49Å
836	V	87.1	Confident	85.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-74.4	145.1	169.9	177.9	0	0	0	0	110.2	N818 I850 K851 C852 W864 C900 A907 E908 I909	N818-V836 PolarHBondContact N-O 3.1Å; V836-I850 HydrophobicContact CG2-CG2 3.75Å; V836-K851 PolarHBondContact N-O 2.98Å; V836-K851 VanDerWaalsContact N-O 3.09Å; V836-C852 HydrophobicContact CG2-CB 4.47Å; V836-W864 HydrophobicContact CG2-CH2 3.52Å; V836-W864 HydrophobicContact CG2-CZ3 3.92Å; V836-C900 HydrophobicContact CG2-CB 4.3Å; V836-A907 HydrophobicContact CG1-CB 3.54Å; V836-A907 VanDerWaalsContact CG1-O 3.3Å; V836-A907 WeakPolarHBondContact CG1-O 3.27Å; V836-E908 VanDerWaalsContact CG1-N 3.34Å; V836-E908 WeakPolarHBondContact CG1-O 3.49Å; V836-I909 HydrophobicContact CG2-CG2 4.31Å
837	G	81.7	Confident	85.7	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.021	24%	0.242	C	C	.	.	S	Bend	trans	108.7	142.9	-165.5	0	0	0	0	0	112.9	N818 E908	N818-G837 CarbonylContact O-C 3.6Å; N818-G837 VanDerWaalsContact O-C 3.27Å; G837-E908 VanDerWaalsContact CA-O 3.31Å; G837-E908 WeakPolarHBondContact CA-O 3.46Å; G837-E908 PolarHBondContact N-O 2.76Å
838	G	84.7	Confident	86.4	Confident	31 Å²	31	44.5 Å²	44.5	32%	0.32	23%	0.229	S	C	.	.	S	Bend	trans	68.9	-143	179.3	0	0	0	0	0	113.9	I909 S910	G838-I909 WeakPolarHBondContact O-CA 3.49Å; G838-S910 PolarHBondContact O-N 3.08Å
839	A	86.1	Confident	87.3	Confident	18 Å²	18	39.2 Å²	39.2	15%	0.149	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	159.8	-178.8	0	0	0	0	0	111.8	T821 H822 S910	T821-A839 CarbonylContact C-O 3.56Å; T821-A839 VanDerWaalsContact CA-O 3.31Å; T821-A839 WeakPolarHBondContact CA-O 3.12Å; T821-A839 HydrophobicContact CG2-CB 4.24Å; H822-A839 PolarHBondContact N-O 3.31Å; A839-S910 CarbonylContact C-O 3.54Å; A839-S910 WeakPolarHBondContact CA-O 3.2Å
840	G	88.7	Confident	87.8	Confident	1 Å²	1	34 Å²	34	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	110.6	178.5	0	0	0	0	0	111.9	H822 S910 I911 E912	H822-G840 CarbonylContact O-C 3.58Å; H822-G840 WeakPolarHBondContact O-CA 3.31Å; G840-S910 PolarHBondContact N-O 3.2Å; G840-I911 WeakPolarHBondContact O-CA 3.35Å; G840-E912 PolarHBondContact O-N 3.01Å
841	L	88.9	Confident	88.3	Confident	22 Å²	22	34.5 Å²	34.5	12%	0.115	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.2	178	178.9	62.2	0	0	0	109.8	H822 I823 Q824 E912 K914	H822-L841 PolarHBondContact O-N 3.15Å; I823-L841 HydrophobicContact CG1-CB 4.37Å; I823-L841 HydrophobicContact CG1-CD2 4.31Å; I823-L841 HydrophobicContact CG2-CD2 4.16Å; Q824-L841 WeakPolarHBondContact CB-O 3.31Å; Q824-L841 PolarHBondContact N-O 3.41Å; L841-E912 WeakPolarHBondContact CA-O 3.32Å; L841-E912 HydrophobicContact CD1-CB 3.61Å; L841-K914 HydrophobicContact CD1-CD 3.8Å; L841-K914 HydrophobicContact CD1-CG 3.89Å; L841-K914 HydrophobicContact CD2-CD 4.11Å; L841-K914 HydrophobicContact CG-CD 4.29Å
842	V	90.2	Very high	88.5	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	160.4	-170.4	-62.2	0	0	0	0	112.6	I832 V848 I890 I911 E912 V913 K914	I832-V842 HydrophobicContact CD1-CG1 4.03Å; I832-V842 HydrophobicContact CG2-CG1 4.48Å; V842-V848 HydrophobicContact CB-CG2 4.39Å; V842-V848 HydrophobicContact CG1-CG2 4.15Å; V842-V848 HydrophobicContact CG2-CG2 4.02Å; V842-I890 HydrophobicContact CG2-CD1 3.96Å; V842-I890 HydrophobicContact CG2-CG2 4.05Å; V842-I911 HydrophobicContact CG2-CG2 4.3Å; V842-E912 PolarHBondContact N-O 2.83Å; V842-V913 HydrophobicContact CG2-CG2 4.3Å; V842-V913 CarbonylContact O-C 3.54Å; V842-V913 VanDerWaalsContact O-CA 3.32Å; V842-V913 WeakPolarHBondContact O-CA 3.49Å; V842-K914 PolarHBondContact O-N 2.99Å
843	F	89.4	Confident	88.4	Confident	26 Å²	26	29.9 Å²	29.9	11%	0.114	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	145.4	177.4	-69.7	-59.8	0	0	0	112.8	Q824 P827 T846 K914 A915 K916	Q824-F843 HydrophobicContact CB-CD2 4.14Å; Q824-F843 HydrophobicContact CB-CE2 4.37Å; Q824-F843 VanDerWaalsContact CD-CD2 3.46Å; Q824-F843 HydrophobicContact CG-CD2 3.54Å; Q824-F843 HydrophobicContact CG-CE2 3.93Å; Q824-F843 WeakPolarHBondContact O-CE2 3.13Å; P827-F843 VanDerWaalsContact CA-CD2 3.5Å; P827-F843 HydrophobicContact CB-CD2 3.77Å; P827-F843 HydrophobicContact CB-CE2 3.75Å; P827-F843 HydrophobicContact CB-CG 4.42Å; P827-F843 HydrophobicContact CB-CZ 4.38Å; P827-F843 HydrophobicContact CG-CE2 4.43Å; F843-T846 WeakPolarHBondContact O-CB 3.14Å; F843-T846 PolarHBondContact O-N 3.21Å; F843-T846 VanDerWaalsContact O-N 3.11Å; F843-T846 PolarHBondContact O-OG1 2.85Å; F843-K914 CarbonylContact C-O 3.6Å; F843-K914 WeakPolarHBondContact CA-O 3.25Å; F843-K914 HydrophobicContact CD1-CB 4.14Å; F843-K914 HydrophobicContact CE1-CB 4.3Å; F843-A915 WeakPolarHBondContact CD1-O 3.49Å; F843-A915 VanDerWaalsContact CE1-O 3.3Å; F843-A915 WeakPolarHBondContact CE1-O 3.48Å; F843-K916 HydrophobicContact CB-CG 4.04Å; F843-K916 HydrophobicContact CD1-CG 4.46Å; F843-K916 HydrophobicContact CG-CG 4.3Å
844	F	85.8	Confident	88.3	Confident	24 Å²	24	26.7 Å²	26.7	11%	0.105	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	136.8	175	-173.1	-85.8	0	0	0	112.7	T846 I890 T891 F892 V913 K914 K916 L924	F844-T846 VanDerWaalsContact C-N 3.29Å; F844-T846 PolarHBondContact O-N 3.3Å; F844-I890 CarbonylContact C-O 3.45Å; F844-I890 WeakPolarHBondContact CA-O 3.4Å; F844-T891 HydrophobicContact CE2-CG2 3.95Å; F844-T891 HydrophobicContact CZ-CG2 4.09Å; F844-F892 HydrophobicContact CB-CZ 4.45Å; F844-F892 AromaticContact CD2-CD2 3.74Å; F844-F892 HydrophobicContact CD2-CD2 3.74Å; F844-F892 AromaticContact CD2-CE2 3.51Å; F844-F892 HydrophobicContact CD2-CE2 3.51Å; F844-F892 HydrophobicContact CD2-CG 4.36Å; F844-F892 AromaticContact CD2-CZ 3.95Å; F844-F892 HydrophobicContact CD2-CZ 3.95Å; F844-F892 AromaticContact CE2-CD2 3.84Å; F844-F892 HydrophobicContact CE2-CD2 3.84Å; F844-F892 AromaticContact CE2-CE2 3.85Å; F844-F892 HydrophobicContact CE2-CE2 3.85Å; F844-F892 HydrophobicContact CG-CE2 4.39Å; F844-V913 HydrophobicContact CB-CG1 4.26Å; F844-K914 PolarHBondContact N-O 2.96Å; F844-K916 WeakPolarHBondContact O-CE 3.43Å; F844-K916 PolarHBondContact O-NZ 3.02Å; F844-L924 HydrophobicContact CD1-CD2 4.23Å; F844-L924 HydrophobicContact CE1-CD2 4.1Å; F844-L924 HydrophobicContact CG-CD1 4.49Å
845	G	82.1	Confident	87.7	Confident	22 Å²	22	32 Å²	32	23%	0.227	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	-0.2	-176	0	0	0	0	0	115.6	D889 I890	G845-D889 WeakPolarHBondContact CA-OD1 3.33Å; G845-I890 PolarHBondContact N-O 3.29Å
846	T	88.8	Confident	86.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	19%	0.191	C	C	.	.			trans	-73.2	140.5	176.9	-59.2	0	0	0	0	111.8	Q824 I832 F843 F844 I890	Q824-T846 PolarHBondContact NE2-OG1 2.94Å; Q824-T846 PolarHBondContact OE1-OG1 3.38Å; I832-T846 HydrophobicContact CB-CG2 4.26Å; I832-T846 HydrophobicContact CD1-CG2 4.19Å; I832-T846 HydrophobicContact CG1-CG2 4.02Å; F843-T846 WeakPolarHBondContact O-CB 3.14Å; F843-T846 PolarHBondContact O-N 3.21Å; F843-T846 VanDerWaalsContact O-N 3.11Å; F843-T846 PolarHBondContact O-OG1 2.85Å; F844-T846 VanDerWaalsContact C-N 3.29Å; F844-T846 PolarHBondContact O-N 3.3Å; T846-I890 WeakPolarHBondContact O-CB 3.04Å; T846-I890 WeakPolarHBondContact O-CG2 3.2Å; T846-I890 PolarHBondContact O-N 2.83Å
847	Q	90.4	Very high	86.5	Confident	77 Å²	77	41.4 Å²	41.4	36%	0.36	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	110.2	172.8	-61.5	-176.4	-4.9	0	0	110.4	T830 K831 I832 I887 L888	T830-Q847 PolarHBondContact O-N 3.27Å; K831-Q847 WeakPolarHBondContact CA-O 3.36Å; K831-Q847 HydrophobicContact CG-CB 4.01Å; I832-Q847 PolarHBondContact N-O 3.02Å; Q847-I887 CarbonylContact C-O 3.59Å; Q847-I887 WeakPolarHBondContact CA-O 3.35Å; Q847-L888 HydrophobicContact CB-CD2 4.39Å; Q847-L888 HydrophobicContact CG-CD2 4.05Å
848	V	92.1	Very high	86.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.9	-176.3	-175.6	0	0	0	0	110.8	L834 V842 I850 R886 I887 I890	L834-V848 HydrophobicContact CD1-CG1 3.8Å; L834-V848 HydrophobicContact CG-CG1 4.25Å; V842-V848 HydrophobicContact CB-CG2 4.39Å; V842-V848 HydrophobicContact CG1-CG2 4.15Å; V842-V848 HydrophobicContact CG2-CG2 4.02Å; V848-I850 HydrophobicContact CG1-CG1 4.07Å; V848-R886 CarbonylContact O-C 3.55Å; V848-R886 WeakPolarHBondContact O-CA 3.25Å; V848-I887 HydrophobicContact CB-CB 4.43Å; V848-I887 PolarHBondContact N-O 3.25Å; V848-I887 PolarHBondContact O-N 2.9Å; V848-I890 HydrophobicContact CG2-CD1 3.86Å; V848-I890 HydrophobicContact CG2-CG2 4.36Å
849	K	92.1	Very high	86.4	Confident	71 Å²	71	49.8 Å²	49.8	31%	0.309	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	104.8	179	174.6	-179.4	168.2	-168.7	0	111.4	I832 T833 L834 L885 R886	I832-K849 WeakPolarHBondContact O-CB 3.34Å; I832-K849 PolarHBondContact O-N 2.57Å; T833-K849 CarbonylContact C-O 3.51Å; T833-K849 VanDerWaalsContact CA-O 3.25Å; T833-K849 WeakPolarHBondContact CA-O 3.14Å; T833-K849 HydrophobicContact CG2-CD 4.49Å; T833-K849 HydrophobicContact CG2-CG 4.49Å; L834-K849 PolarHBondContact N-O 2.89Å; K849-L885 CarbonylContact C-O 3.59Å; K849-L885 VanDerWaalsContact CA-O 3.32Å; K849-L885 WeakPolarHBondContact CA-O 3.3Å; K849-R886 HydrophobicContact CB-CG 4.4Å; K849-R886 HydrophobicContact CG-CG 4.21Å
850	I	92.8	Very high	86.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.8	-176.8	-41	-178.1	0	0	0	109.9	L834 V836 V848 W864 A884 L885 Y898 I909 I911	L834-I850 HydrophobicContact CB-CG2 4.36Å; V836-I850 HydrophobicContact CG2-CG2 3.75Å; V848-I850 HydrophobicContact CG1-CG1 4.07Å; I850-W864 HydrophobicContact CB-CH2 3.68Å; I850-W864 HydrophobicContact CB-CZ3 4.01Å; I850-W864 HydrophobicContact CG2-CH2 3.55Å; I850-W864 HydrophobicContact CG2-CZ3 3.86Å; I850-W864 WeakPolarHBondContact O-CZ2 3.21Å; I850-A884 CarbonylContact O-C 3.51Å; I850-A884 WeakPolarHBondContact O-CA 3.45Å; I850-A884 VanDerWaalsContact O-CB 3.29Å; I850-A884 WeakPolarHBondContact O-CB 3.03Å; I850-L885 PolarHBondContact N-O 2.86Å; I850-L885 PolarHBondContact O-N 2.72Å; I850-Y898 HydrophobicContact CD1-CD2 4.47Å; I850-Y898 HydrophobicContact CD1-CG 4.06Å; I850-I909 HydrophobicContact CD1-CG2 4.17Å; I850-I909 HydrophobicContact CG2-CG2 3.79Å; I850-I911 HydrophobicContact CD1-CD1 4.14Å; I850-I911 HydrophobicContact CD1-CG1 4.17Å
851	K	90.8	Very high	85.9	Confident	99 Å²	99	60.2 Å²	60.2	43%	0.43	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.7	178.2	-67	167.6	172	165.9	0	110.8	T833 L834 K835 V836 P853 A884	T833-K851 HydrophobicContact CG2-CD 3.82Å; T833-K851 HydrophobicContact CG2-CG 4.2Å; L834-K851 WeakPolarHBondContact O-CB 3.39Å; L834-K851 PolarHBondContact O-N 2.83Å; K835-K851 WeakPolarHBondContact CA-O 3.24Å; V836-K851 PolarHBondContact N-O 2.98Å; V836-K851 VanDerWaalsContact N-O 3.09Å; K851-P853 VanDerWaalsContact O-CD 3.32Å; K851-P853 WeakPolarHBondContact O-CD 3.38Å; K851-A884 HydrophobicContact CG-CB 4.34Å
852	C	90.3	Very high	85.9	Confident	7 Å²	7	59.6 Å²	59.6	5%	0.047	27%	0.274	C	S	.	.			trans	-93.3	105.3	168.6	-169.9	0	0	0	0	109.9	V836 V854 I862 W864 C900	V836-C852 HydrophobicContact CG2-CB 4.47Å; C852-V854 PolarHBondContact O-N 3.02Å; C852-V854 VanDerWaalsContact O-N 3.14Å; C852-I862 HydrophobicContact CB-CD1 4.16Å; C852-I862 HydrophobicContact CB-CG2 4.23Å; C852-W864 HydrophobicContact CB-CH2 4.28Å; C852-W864 HydrophobicContact CB-CZ2 3.82Å; C852-C900 HydrophobicContact CB-CB 3.52Å; C852-C900 WeakPolarHBondContact CB-SG 3.46Å; C852-C900 WeakPolarHBondContact SG-CB 3.45Å; C852-C900 CovalentContact SG-SG 2.04Å; C852-C900 PolarHBondContact SG-SG 3.27Å
853	P	86.6	Confident	85.9	Confident	36 Å²	36	67.2 Å²	67.2	23%	0.234	31%	0.306	C	S	.	.			trans	-90.4	70.7	-169.6	36.8	-36.3	0	0	0	112.6	I815 Q816 K851	I815-P853 HydrophobicContact CG2-CG 4.39Å; Q816-P853 HydrophobicContact CB-CB 4.42Å; Q816-P853 HydrophobicContact CB-CG 4.1Å; Q816-P853 PolarHBondContact N-O 3.28Å; Q816-P853 VanDerWaalsContact N-O 3.12Å; Q816-P853 WeakPolarHBondContact O-CG 3.3Å; K851-P853 VanDerWaalsContact O-CD 3.32Å; K851-P853 WeakPolarHBondContact O-CD 3.38Å
854	V	86.5	Confident	86.1	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.012	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-78.4	145.5	171.6	-67.1	0	0	0	0	112.5	I815 C852 Y857 R859 I862 A902	I815-V854 HydrophobicContact CG1-CG1 3.68Å; C852-V854 PolarHBondContact O-N 3.02Å; C852-V854 VanDerWaalsContact O-N 3.14Å; V854-Y857 HydrophobicContact CG2-CD1 4.33Å; V854-R859 HydrophobicContact CG2-CG 3.79Å; V854-R859 PolarHBondContact O-NE 2.94Å; V854-R859 PolarHBondContact O-NH2 2.9Å; V854-I862 HydrophobicContact CG2-CD1 3.77Å; V854-A902 HydrophobicContact CG1-CB 3.68Å
855	K	77.9	Confident	86.3	Confident	120 Å²	120	65.5 Å²	65.5	52%	0.522	30%	0.299	S	S	.	.	S	Bend	trans	-103.9	153	164.6	-75	170.4	169.7	166.3	0	109.6	Q816 Y857	Q816-K855 VanDerWaalsContact NE2-NZ 3.18Å; K855-Y857 PolarHBondContact O-N 3.29Å
856	R	71.1	Confident	86.7	Confident	268 Å²	268	65.9 Å²	65.9	100%	1.011	30%	0.295	S	S	*	.	S	Bend	trans	53.4	-3.2	179.2	-60.3	-173.3	-177.5	-129.4	2.5	118.2
857	Y	80.5	Confident	86.7	Confident	39 Å²	39	69.2 Å²	69.2	15%	0.153	31%	0.312	C	S	.	.	S	Bend	trans	-98.6	148.3	178.5	-171.6	-100.3	0	0	0	114	P813 V854 K855 R859 K861 I862 A902 G903	P813-Y857 HydrophobicContact CB-CD2 4.13Å; P813-Y857 HydrophobicContact CB-CG 4.24Å; P813-Y857 HydrophobicContact CG-CD2 3.81Å; P813-Y857 HydrophobicContact CG-CE2 4.36Å; P813-Y857 HydrophobicContact CG-CG 4.19Å; V854-Y857 HydrophobicContact CG2-CD1 4.33Å; K855-Y857 PolarHBondContact O-N 3.29Å; Y857-R859 PolarHBondContact O-N 3.01Å; Y857-R859 VanDerWaalsContact O-N 3.15Å; Y857-K861 HydrophobicContact CE1-CB 3.93Å; Y857-K861 WeakPolarHBondContact OH-CB 3.4Å; Y857-I862 HydrophobicContact CD1-CG1 4.23Å; Y857-I862 HydrophobicContact CE1-CG1 4.11Å; Y857-A902 HydrophobicContact CD1-CB 3.81Å; Y857-A902 HydrophobicContact CE1-CB 3.78Å; Y857-A902 HydrophobicContact CG-CB 4.34Å; Y857-G903 PolarHBondContact OH-N 2.89Å; Y857-G903 VanDerWaalsContact OH-N 3.13Å
858	N	82.2	Confident	86.2	Confident	91 Å²	91	72 Å²	72	49%	0.487	33%	0.325	S	S	.	.			trans	-72.6	105.7	177.6	-173	-13.1	0	0	0	111.8	T860 K861	N858-T860 PolarHBondContact O-N 3.15Å; N858-T860 PolarHBondContact OD1-N 3.04Å; N858-T860 VanDerWaalsContact OD1-N 3.15Å; N858-T860 PolarHBondContact OD1-OG1 3.15Å; N858-K861 PolarHBondContact O-N 3.39Å
859	R	81.9	Confident	85.8	Confident	118 Å²	118	79.7 Å²	79.7	45%	0.445	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-9.2	-174.1	-58	-171.4	-177.6	98	-0.8	115.2	V854 Y857 I862 G883	V854-R859 HydrophobicContact CG2-CG 3.79Å; V854-R859 PolarHBondContact O-NE 2.94Å; V854-R859 PolarHBondContact O-NH2 2.9Å; Y857-R859 PolarHBondContact O-N 3.01Å; Y857-R859 VanDerWaalsContact O-N 3.15Å; R859-I862 HydrophobicContact CB-CD1 4.19Å; R859-I862 HydrophobicContact CG-CD1 4.32Å; R859-G883 WeakPolarHBondContact O-CA 3.05Å; R859-G883 PolarHBondContact O-N 2.91Å
860	T	80.6	Confident	85.6	Confident	100 Å²	100	81.2 Å²	81.2	61%	0.613	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.7	171.6	65.1	0	0	0	0	113.1	N858 I862	N858-T860 PolarHBondContact O-N 3.15Å; N858-T860 PolarHBondContact OD1-N 3.04Å; N858-T860 VanDerWaalsContact OD1-N 3.15Å; N858-T860 PolarHBondContact OD1-OG1 3.15Å; T860-I862 VanDerWaalsContact C-N 3.35Å
861	K	83.8	Confident	85.3	Confident	138 Å²	138	83 Å²	83	60%	0.6	38%	0.384	S	S	*	.	S	Bend	trans	-84	-3.4	178.7	-66.4	-171.8	175.9	-175.9	0	114	Y857 N858 K863	Y857-K861 HydrophobicContact CE1-CB 3.93Å; Y857-K861 WeakPolarHBondContact OH-CB 3.4Å; N858-K861 PolarHBondContact O-N 3.39Å; K861-K863 PolarHBondContact O-N 3.4Å
862	I	88.6	Confident	84.6	Confident	9 Å²	9	85.5 Å²	85.5	5%	0.046	40%	0.398	C	S	.	.			trans	-68.2	119.7	-178	-60.7	178.5	0	0	0	110.2	C852 V854 Y857 R859 T860 C900 H901 A902	C852-I862 HydrophobicContact CB-CD1 4.16Å; C852-I862 HydrophobicContact CB-CG2 4.23Å; V854-I862 HydrophobicContact CG2-CD1 3.77Å; Y857-I862 HydrophobicContact CD1-CG1 4.23Å; Y857-I862 HydrophobicContact CE1-CG1 4.11Å; R859-I862 HydrophobicContact CB-CD1 4.19Å; R859-I862 HydrophobicContact CG-CD1 4.32Å; T860-I862 VanDerWaalsContact C-N 3.35Å; I862-C900 HydrophobicContact CG2-CB 4.2Å; I862-H901 WeakPolarHBondContact CA-O 3.32Å; I862-A902 HydrophobicContact CG1-CB 4.39Å
863	K	89.9	Confident	83.9	Confident	161 Å²	161	95.8 Å²	95.8	70%	0.7	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	160.6	171.5	-62.5	-179.8	-178.4	178.1	0	109.9	K861 H901	K861-K863 PolarHBondContact O-N 3.4Å; K863-H901 HydrophobicContact CB-CB 4.29Å; K863-H901 PolarHBondContact N-O 3.2Å; K863-H901 PolarHBondContact O-N 3.01Å
864	W	92.8	Very high	83.8	Confident	11 Å²	11	96.6 Å²	96.6	4%	0.042	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.4	176.1	-72.9	83.5	0	0	0	110.3	V836 I850 C852 L871 G883 L885 S899 C900	V836-W864 HydrophobicContact CG2-CH2 3.52Å; V836-W864 HydrophobicContact CG2-CZ3 3.92Å; I850-W864 HydrophobicContact CB-CH2 3.68Å; I850-W864 HydrophobicContact CB-CZ3 4.01Å; I850-W864 HydrophobicContact CG2-CH2 3.55Å; I850-W864 HydrophobicContact CG2-CZ3 3.86Å; I850-W864 WeakPolarHBondContact O-CZ2 3.21Å; C852-W864 HydrophobicContact CB-CH2 4.28Å; C852-W864 HydrophobicContact CB-CZ2 3.82Å; W864-L871 HydrophobicContact CB-CD1 4.07Å; W864-L871 PolarHBondContact O-N 3.13Å; W864-G883 PolarHBondContact NE1-O 2.85Å; W864-L885 HydrophobicContact CD2-CB 3.67Å; W864-L885 HydrophobicContact CD2-CD2 4.11Å; W864-L885 HydrophobicContact CD2-CG 4.45Å; W864-L885 HydrophobicContact CE3-CB 4.03Å; W864-L885 HydrophobicContact CE3-CD2 3.89Å; W864-L885 HydrophobicContact CG-CB 4.07Å; W864-L885 HydrophobicContact CG-CD2 4.4Å; W864-L885 HydrophobicContact CH2-CB 4.29Å; W864-L885 HydrophobicContact CZ2-CB 3.95Å; W864-L885 HydrophobicContact CZ3-CB 4.33Å; W864-L885 HydrophobicContact CZ3-CD2 4.46Å; W864-S899 VanDerWaalsContact CA-O 3.31Å; W864-S899 WeakPolarHBondContact CA-O 3.29Å; W864-C900 HydrophobicContact CD2-CB 3.93Å; W864-C900 HydrophobicContact CE3-CB 3.89Å; W864-C900 HydrophobicContact CH2-CB 3.74Å; W864-C900 HydrophobicContact CZ2-CB 3.76Å; W864-C900 HydrophobicContact CZ3-CB 3.79Å
865	S	90.9	Very high	83.4	Confident	3 Å²	3	106.6 Å²	106.6	2%	0.021	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.2	169.8	45.2	0	0	0	0	111	K869 Y898 S899 H901	S865-K869 CarbonylContact C-O 3.55Å; S865-K869 WeakPolarHBondContact CA-O 3.28Å; S865-K869 WeakPolarHBondContact CB-O 3.45Å; S865-Y898 WeakPolarHBondContact O-CA 3.31Å; S865-S899 PolarHBondContact N-O 2.98Å; S865-S899 PolarHBondContact O-N 3Å; S865-S899 VanDerWaalsContact O-N 3.12Å; S865-S899 WeakPolarHBondContact OG-CB 3.4Å; S865-S899 PolarHBondContact OG-OG 3Å; S865-H901 PolarHBondContact OG-NE2 3.05Å
866	K	91.3	Very high	83.8	Confident	31 Å²	31	103.5 Å²	103.5	14%	0.135	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.6	163.2	-172.5	-167.6	-177.5	-80.5	0	106.5	H868 K869 L871 D894 A895 V897 Y898	K866-H868 PolarHBondContact O-N 3.11Å; K866-K869 PolarHBondContact N-O 2.8Å; K866-K869 PolarHBondContact O-N 2.85Å; K866-L871 HydrophobicContact CB-CD1 4.1Å; K866-L871 HydrophobicContact CB-CD2 3.84Å; K866-L871 HydrophobicContact CB-CG 3.91Å; K866-D894 WeakPolarHBondContact CE-O 3.35Å; K866-A895 VanDerWaalsContact CE-O 3.28Å; K866-A895 WeakPolarHBondContact CE-O 3.33Å; K866-A895 PolarHBondContact NZ-O 2.04Å; K866-V897 CarbonylContact C-O 3.27Å; K866-V897 VanDerWaalsContact CA-O 3.31Å; K866-V897 WeakPolarHBondContact CA-O 3.43Å; K866-Y898 HydrophobicContact CB-CD1 4.26Å; K866-Y898 HydrophobicContact CB-CE1 3.98Å; K866-Y898 HydrophobicContact CD-CE1 4.16Å; K866-Y898 HydrophobicContact CD-CE2 4.37Å; K866-Y898 WeakPolarHBondContact CD-OH 3.21Å; K866-Y898 WeakPolarHBondContact CE-OH 3.29Å; K866-Y898 HydrophobicContact CG-CD1 4.36Å; K866-Y898 HydrophobicContact CG-CE1 3.9Å; K866-Y898 HydrophobicContact CG-CE2 4.14Å
867	D	87.5	Confident	84.7	Confident	72 Å²	72	92.8 Å²	92.8	39%	0.385	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	48.1	179.9	-41.9	-41.5	0	0	0	111	K869 G896 V897	D867-K869 PolarHBondContact O-N 3.09Å; D867-G896 WeakPolarHBondContact OD1-CA 3.26Å; D867-V897 PolarHBondContact N-O 3.33Å; D867-V897 PolarHBondContact OD1-N 3.1Å
868	H	79.9	Confident	85	Confident	136 Å²	136	95.5 Å²	95.5	63%	0.63	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	-8.4	-172.1	-45.8	-62.4	0	0	0	117.1	K866 E908	K866-H868 PolarHBondContact O-N 3.11Å; H868-E908 IonicContact CE1-OE1 2.76Å; H868-E908 PolarHBondContact CE1-OE1 3.01Å; H868-E908 IonicContact CE1-OE2 3.18Å; H868-E908 IonicContact ND1-OE1 2.82Å; H868-E908 PolarHBondContact ND1-OE1 2.76Å
869	K	84.9	Confident	85.3	Confident	162 Å²	162	94 Å²	94	70%	0.704	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	138.4	175.9	-65.5	174.8	-177.1	176.4	0	111.3	S865 K866 D867 L871	S865-K869 CarbonylContact C-O 3.55Å; S865-K869 WeakPolarHBondContact CA-O 3.28Å; S865-K869 WeakPolarHBondContact CB-O 3.45Å; K866-K869 PolarHBondContact N-O 2.8Å; K866-K869 PolarHBondContact O-N 2.85Å; D867-K869 PolarHBondContact O-N 3.09Å; K869-L871 PolarHBondContact O-N 3.19Å
870	P	86	Confident	85.5	Confident	102 Å²	102	89.9 Å²	89.9	66%	0.662	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	127.6	-176.7	26.5	-34.2	0	0	0	111.7	Q872	P870-Q872 PolarHBondContact O-N 3.41Å
871	L	86.9	Confident	85.6	Confident	37 Å²	37	94.4 Å²	94.4	19%	0.194	43%	0.433	C	S	.	.			trans	-72.9	112.6	-177.5	-86.8	163.4	0	0	0	111.7	W864 K866 K869 Y877 L885 Y898	W864-L871 HydrophobicContact CB-CD1 4.07Å; W864-L871 PolarHBondContact O-N 3.13Å; K866-L871 HydrophobicContact CB-CD1 4.1Å; K866-L871 HydrophobicContact CB-CD2 3.84Å; K866-L871 HydrophobicContact CB-CG 3.91Å; K869-L871 PolarHBondContact O-N 3.19Å; L871-Y877 HydrophobicContact CD2-CD1 4.4Å; L871-Y877 HydrophobicContact CD2-CD2 3.75Å; L871-Y877 HydrophobicContact CD2-CE1 4.41Å; L871-Y877 HydrophobicContact CD2-CE2 3.78Å; L871-Y877 HydrophobicContact CD2-CG 4.07Å; L871-L885 HydrophobicContact CD1-CD2 3.87Å; L871-Y898 HydrophobicContact CD1-CD1 3.83Å; L871-Y898 HydrophobicContact CD1-CE1 3.85Å
872	Q	76.8	Confident	85.6	Confident	153 Å²	153	96 Å²	96	72%	0.715	44%	0.44	S	S	*	.			trans	-67.5	142.4	173.2	-64.8	-62.7	-6.2	0	0	111.6	P870 S874	P870-Q872 PolarHBondContact O-N 3.41Å; Q872-S874 PolarHBondContact O-N 3.44Å
873	R	75.6	Confident	85.4	Confident	223 Å²	223	95.6 Å²	95.6	84%	0.842	44%	0.438	S	S	*	.			trans	-74.4	114.1	-179.2	-74.3	-180	169	179.2	-1.8	110.1
874	S	83.9	Confident	85.4	Confident	53 Å²	53	88.2 Å²	88.2	37%	0.371	41%	0.407	S	S	.	.			trans	-128.4	179.3	-176.4	75.6	0	0	0	0	112.5	Q872 K876 Y877	Q872-S874 PolarHBondContact O-N 3.44Å; S874-K876 PolarHBondContact O-N 3.14Å; S874-K876 PolarHBondContact OG-N 3.17Å; S874-K876 VanDerWaalsContact OG-N 3.14Å; S874-Y877 PolarHBondContact N-O 3.2Å; S874-Y877 PolarHBondContact OG-N 3.31Å
875	R	79.4	Confident	85.4	Confident	211 Å²	211	87.7 Å²	87.7	80%	0.796	41%	0.406	S	S	*	.	S	Bend	trans	-63.5	-28	169.3	-69.9	-178.7	177.1	176	0.2	111.7	K878	R875-K878 WeakPolarHBondContact O-CE 3.33Å; R875-K878 PolarHBondContact O-NZ 3.38Å
876	K	84.6	Confident	85.4	Confident	55 Å²	55	93 Å²	93	24%	0.239	43%	0.425	C	S	.	.	S	Bend	trans	-82	-49.1	179.5	-149.6	-178.7	-166.6	-171.6	0	112.7	S874 L888 D889 T891 D894	S874-K876 PolarHBondContact O-N 3.14Å; S874-K876 PolarHBondContact OG-N 3.17Å; S874-K876 VanDerWaalsContact OG-N 3.14Å; K876-L888 WeakPolarHBondContact CG-O 3.2Å; K876-L888 PolarHBondContact O-N 3.31Å; K876-D889 WeakPolarHBondContact CE-O 3.47Å; K876-T891 PolarHBondContact NZ-OG1 2.85Å; K876-D894 WeakPolarHBondContact CE-OD1 3.48Å; K876-D894 WeakPolarHBondContact CE-OD2 3.14Å; K876-D894 IonicContact NZ-OD1 3.84Å; K876-D894 PolarHBondContact NZ-OD1 3.33Å; K876-D894 IonicContact NZ-OD2 3.04Å; K876-D894 PolarHBondContact NZ-OD2 3.37Å
877	Y	90.5	Very high	85.5	Confident	43 Å²	43	91.5 Å²	91.5	17%	0.169	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.5	-174.8	-53.2	-55.8	0	0	0	112.7	L871 S874 I887 D894	L871-Y877 HydrophobicContact CD2-CD1 4.4Å; L871-Y877 HydrophobicContact CD2-CD2 3.75Å; L871-Y877 HydrophobicContact CD2-CE1 4.41Å; L871-Y877 HydrophobicContact CD2-CE2 3.78Å; L871-Y877 HydrophobicContact CD2-CG 4.07Å; S874-Y877 PolarHBondContact N-O 3.2Å; S874-Y877 PolarHBondContact OG-N 3.31Å; Y877-I887 HydrophobicContact CD1-CG1 4.18Å; Y877-I887 HydrophobicContact CD1-CG2 4.22Å; Y877-I887 HydrophobicContact CE1-CG1 4.34Å; Y877-I887 HydrophobicContact CE1-CG2 4.03Å; Y877-D894 PolarHBondContact OH-OD1 3.29Å
878	K	87.6	Confident	85.5	Confident	96 Å²	96	90.1 Å²	90.1	42%	0.417	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	110.5	-173.8	-76.1	163	176.3	151.9	0	112.6	R875 R886 L888	R875-K878 WeakPolarHBondContact O-CE 3.33Å; R875-K878 PolarHBondContact O-NZ 3.38Å; K878-R886 PolarHBondContact N-O 3.01Å; K878-R886 WeakPolarHBondContact O-CB 3.42Å; K878-R886 PolarHBondContact O-N 3.14Å; K878-L888 HydrophobicContact CD-CD1 3.79Å
879	V	88.9	Confident	85.7	Confident	61 Å²	61	86.3 Å²	86.3	37%	0.37	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	127.8	174.5	-174.6	0	0	0	0	110.7	L885	V879-L885 HydrophobicContact CG2-CD1 4.06Å
880	S	85.9	Confident	85.9	Confident	31 Å²	31	78.6 Å²	78.6	22%	0.217	36%	0.362	C	S	.	.			trans	-75.4	153.8	-179.5	-176.4	0	0	0	0	112.7	K882 G883 A884	S880-K882 PolarHBondContact O-N 2.76Å; S880-G883 PolarHBondContact O-N 2.9Å; S880-A884 WeakPolarHBondContact CB-O 3.08Å; S880-A884 PolarHBondContact N-O 3.39Å
881	K	82.1	Confident	85.9	Confident	195 Å²	195	74 Å²	74	85%	0.848	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-18	170.1	-68.1	-170.2	178.2	-173.5	0	114.2
882	K	82.9	Confident	85.7	Confident	170 Å²	170	74 Å²	74	74%	0.739	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	20.3	173.8	-61.1	-168.4	177.2	-173	0	114	S880 A884	S880-K882 PolarHBondContact O-N 2.76Å; K882-A884 VanDerWaalsContact C-N 3.28Å; K882-A884 PolarHBondContact O-N 2.88Å
883	G	84.1	Confident	86.1	Confident	1 Å²	1	74 Å²	74	1%	0.01	32%	0.324	C	S	.	.	S	Bend	trans	75.6	1.7	174.2	0	0	0	0	0	116.7	R859 W864 S880	R859-G883 WeakPolarHBondContact O-CA 3.05Å; R859-G883 PolarHBondContact O-N 2.91Å; W864-G883 PolarHBondContact NE1-O 2.85Å; S880-G883 PolarHBondContact O-N 2.9Å
884	A	90.9	Very high	86.6	Confident	6 Å²	6	63.5 Å²	63.5	5%	0.05	28%	0.284	C	S	.	.			trans	-88.1	128.3	-179.8	0	0	0	0	0	111.7	I850 K851 S880 K882	I850-A884 CarbonylContact O-C 3.51Å; I850-A884 WeakPolarHBondContact O-CA 3.45Å; I850-A884 VanDerWaalsContact O-CB 3.29Å; I850-A884 WeakPolarHBondContact O-CB 3.03Å; K851-A884 HydrophobicContact CG-CB 4.34Å; S880-A884 WeakPolarHBondContact CB-O 3.08Å; S880-A884 PolarHBondContact N-O 3.39Å; K882-A884 VanDerWaalsContact C-N 3.28Å; K882-A884 PolarHBondContact O-N 2.88Å
885	L	92.6	Very high	86.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	147.5	171.3	-179.9	61.8	0	0	0	110.5	K849 I850 W864 L871 V879 I887 Y898	K849-L885 CarbonylContact C-O 3.59Å; K849-L885 VanDerWaalsContact CA-O 3.32Å; K849-L885 WeakPolarHBondContact CA-O 3.3Å; I850-L885 PolarHBondContact N-O 2.86Å; I850-L885 PolarHBondContact O-N 2.72Å; W864-L885 HydrophobicContact CD2-CB 3.67Å; W864-L885 HydrophobicContact CD2-CD2 4.11Å; W864-L885 HydrophobicContact CD2-CG 4.45Å; W864-L885 HydrophobicContact CE3-CB 4.03Å; W864-L885 HydrophobicContact CE3-CD2 3.89Å; W864-L885 HydrophobicContact CG-CB 4.07Å; W864-L885 HydrophobicContact CG-CD2 4.4Å; W864-L885 HydrophobicContact CH2-CB 4.29Å; W864-L885 HydrophobicContact CZ2-CB 3.95Å; W864-L885 HydrophobicContact CZ3-CB 4.33Å; W864-L885 HydrophobicContact CZ3-CD2 4.46Å; L871-L885 HydrophobicContact CD1-CD2 3.87Å; V879-L885 HydrophobicContact CG2-CD1 4.06Å; L885-I887 HydrophobicContact CD2-CG1 4.41Å; L885-I887 HydrophobicContact CG-CG1 4.48Å; L885-Y898 HydrophobicContact CD2-CD1 3.6Å; L885-Y898 HydrophobicContact CD2-CE1 3.98Å
886	R	91.5	Very high	87.3	Confident	113 Å²	113	53.6 Å²	53.6	43%	0.426	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.4	164.5	-54.2	-172.4	-163.7	-168	8.2	109	V848 K849 K878	V848-R886 CarbonylContact O-C 3.55Å; V848-R886 WeakPolarHBondContact O-CA 3.25Å; K849-R886 HydrophobicContact CB-CG 4.4Å; K849-R886 HydrophobicContact CG-CG 4.21Å; K878-R886 PolarHBondContact N-O 3.01Å; K878-R886 WeakPolarHBondContact O-CB 3.42Å; K878-R886 PolarHBondContact O-N 3.14Å
887	I	92.1	Very high	87.7	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.7	166.5	-50.2	168.7	0	0	0	105.6	Q847 V848 Y877 L885 I890 Y898	Q847-I887 CarbonylContact C-O 3.59Å; Q847-I887 WeakPolarHBondContact CA-O 3.35Å; V848-I887 HydrophobicContact CB-CB 4.43Å; V848-I887 PolarHBondContact N-O 3.25Å; V848-I887 PolarHBondContact O-N 2.9Å; Y877-I887 HydrophobicContact CD1-CG1 4.18Å; Y877-I887 HydrophobicContact CD1-CG2 4.22Å; Y877-I887 HydrophobicContact CE1-CG1 4.34Å; Y877-I887 HydrophobicContact CE1-CG2 4.03Å; L885-I887 HydrophobicContact CD2-CG1 4.41Å; L885-I887 HydrophobicContact CG-CG1 4.48Å; I887-I890 HydrophobicContact CD1-CD1 4.19Å; I887-I890 HydrophobicContact CG2-CB 4.24Å; I887-I890 HydrophobicContact CG2-CD1 4.39Å; I887-I890 HydrophobicContact CG2-CG1 4.03Å; I887-Y898 HydrophobicContact CD1-CD1 4.49Å; I887-Y898 HydrophobicContact CD1-CE1 3.81Å; I887-Y898 HydrophobicContact CD1-CE2 4.03Å; I887-Y898 HydrophobicContact CG1-CE1 4.44Å
888	L	87.9	Confident	87.8	Confident	44 Å²	44	51 Å²	51	23%	0.23	25%	0.246	C	C	.	.	S	Bend	trans	-102.8	135.2	174.9	-60.5	-179.8	0	0	0	109	Q847 K876 K878	Q847-L888 HydrophobicContact CB-CD2 4.39Å; Q847-L888 HydrophobicContact CG-CD2 4.05Å; K876-L888 WeakPolarHBondContact CG-O 3.2Å; K876-L888 PolarHBondContact O-N 3.31Å; K878-L888 HydrophobicContact CD-CD1 3.79Å
889	D	84.2	Confident	88	Confident	56 Å²	56	46.4 Å²	46.4	30%	0.299	23%	0.226	S	C	.	.	S	Bend	trans	57.8	66.6	177.2	-152.8	22.1	0	0	0	111.4	G845 K876 T891 R931	G845-D889 WeakPolarHBondContact CA-OD1 3.33Å; K876-D889 WeakPolarHBondContact CE-O 3.47Å; D889-T891 PolarHBondContact O-N 2.93Å; D889-R931 IonicContact OD2-CZ 3.37Å; D889-R931 IonicContact OD2-NH1 3.65Å; D889-R931 PolarHBondContact OD2-NH1 2.95Å; D889-R931 IonicContact OD2-NH2 2.7Å; D889-R931 PolarHBondContact OD2-NH2 2.95Å
890	I	88.8	Confident	88.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.208	C	C	.	.			trans	-69.5	126.3	-171.8	-158.2	171.5	0	0	0	111.9	V842 F844 G845 T846 V848 I887 D894 I911 V913	V842-I890 HydrophobicContact CG2-CD1 3.96Å; V842-I890 HydrophobicContact CG2-CG2 4.05Å; F844-I890 CarbonylContact C-O 3.45Å; F844-I890 WeakPolarHBondContact CA-O 3.4Å; G845-I890 PolarHBondContact N-O 3.29Å; T846-I890 WeakPolarHBondContact O-CB 3.04Å; T846-I890 WeakPolarHBondContact O-CG2 3.2Å; T846-I890 PolarHBondContact O-N 2.83Å; V848-I890 HydrophobicContact CG2-CD1 3.86Å; V848-I890 HydrophobicContact CG2-CG2 4.36Å; I887-I890 HydrophobicContact CD1-CD1 4.19Å; I887-I890 HydrophobicContact CG2-CB 4.24Å; I887-I890 HydrophobicContact CG2-CD1 4.39Å; I887-I890 HydrophobicContact CG2-CG1 4.03Å; I890-D894 VanDerWaalsContact CA-OD2 3.32Å; I890-D894 WeakPolarHBondContact CA-OD2 3.32Å; I890-D894 HydrophobicContact CD1-CB 4.16Å; I890-D894 HydrophobicContact CG1-CB 3.55Å; I890-D894 WeakPolarHBondContact CG1-OD2 3.43Å; I890-I911 HydrophobicContact CD1-CG2 3.76Å; I890-V913 HydrophobicContact CD1-CG2 3.95Å; I890-V913 HydrophobicContact CG1-CG2 4.04Å
891	T	86.7	Confident	88.3	Confident	6 Å²	6	45 Å²	45	4%	0.037	21%	0.212	C	C	.	.			trans	-112.2	168.5	-179.7	67.6	0	0	0	0	111.5	F844 K876 D889 R893 D894 E928	F844-T891 HydrophobicContact CE2-CG2 3.95Å; F844-T891 HydrophobicContact CZ-CG2 4.09Å; K876-T891 PolarHBondContact NZ-OG1 2.85Å; D889-T891 PolarHBondContact O-N 2.93Å; T891-R893 PolarHBondContact O-N 2.84Å; T891-D894 PolarHBondContact N-OD2 2.84Å; T891-D894 WeakPolarHBondContact O-CB 3.31Å; T891-D894 PolarHBondContact O-N 3.12Å; T891-E928 WeakPolarHBondContact CB-OE1 3.34Å; T891-E928 WeakPolarHBondContact CB-OE2 3.3Å; T891-E928 WeakPolarHBondContact CG2-OE1 3.19Å; T891-E928 PolarHBondContact OG1-OE1 3.22Å
892	F	82.9	Confident	88.6	Confident	37 Å²	37	35.7 Å²	35.7	16%	0.162	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-58.3	-32.9	178.5	-60.5	-69.2	0	0	0	112	F844 D894 A895 V913 A915 I921 L924 E925	F844-F892 HydrophobicContact CB-CZ 4.45Å; F844-F892 AromaticContact CD2-CD2 3.74Å; F844-F892 HydrophobicContact CD2-CD2 3.74Å; F844-F892 AromaticContact CD2-CE2 3.51Å; F844-F892 HydrophobicContact CD2-CE2 3.51Å; F844-F892 HydrophobicContact CD2-CG 4.36Å; F844-F892 AromaticContact CD2-CZ 3.95Å; F844-F892 HydrophobicContact CD2-CZ 3.95Å; F844-F892 AromaticContact CE2-CD2 3.84Å; F844-F892 HydrophobicContact CE2-CD2 3.84Å; F844-F892 AromaticContact CE2-CE2 3.85Å; F844-F892 HydrophobicContact CE2-CE2 3.85Å; F844-F892 HydrophobicContact CG-CE2 4.39Å; F892-D894 PolarHBondContact O-N 3.11Å; F892-A895 VanDerWaalsContact O-CB 3.31Å; F892-A895 WeakPolarHBondContact O-CB 3.39Å; F892-A895 PolarHBondContact O-N 2.9Å; F892-A895 VanDerWaalsContact O-N 3.08Å; F892-V913 HydrophobicContact CD1-CB 4.03Å; F892-V913 HydrophobicContact CD1-CG1 3.9Å; F892-V913 HydrophobicContact CE1-CB 4.48Å; F892-V913 HydrophobicContact CE1-CG1 4.04Å; F892-A915 HydrophobicContact CZ-CB 4.33Å; F892-I921 HydrophobicContact CE2-CG2 4.35Å; F892-I921 HydrophobicContact CZ-CG2 4.31Å; F892-L924 HydrophobicContact CE2-CB 4.1Å; F892-L924 HydrophobicContact CE2-CD1 4.34Å; F892-L924 HydrophobicContact CZ-CD1 4.35Å; F892-E925 HydrophobicContact CD2-CG 4.1Å; F892-E925 HydrophobicContact CE2-CG 4.45Å
893	R	83.8	Confident	88.5	Confident	152 Å²	152	30 Å²	30	57%	0.574	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-65.3	-15.4	174.7	-55.5	-175	-177	-153.7	-2.7	114.6	T891 E928	T891-R893 PolarHBondContact O-N 2.84Å; R893-E928 WeakPolarHBondContact CD-OE1 3.48Å; R893-E928 IonicContact NE-OE1 2.84Å
894	D	87.7	Confident	88.1	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.011	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-86.9	-8	174.2	-58.8	-42.2	0	0	0	113	K866 K876 Y877 I890 T891 F892 Y898	K866-D894 WeakPolarHBondContact CE-O 3.35Å; K876-D894 WeakPolarHBondContact CE-OD1 3.48Å; K876-D894 WeakPolarHBondContact CE-OD2 3.14Å; K876-D894 IonicContact NZ-OD1 3.84Å; K876-D894 PolarHBondContact NZ-OD1 3.33Å; K876-D894 IonicContact NZ-OD2 3.04Å; K876-D894 PolarHBondContact NZ-OD2 3.37Å; Y877-D894 PolarHBondContact OH-OD1 3.29Å; I890-D894 VanDerWaalsContact CA-OD2 3.32Å; I890-D894 WeakPolarHBondContact CA-OD2 3.32Å; I890-D894 HydrophobicContact CD1-CB 4.16Å; I890-D894 HydrophobicContact CG1-CB 3.55Å; I890-D894 WeakPolarHBondContact CG1-OD2 3.43Å; T891-D894 PolarHBondContact N-OD2 2.84Å; T891-D894 WeakPolarHBondContact O-CB 3.31Å; T891-D894 PolarHBondContact O-N 3.12Å; F892-D894 PolarHBondContact O-N 3.11Å; D894-Y898 VanDerWaalsContact O-CE2 3.31Å; D894-Y898 WeakPolarHBondContact O-CE2 3.32Å; D894-Y898 PolarHBondContact O-OH 2.77Å
895	A	88	Confident	87.7	Confident	39 Å²	39	36.8 Å²	36.8	32%	0.322	20%	0.197	S	C	.	.			trans	-60.6	142.6	174.4	0	0	0	0	0	111.1	K866 F892 I911 V913	K866-A895 VanDerWaalsContact CE-O 3.28Å; K866-A895 WeakPolarHBondContact CE-O 3.33Å; K866-A895 PolarHBondContact NZ-O 2.04Å; F892-A895 VanDerWaalsContact O-CB 3.31Å; F892-A895 WeakPolarHBondContact O-CB 3.39Å; F892-A895 PolarHBondContact O-N 2.9Å; F892-A895 VanDerWaalsContact O-N 3.08Å; A895-I911 CarbonylContact C-O 3.49Å; A895-I911 VanDerWaalsContact CA-O 3.26Å; A895-I911 WeakPolarHBondContact CA-O 3.45Å; A895-V913 HydrophobicContact CB-CG2 4.43Å
896	G	89.3	Confident	87.4	Confident	17 Å²	17	40.1 Å²	40.1	18%	0.175	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146	-173.3	-175.3	0	0	0	0	0	114	D867 I911	D867-G896 WeakPolarHBondContact OD1-CA 3.26Å; G896-I911 PolarHBondContact N-O 3.21Å; G896-I911 PolarHBondContact O-N 2.95Å
897	V	92.4	Very high	87.3	Confident	44 Å²	44	35 Å²	35	27%	0.267	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.5	-173.4	-178.8	0	0	0	0	110.8	K866 D867 E908	K866-V897 CarbonylContact C-O 3.27Å; K866-V897 VanDerWaalsContact CA-O 3.31Å; K866-V897 WeakPolarHBondContact CA-O 3.43Å; D867-V897 PolarHBondContact N-O 3.33Å; D867-V897 PolarHBondContact OD1-N 3.1Å; V897-E908 HydrophobicContact CG1-CB 3.9Å; V897-E908 HydrophobicContact CG1-CG 4.49Å
898	Y	93.4	Very high	87.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	107	-179.2	-73.6	-92.2	0	0	0	111.8	I850 S865 K866 L871 L885 I887 D894 I909 I911	I850-Y898 HydrophobicContact CD1-CD2 4.47Å; I850-Y898 HydrophobicContact CD1-CG 4.06Å; S865-Y898 WeakPolarHBondContact O-CA 3.31Å; K866-Y898 HydrophobicContact CB-CD1 4.26Å; K866-Y898 HydrophobicContact CB-CE1 3.98Å; K866-Y898 HydrophobicContact CD-CE1 4.16Å; K866-Y898 HydrophobicContact CD-CE2 4.37Å; K866-Y898 WeakPolarHBondContact CD-OH 3.21Å; K866-Y898 WeakPolarHBondContact CE-OH 3.29Å; K866-Y898 HydrophobicContact CG-CD1 4.36Å; K866-Y898 HydrophobicContact CG-CE1 3.9Å; K866-Y898 HydrophobicContact CG-CE2 4.14Å; L871-Y898 HydrophobicContact CD1-CD1 3.83Å; L871-Y898 HydrophobicContact CD1-CE1 3.85Å; L885-Y898 HydrophobicContact CD2-CD1 3.6Å; L885-Y898 HydrophobicContact CD2-CE1 3.98Å; I887-Y898 HydrophobicContact CD1-CD1 4.49Å; I887-Y898 HydrophobicContact CD1-CE1 3.81Å; I887-Y898 HydrophobicContact CD1-CE2 4.03Å; I887-Y898 HydrophobicContact CG1-CE1 4.44Å; D894-Y898 VanDerWaalsContact O-CE2 3.31Å; D894-Y898 WeakPolarHBondContact O-CE2 3.32Å; D894-Y898 PolarHBondContact O-OH 2.77Å; Y898-I909 PolarHBondContact N-O 3.14Å; Y898-I909 PolarHBondContact O-N 3.35Å; Y898-I909 VanDerWaalsContact O-N 3.11Å; Y898-I911 HydrophobicContact CD2-CB 4.02Å; Y898-I911 HydrophobicContact CD2-CG1 3.54Å; Y898-I911 HydrophobicContact CE2-CB 4.02Å; Y898-I911 HydrophobicContact CE2-CG1 3.95Å; Y898-I911 HydrophobicContact CG-CG1 4.47Å
899	S	92.3	Very high	87.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.6	178.2	-14.7	0	0	0	0	111.5	W864 S865 A907 E908	W864-S899 VanDerWaalsContact CA-O 3.31Å; W864-S899 WeakPolarHBondContact CA-O 3.29Å; S865-S899 PolarHBondContact N-O 2.98Å; S865-S899 PolarHBondContact O-N 3Å; S865-S899 VanDerWaalsContact O-N 3.12Å; S865-S899 WeakPolarHBondContact OG-CB 3.4Å; S865-S899 PolarHBondContact OG-OG 3Å; S899-A907 CarbonylContact C-O 3.6Å; S899-A907 WeakPolarHBondContact CA-O 3.22Å; S899-E908 WeakPolarHBondContact CB-OE1 3.22Å; S899-E908 PolarHBondContact OG-OE1 2.74Å
900	C	91.7	Very high	87.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.5	164.1	77	0	0	0	0	111.1	V836 C852 I862 W864 S906 A907	V836-C900 HydrophobicContact CG2-CB 4.3Å; C852-C900 HydrophobicContact CB-CB 3.52Å; C852-C900 WeakPolarHBondContact CB-SG 3.46Å; C852-C900 WeakPolarHBondContact SG-CB 3.45Å; C852-C900 CovalentContact SG-SG 2.04Å; C852-C900 PolarHBondContact SG-SG 3.27Å; I862-C900 HydrophobicContact CG2-CB 4.2Å; W864-C900 HydrophobicContact CD2-CB 3.93Å; W864-C900 HydrophobicContact CE3-CB 3.89Å; W864-C900 HydrophobicContact CH2-CB 3.74Å; W864-C900 HydrophobicContact CZ2-CB 3.76Å; W864-C900 HydrophobicContact CZ3-CB 3.79Å; C900-S906 WeakPolarHBondContact O-CA 3.03Å; C900-A907 PolarHBondContact N-O 3.01Å; C900-A907 PolarHBondContact O-N 3.28Å; C900-A907 VanDerWaalsContact O-N 3.1Å
901	H	89.8	Confident	87.9	Confident	62 Å²	62	35.8 Å²	35.8	29%	0.287	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.6	-176.7	-58.4	-82.3	0	0	0	110.4	I862 K863 S865	I862-H901 WeakPolarHBondContact CA-O 3.32Å; K863-H901 HydrophobicContact CB-CB 4.29Å; K863-H901 PolarHBondContact N-O 3.2Å; K863-H901 PolarHBondContact O-N 3.01Å; S865-H901 PolarHBondContact OG-NE2 3.05Å
902	A	86.7	Confident	88.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	96.1	-179.5	0	0	0	0	0	109.3	P813 V854 Y857 I862 L904 S905	P813-A902 HydrophobicContact CG-CB 4.34Å; P813-A902 WeakPolarHBondContact CG-O 3.44Å; V854-A902 HydrophobicContact CG1-CB 3.68Å; Y857-A902 HydrophobicContact CD1-CB 3.81Å; Y857-A902 HydrophobicContact CE1-CB 3.78Å; Y857-A902 HydrophobicContact CG-CB 4.34Å; I862-A902 HydrophobicContact CG1-CB 4.39Å; A902-L904 PolarHBondContact O-N 2.93Å; A902-S905 PolarHBondContact N-O 3.4Å; A902-S905 PolarHBondContact O-N 2.77Å; A902-S905 VanDerWaalsContact O-N 3.11Å
903	G	81.7	Confident	88.4	Confident	51 Å²	51	39.4 Å²	39.4	53%	0.526	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	-126.7	-168.8	0	0	0	0	0	110.4	Y857	Y857-G903 PolarHBondContact OH-N 2.89Å; Y857-G903 VanDerWaalsContact OH-N 3.13Å
904	L	75.1	Confident	88.5	Confident	130 Å²	130	37.7 Å²	37.7	68%	0.681	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	8.6	177.2	-58.1	177.2	0	0	0	113.9	K812 A902	K812-L904 WeakPolarHBondContact CE-O 3.47Å; K812-L904 HydrophobicContact CG-CB 4.11Å; A902-L904 PolarHBondContact O-N 2.93Å
905	S	82.4	Confident	88.1	Confident	18 Å²	18	38.5 Å²	38.5	13%	0.126	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.2	172.2	-64.5	0	0	0	0	110.8	K812 P813 A902	K812-S905 VanDerWaalsContact C-OG 3.28Å; P813-S905 WeakPolarHBondContact CD-OG 3.39Å; P813-S905 VanDerWaalsContact N-OG 3.16Å; P813-S905 VanDerWaalsContact O-CB 3.24Å; P813-S905 WeakPolarHBondContact O-CB 3.31Å; P813-S905 PolarHBondContact O-OG 2.82Å; A902-S905 PolarHBondContact N-O 3.4Å; A902-S905 PolarHBondContact O-N 2.77Å; A902-S905 VanDerWaalsContact O-N 3.11Å
906	S	87.9	Confident	87.7	Confident	72 Å²	72	39.4 Å²	39.4	50%	0.503	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	155.3	168.6	59.6	0	0	0	0	111	C900	C900-S906 WeakPolarHBondContact O-CA 3.03Å
907	A	88.8	Confident	86.8	Confident	5 Å²	5	43.4 Å²	43.4	4%	0.041	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	150.8	169.4	0	0	0	0	0	109.7	I815 I817 V836 S899 C900	I815-A907 HydrophobicContact CB-CB 4.13Å; I815-A907 HydrophobicContact CD1-CB 3.77Å; I815-A907 HydrophobicContact CG2-CB 3.77Å; I817-A907 HydrophobicContact CD1-CB 3.66Å; I817-A907 HydrophobicContact CG1-CB 3.79Å; V836-A907 HydrophobicContact CG1-CB 3.54Å; V836-A907 VanDerWaalsContact CG1-O 3.3Å; V836-A907 WeakPolarHBondContact CG1-O 3.27Å; S899-A907 CarbonylContact C-O 3.6Å; S899-A907 WeakPolarHBondContact CA-O 3.22Å; C900-A907 PolarHBondContact N-O 3.01Å; C900-A907 PolarHBondContact O-N 3.28Å; C900-A907 VanDerWaalsContact O-N 3.1Å
908	E	91.3	Very high	85.6	Confident	71 Å²	71	45.6 Å²	45.6	33%	0.332	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	161.7	-166.4	-45.9	-154.9	124.8	0	0	113.4	V836 G837 H868 V897 S899	V836-E908 VanDerWaalsContact CG1-N 3.34Å; V836-E908 WeakPolarHBondContact CG1-O 3.49Å; G837-E908 VanDerWaalsContact CA-O 3.31Å; G837-E908 WeakPolarHBondContact CA-O 3.46Å; G837-E908 PolarHBondContact N-O 2.76Å; H868-E908 IonicContact CE1-OE1 2.76Å; H868-E908 PolarHBondContact CE1-OE1 3.01Å; H868-E908 IonicContact CE1-OE2 3.18Å; H868-E908 IonicContact ND1-OE1 2.82Å; H868-E908 PolarHBondContact ND1-OE1 2.76Å; V897-E908 HydrophobicContact CG1-CB 3.9Å; V897-E908 HydrophobicContact CG1-CG 4.49Å; S899-E908 WeakPolarHBondContact CB-OE1 3.22Å; S899-E908 PolarHBondContact OG-OE1 2.74Å
909	I	91.4	Very high	84.2	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	130.9	170.9	172.9	164.6	0	0	0	109.2	L834 K835 V836 G838 I850 Y898 I911	L834-I909 HydrophobicContact CB-CD1 4.17Å; L834-I909 HydrophobicContact CD1-CD1 3.94Å; K835-I909 VanDerWaalsContact O-CD1 3.29Å; K835-I909 WeakPolarHBondContact O-CD1 3.49Å; V836-I909 HydrophobicContact CG2-CG2 4.31Å; G838-I909 WeakPolarHBondContact O-CA 3.49Å; I850-I909 HydrophobicContact CD1-CG2 4.17Å; I850-I909 HydrophobicContact CG2-CG2 3.79Å; Y898-I909 PolarHBondContact N-O 3.14Å; Y898-I909 PolarHBondContact O-N 3.35Å; Y898-I909 VanDerWaalsContact O-N 3.11Å; I909-I911 HydrophobicContact CD1-CD1 4.17Å; I909-I911 HydrophobicContact CG1-CD1 4.09Å
910	S	91.1	Very high	83	Confident	41 Å²	41	55.6 Å²	55.6	29%	0.287	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	140.7	171.1	-173.8	0	0	0	0	110.7	G838 A839 G840	G838-S910 PolarHBondContact O-N 3.08Å; A839-S910 CarbonylContact C-O 3.54Å; A839-S910 WeakPolarHBondContact CA-O 3.2Å; G840-S910 PolarHBondContact N-O 3.2Å
911	I	92.4	Very high	81.7	Confident	1 Å²	1	60 Å²	60	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.8	174.3	-58.1	-65.9	0	0	0	109.6	L834 G840 V842 I850 I890 A895 G896 Y898 I909	L834-I911 HydrophobicContact CD1-CD1 3.4Å; G840-I911 WeakPolarHBondContact O-CA 3.35Å; V842-I911 HydrophobicContact CG2-CG2 4.3Å; I850-I911 HydrophobicContact CD1-CD1 4.14Å; I850-I911 HydrophobicContact CD1-CG1 4.17Å; I890-I911 HydrophobicContact CD1-CG2 3.76Å; A895-I911 CarbonylContact C-O 3.49Å; A895-I911 VanDerWaalsContact CA-O 3.26Å; A895-I911 WeakPolarHBondContact CA-O 3.45Å; G896-I911 PolarHBondContact N-O 3.21Å; G896-I911 PolarHBondContact O-N 2.95Å; Y898-I911 HydrophobicContact CD2-CB 4.02Å; Y898-I911 HydrophobicContact CD2-CG1 3.54Å; Y898-I911 HydrophobicContact CE2-CB 4.02Å; Y898-I911 HydrophobicContact CE2-CG1 3.95Å; Y898-I911 HydrophobicContact CG-CG1 4.47Å; I909-I911 HydrophobicContact CD1-CD1 4.17Å; I909-I911 HydrophobicContact CG1-CD1 4.09Å
912	E	89.2	Confident	80.6	Confident	100 Å²	100	64 Å²	64	47%	0.467	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.6	177.1	-72.4	171.3	-153.5	0	0	110	G840 L841 V842	G840-E912 PolarHBondContact O-N 3.01Å; L841-E912 WeakPolarHBondContact CA-O 3.32Å; L841-E912 HydrophobicContact CD1-CB 3.61Å; V842-E912 PolarHBondContact N-O 2.83Å
913	V	90.4	Very high	79.6	Confident	19 Å²	19	69.2 Å²	69.2	12%	0.115	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.3	-175.4	-174.5	0	0	0	0	110.4	V842 F844 I890 F892 A895	V842-V913 HydrophobicContact CG2-CG2 4.3Å; V842-V913 CarbonylContact O-C 3.54Å; V842-V913 VanDerWaalsContact O-CA 3.32Å; V842-V913 WeakPolarHBondContact O-CA 3.49Å; F844-V913 HydrophobicContact CB-CG1 4.26Å; I890-V913 HydrophobicContact CD1-CG2 3.95Å; I890-V913 HydrophobicContact CG1-CG2 4.04Å; F892-V913 HydrophobicContact CD1-CB 4.03Å; F892-V913 HydrophobicContact CD1-CG1 3.9Å; F892-V913 HydrophobicContact CE1-CB 4.48Å; F892-V913 HydrophobicContact CE1-CG1 4.04Å; A895-V913 HydrophobicContact CB-CG2 4.43Å
914	K	85.3	Confident	78.9	Confident	115 Å²	115	67 Å²	67	50%	0.5	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	151.5	174.7	-80	179.7	179.8	176.7	0	112.2	L841 V842 F843 F844	L841-K914 HydrophobicContact CD1-CD 3.8Å; L841-K914 HydrophobicContact CD1-CG 3.89Å; L841-K914 HydrophobicContact CD2-CD 4.11Å; L841-K914 HydrophobicContact CG-CD 4.29Å; V842-K914 PolarHBondContact O-N 2.99Å; F843-K914 CarbonylContact C-O 3.6Å; F843-K914 WeakPolarHBondContact CA-O 3.25Å; F843-K914 HydrophobicContact CD1-CB 4.14Å; F843-K914 HydrophobicContact CE1-CB 4.3Å; F844-K914 PolarHBondContact N-O 2.96Å
915	A	79.8	Confident	78.4	Confident	20 Å²	20	65.4 Å²	65.4	17%	0.165	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.8	152.9	165.5	0	0	0	0	0	110.9	F843 F892 I921 L924	F843-A915 WeakPolarHBondContact CD1-O 3.49Å; F843-A915 VanDerWaalsContact CE1-O 3.3Å; F843-A915 WeakPolarHBondContact CE1-O 3.48Å; F892-A915 HydrophobicContact CZ-CB 4.33Å; A915-I921 HydrophobicContact CB-CG1 3.96Å; A915-L924 HydrophobicContact CB-CD1 3.99Å
916	K	79.6	Confident	77.5	Confident	58 Å²	58	70.9 Å²	70.9	25%	0.252	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-74.9	151.9	173.5	-62.5	-171.6	-169.8	82.5	0	110	P827 F843 F844 G918 Q919	P827-K916 HydrophobicContact CB-CB 4.41Å; P827-K916 HydrophobicContact CB-CD 4.34Å; P827-K916 HydrophobicContact CB-CG 4.3Å; F843-K916 HydrophobicContact CB-CG 4.04Å; F843-K916 HydrophobicContact CD1-CG 4.46Å; F843-K916 HydrophobicContact CG-CG 4.3Å; F844-K916 WeakPolarHBondContact O-CE 3.43Å; F844-K916 PolarHBondContact O-NZ 3.02Å; K916-G918 PolarHBondContact O-N 2.87Å; K916-Q919 HydrophobicContact CB-CG 4.49Å; K916-Q919 PolarHBondContact O-N 2.8Å; K916-Q919 VanDerWaalsContact O-N 3.09Å
917	P	69.8	Low	76.4	Confident	101 Å²	101	72.8 Å²	72.8	66%	0.656	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	125.1	173.5	-24.3	34.4	0	0	0	111.1	P827	P827-P917 HydrophobicContact CG-CG 4.36Å
918	G	66.8	Low	75.2	Confident	90 Å²	90	73.6 Å²	73.6	93%	0.928	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	7	-177.7	0	0	0	0	0	116.2	K916	K916-G918 PolarHBondContact O-N 2.87Å
919	Q	64.9	Low	74	Confident	75 Å²	75	73.4 Å²	73.4	35%	0.35	39%	0.389	S	S	.	.			trans	-117	134.7	169.5	-55.1	-167.6	-86.8	0	0	110	K916 L924	K916-Q919 HydrophobicContact CB-CG 4.49Å; K916-Q919 PolarHBondContact O-N 2.8Å; K916-Q919 VanDerWaalsContact O-N 3.09Å; Q919-L924 HydrophobicContact CB-CD1 4.02Å; Q919-L924 HydrophobicContact CB-CG 4.46Å
920	Q	67.3	Low	72.7	Confident	135 Å²	135	79.8 Å²	79.8	63%	0.631	42%	0.419	S	S	*	.			trans	-78.8	153.5	173.2	-64.2	-173.9	2.4	0	0	110.4	E923 L924	Q920-E923 HydrophobicContact CB-CB 4.48Å; Q920-L924 WeakPolarHBondContact O-CG 3.45Å
921	I	64.1	Low	71.3	Confident	92 Å²	92	84.8 Å²	84.8	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-73.6	-45.8	-176.1	-63.1	171.5	0	0	0	110.3	F892 A915 E923 L924 E925	F892-I921 HydrophobicContact CE2-CG2 4.35Å; F892-I921 HydrophobicContact CZ-CG2 4.31Å; A915-I921 HydrophobicContact CB-CG1 3.96Å; I921-E923 VanDerWaalsContact C-N 3.34Å; I921-E923 PolarHBondContact O-N 2.88Å; I921-L924 WeakPolarHBondContact O-CB 3.31Å; I921-L924 PolarHBondContact O-N 3.06Å; I921-L924 VanDerWaalsContact O-N 3.09Å; I921-E925 HydrophobicContact CG2-CG 4.4Å; I921-E925 PolarHBondContact O-N 3.12Å
922	E	66.4	Low	69.7	Low	147 Å²	147	88.5 Å²	88.5	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-57.4	-43	-178.1	-67.1	152.4	-149.7	0	0	112.6	L924 E925 Q926	E922-L924 VanDerWaalsContact C-N 3.34Å; E922-L924 PolarHBondContact O-N 3.21Å; E922-E925 PolarHBondContact O-N 3.09Å; E922-Q926 PolarHBondContact O-N 2.89Å
923	E	66.9	Low	68.4	Low	108 Å²	108	88.4 Å²	88.4	51%	0.505	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-35.2	177.4	-170	-177.9	-149.5	0	0	112.5	Q920 I921 Q927	Q920-E923 HydrophobicContact CB-CB 4.48Å; I921-E923 VanDerWaalsContact C-N 3.34Å; I921-E923 PolarHBondContact O-N 2.88Å; E923-Q927 WeakPolarHBondContact O-CG 3.47Å; E923-Q927 PolarHBondContact O-N 3.26Å
924	L	65.3	Low	66.8	Low	5 Å²	5	97.9 Å²	97.9	3%	0.026	49%	0.491	C	S	.	.	H	α-helix	trans	-74.3	-34.1	175.8	-70.9	171.4	0	0	0	112.3	F844 F892 A915 Q919 Q920 I921 E922 E928	F844-L924 HydrophobicContact CD1-CD2 4.23Å; F844-L924 HydrophobicContact CE1-CD2 4.1Å; F844-L924 HydrophobicContact CG-CD1 4.49Å; F892-L924 HydrophobicContact CE2-CB 4.1Å; F892-L924 HydrophobicContact CE2-CD1 4.34Å; F892-L924 HydrophobicContact CZ-CD1 4.35Å; A915-L924 HydrophobicContact CB-CD1 3.99Å; Q919-L924 HydrophobicContact CB-CD1 4.02Å; Q919-L924 HydrophobicContact CB-CG 4.46Å; Q920-L924 WeakPolarHBondContact O-CG 3.45Å; I921-L924 WeakPolarHBondContact O-CB 3.31Å; I921-L924 PolarHBondContact O-N 3.06Å; I921-L924 VanDerWaalsContact O-N 3.09Å; E922-L924 VanDerWaalsContact C-N 3.34Å; E922-L924 PolarHBondContact O-N 3.21Å; L924-E928 PolarHBondContact O-N 3.43Å
925	E	65	Low	65.2	Low	96 Å²	96	98.7 Å²	98.7	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-71.9	-38.4	176.4	-68.6	-169.2	153.9	0	0	111.8	F892 I921 E922 E928 T929	F892-E925 HydrophobicContact CD2-CG 4.1Å; F892-E925 HydrophobicContact CE2-CG 4.45Å; I921-E925 HydrophobicContact CG2-CG 4.4Å; I921-E925 PolarHBondContact O-N 3.12Å; E922-E925 PolarHBondContact O-N 3.09Å; E925-E928 PolarHBondContact O-N 2.82Å; E925-T929 PolarHBondContact O-N 3.04Å
926	Q	64.6	Low	63.8	Low	134 Å²	134	104.4 Å²	104.4	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-57.9	-49.2	169.7	-77.8	-175.1	-17.3	0	0	111.4	E922 E928 T929 E930	E922-Q926 PolarHBondContact O-N 2.89Å; Q926-E928 VanDerWaalsContact C-N 3.29Å; Q926-E928 PolarHBondContact O-N 3.14Å; Q926-T929 PolarHBondContact O-N 2.99Å; Q926-T929 PolarHBondContact O-OG1 3.26Å; Q926-E930 PolarHBondContact O-N 3.11Å
927	Q	64.6	Low	62.4	Low	111 Å²	111	106.3 Å²	106.3	52%	0.519	54%	0.538	S	S	.	.	H	α-helix	trans	-60	-33.3	175.4	-73.9	-174.2	6.5	0	0	113.7	E923 R931	E923-Q927 WeakPolarHBondContact O-CG 3.47Å; E923-Q927 PolarHBondContact O-N 3.26Å; Q927-R931 VanDerWaalsContact O-CB 3.25Å; Q927-R931 WeakPolarHBondContact O-CB 3.33Å; Q927-R931 PolarHBondContact O-N 2.93Å
928	E	63.8	Low	61.4	Low	23 Å²	23	104.6 Å²	104.6	11%	0.107	54%	0.539	C	S	.	.	H	α-helix	trans	-68.2	-37.4	172.9	-170.1	169.2	-172.4	0	0	111.5	T891 R893 L924 E925 Q926 L932	T891-E928 WeakPolarHBondContact CB-OE1 3.34Å; T891-E928 WeakPolarHBondContact CB-OE2 3.3Å; T891-E928 WeakPolarHBondContact CG2-OE1 3.19Å; T891-E928 PolarHBondContact OG1-OE1 3.22Å; R893-E928 WeakPolarHBondContact CD-OE1 3.48Å; R893-E928 IonicContact NE-OE1 2.84Å; L924-E928 PolarHBondContact O-N 3.43Å; E925-E928 PolarHBondContact O-N 2.82Å; Q926-E928 VanDerWaalsContact C-N 3.29Å; Q926-E928 PolarHBondContact O-N 3.14Å; E928-L932 HydrophobicContact CG-CD1 4.38Å; E928-L932 WeakPolarHBondContact O-CD1 3.47Å; E928-L932 VanDerWaalsContact O-CG 3.3Å; E928-L932 WeakPolarHBondContact O-CG 3.11Å; E928-L932 PolarHBondContact O-N 2.87Å
929	T	65.3	Low	60.6	Low	67 Å²	67	105.2 Å²	105.2	41%	0.411	53%	0.525	S	S	.	.	H	α-helix	trans	-68.9	-46.5	177	59.9	0	0	0	0	113.6	E925 Q926 R931 L932 V933	E925-T929 PolarHBondContact O-N 3.04Å; Q926-T929 PolarHBondContact O-N 2.99Å; Q926-T929 PolarHBondContact O-OG1 3.26Å; T929-R931 VanDerWaalsContact C-N 3.31Å; T929-R931 PolarHBondContact O-N 3.09Å; T929-L932 PolarHBondContact O-N 2.82Å; T929-L932 VanDerWaalsContact O-N 3.17Å; T929-V933 PolarHBondContact O-N 2.8Å; T929-V933 VanDerWaalsContact O-N 3.14Å
930	E	64.1	Low	59.5	Low	138 Å²	138	109.1 Å²	109.1	65%	0.645	54%	0.543	S	S	*	.	H	α-helix	trans	-60.9	-40.9	178.2	-67.2	-175.1	155.8	0	0	112.1	Q926 L932 V933 R934	Q926-E930 PolarHBondContact O-N 3.11Å; E930-L932 VanDerWaalsContact C-N 3.28Å; E930-L932 PolarHBondContact O-N 2.97Å; E930-V933 PolarHBondContact O-N 2.86Å; E930-R934 PolarHBondContact O-N 3.36Å; E930-R934 VanDerWaalsContact O-N 3.13Å
931	R	60.8	Low	58.3	Low	145 Å²	145	106.4 Å²	106.4	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-62.5	-34.3	178.2	-170.9	175.2	-179.6	-166.6	-1.5	112.1	D889 Q927 T929 E935	D889-R931 IonicContact OD2-CZ 3.37Å; D889-R931 IonicContact OD2-NH1 3.65Å; D889-R931 PolarHBondContact OD2-NH1 2.95Å; D889-R931 IonicContact OD2-NH2 2.7Å; D889-R931 PolarHBondContact OD2-NH2 2.95Å; Q927-R931 VanDerWaalsContact O-CB 3.25Å; Q927-R931 WeakPolarHBondContact O-CB 3.33Å; Q927-R931 PolarHBondContact O-N 2.93Å; T929-R931 VanDerWaalsContact C-N 3.31Å; T929-R931 PolarHBondContact O-N 3.09Å; R931-E935 PolarHBondContact O-N 2.85Å
932	L	59	Low	57.2	Low	79 Å²	79	110.4 Å²	110.4	41%	0.414	57%	0.565	S	S	.	*	H	α-helix	trans	-73.9	-39.3	176.6	-72.8	167.1	0	0	0	112.8	E928 T929 E930 R934 E935 K936	E928-L932 HydrophobicContact CG-CD1 4.38Å; E928-L932 WeakPolarHBondContact O-CD1 3.47Å; E928-L932 VanDerWaalsContact O-CG 3.3Å; E928-L932 WeakPolarHBondContact O-CG 3.11Å; E928-L932 PolarHBondContact O-N 2.87Å; T929-L932 PolarHBondContact O-N 2.82Å; T929-L932 VanDerWaalsContact O-N 3.17Å; E930-L932 VanDerWaalsContact C-N 3.28Å; E930-L932 PolarHBondContact O-N 2.97Å; L932-R934 VanDerWaalsContact C-N 3.27Å; L932-R934 PolarHBondContact O-N 2.72Å; L932-E935 PolarHBondContact O-N 2.82Å; L932-K936 PolarHBondContact O-N 3.43Å; L932-K936 VanDerWaalsContact O-N 3.15Å
933	V	62.6	Low	55.7	Low	99 Å²	99	109.5 Å²	109.5	60%	0.6	57%	0.57	S	S	*	*	H	α-helix	trans	-58.3	-44	173.5	174.8	0	0	0	0	110.1	T929 E930 E935 K936 S937	T929-V933 PolarHBondContact O-N 2.8Å; T929-V933 VanDerWaalsContact O-N 3.14Å; E930-V933 PolarHBondContact O-N 2.86Å; V933-E935 PolarHBondContact O-N 3.34Å; V933-K936 PolarHBondContact O-N 2.81Å; V933-S937 PolarHBondContact O-N 2.91Å; V933-S937 PolarHBondContact O-OG 2.87Å
934	R	56.7	Low	54	Low	217 Å²	217	110.5 Å²	110.5	82%	0.819	59%	0.589	S	S	*	*	H	α-helix	trans	-69.3	-27.4	-178.9	-161.4	170.7	-171.6	155.7	4.2	114.7	E930 L932	E930-R934 PolarHBondContact O-N 3.36Å; E930-R934 VanDerWaalsContact O-N 3.13Å; L932-R934 VanDerWaalsContact C-N 3.27Å; L932-R934 PolarHBondContact O-N 2.72Å
935	E	52.9	Low	52.4	Low	132 Å²	132	114.3 Å²	114.3	62%	0.617	62%	0.621	S	S	*	*	H	α-helix	trans	-75.8	-34.3	170.6	-75.5	-162.3	137.3	0	0	112.1	R931 L932 V933 G938	R931-E935 PolarHBondContact O-N 2.85Å; L932-E935 PolarHBondContact O-N 2.82Å; V933-E935 PolarHBondContact O-N 3.34Å; E935-G938 PolarHBondContact O-N 2.72Å
936	K	50.1	Low	50.8	Low	141 Å²	141	117 Å²	117	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-68.8	-35.9	-179.1	-157.1	-171.7	179.7	-155.5	0	113	L932 V933 G938 T939	L932-K936 PolarHBondContact O-N 3.43Å; L932-K936 VanDerWaalsContact O-N 3.15Å; V933-K936 PolarHBondContact O-N 2.81Å; K936-G938 PolarHBondContact O-N 3.46Å; K936-G938 VanDerWaalsContact O-N 3.1Å; K936-T939 PolarHBondContact O-N 3.31Å; K936-T939 PolarHBondContact O-OG1 2.9Å; K936-T939 VanDerWaalsContact O-OG1 3.04Å
937	S	48.8	Very low	49.2	Very low	97 Å²	97	118.2 Å²	118.2	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-9.7	175.9	-52	0	0	0	0	114.6	V933	V933-S937 PolarHBondContact O-N 2.91Å; V933-S937 PolarHBondContact O-OG 2.87Å
938	G	49.7	Very low	47.7	Very low	65 Å²	65	121.6 Å²	121.6	67%	0.67	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	5	-178.5	0	0	0	0	0	115.4	E935 K936	E935-G938 PolarHBondContact O-N 2.72Å; K936-G938 PolarHBondContact O-N 3.46Å; K936-G938 VanDerWaalsContact O-N 3.1Å
939	T	50.6	Low	46.1	Very low	103 Å²	103	125.4 Å²	125.4	63%	0.632	69%	0.689	S	S	*	*	S	Bend	trans	-125.7	2.7	-170.2	47.7	0	0	0	0	115.7	K936	K936-T939 PolarHBondContact O-N 3.31Å; K936-T939 PolarHBondContact O-OG1 2.9Å; K936-T939 VanDerWaalsContact O-OG1 3.04Å
940	E	40.1	Very low	44.4	Very low	157 Å²	157	127.1 Å²	127.1	73%	0.734	71%	0.709	S	S	*	*	S	Bend	trans	-104.1	26.5	180	-68.5	173.7	-171.9	0	0	112.3
941	A	43.1	Very low	42.8	Very low	79 Å²	79	128.4 Å²	128.4	65%	0.653	72%	0.72	S	S	*	*	S	Bend	trans	-129.3	146.7	163.5	0	0	0	0	0	109.2
942	L	40.8	Very low	41.3	Very low	176 Å²	176	124.3 Å²	124.3	92%	0.921	72%	0.723	S	S	*	*	S	Bend	trans	83.3	41.7	-175.7	-50.4	174.6	0	0	0	117.6
943	T	34.4	Very low	40	Very low	127 Å²	127	127.8 Å²	127.8	78%	0.779	75%	0.748	S	S	*	*			trans	-143.1	136.8	149.9	47.1	0	0	0	0	110.7
944	S	32.9	Very low	38.4	Very low	129 Å²	129	126.1 Å²	126.1	90%	0.902	75%	0.751	S	S	*	*			trans	81.2	136.1	-163.8	-36.8	0	0	0	0	113
945	A	31.2	Very low	37.1	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	75%	0.751	S	S	*	*			cis	-112	-164.4	-0.1	0	0	0	0	0	110.4
946	D	30.8	Very low	35.9	Very low	152 Å²	152	121.2 Å²	121.2	81%	0.813	76%	0.759	S	S	*	*			cis	-149.4	152.1	26.8	-83.7	-64.3	0	0	0	113.7
947	M	30.9	Very low	34.9	Very low	159 Å²	159	121 Å²	121	78%	0.783	77%	0.77	S	S	*	*			trans	-172.6	98.1	136.2	-99.4	-64.6	-178.8	0	0	110.9
948	K	33.3	Very low	34	Very low	182 Å²	182	120.5 Å²	120.5	79%	0.791	77%	0.771	S	S	*	*			trans	53.2	148	143	-58.7	-176.6	-178.7	-175.8	0	121.4
949	S	30.1	Very low	33	Very low	104 Å²	104	124.1 Å²	124.1	73%	0.727	78%	0.78	S	S	*	*			cis	-173.1	149.7	-15.4	-95.4	0	0	0	0	110.3
950	A	30.2	Very low	31.8	Very low	102 Å²	102	122.1 Å²	122.1	84%	0.843	78%	0.781	S	S	*	*			trans	66.7	154	158.4	0	0	0	0	0	119.7
951	D	29.4	Very low	32.3	Very low	165 Å²	165	120.1 Å²	120.1	88%	0.882	78%	0.781	S	S	*	*			cis	-161.7	157.7	-36.3	-163.9	12.6	0	0	0	110.6
952	G	30.8	Very low	31.8	Very low	59 Å²	59	123.2 Å²	123.2	61%	0.608	79%	0.787	S	S	*	*			trans	75.9	151.3	172.5	0	0	0	0	0	116.3
953	T	31.4	Very low	31.4	Very low	152 Å²	152	118.7 Å²	118.7	93%	0.933	77%	0.769	S	S	*	*			cis	-150.2	157.9	-13.8	47.2	0	0	0	0	107.7
954	G	28.8	Very low	31.3	Very low	64 Å²	64	121.2 Å²	121.2	66%	0.66	77%	0.772	S	S	*	*			cis	179.8	-161.6	-2.4	0	0	0	0	0	112.6
955	T	28.5	Very low	31.2	Very low	135 Å²	135	121.1 Å²	121.1	83%	0.828	77%	0.766	S	S	*	*			trans	63.9	111.5	164.8	42.1	0	0	0	0	122.7
956	S	28.2	Very low	31.2	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	77%	0.772	S	S	*	*			trans	71.3	147.7	139	76.7	0	0	0	0	119.7
957	T	29	Very low	31.2	Very low	136 Å²	136	121.2 Å²	121.2	83%	0.834	77%	0.773	S	S	*	*			cis	-144.7	170.8	8.8	-31.5	0	0	0	0	112.3
958	A	28.8	Very low	31.3	Very low	86 Å²	86	119.8 Å²	119.8	71%	0.711	78%	0.779	S	S	*	*			trans	-63.5	174.8	-180	0	0	0	0	0	114.4
959	V	29.5	Very low	31.2	Very low	141 Å²	141	116.3 Å²	116.3	86%	0.855	78%	0.784	S	S	*	*				-162.6	143.1	58.8	166.2	0	0	0	0	112.3
960	G	26.7	Very low	31.5	Very low	62 Å²	62	119.3 Å²	119.3	64%	0.639	79%	0.787	S	S	*	*			trans	-112.8	-157.7	163.7	0	0	0	0	0	111.8
961	P	49.8	Very low	31.7	Very low	114 Å²	114	122 Å²	122	74%	0.74	78%	0.782	S	S	*	*			cis	-142.7	-164.2	15.7	42	-21.4	0	0	0	116.1
962	N	32.4	Very low	32	Very low	145 Å²	145	123.2 Å²	123.2	78%	0.775	78%	0.782	S	S	*	*			trans	125.6	149.5	150.5	-68.8	-57.8	0	0	0	115.6
963	S	31.7	Very low	32.1	Very low	80 Å²	80	123.5 Å²	123.5	56%	0.559	79%	0.785	S	S	*	*			cis	-176.1	145.5	-22.3	57.9	0	0	0	0	112.7
964	H	32.5	Very low	32.4	Very low	180 Å²	180	121 Å²	121	83%	0.833	77%	0.774	S	S	*	*			trans	65.6	164.5	155.5	-56.9	-45.3	0	0	0	118.2
965	V	31.2	Very low	32.8	Very low	127 Å²	127	126 Å²	126	77%	0.77	77%	0.773	S	S	*	*			cis	-151.1	170.9	-8.2	106.6	0	0	0	0	112.4
966	N	31.1	Very low	33.4	Very low	159 Å²	159	130.1 Å²	130.1	85%	0.85	77%	0.773	S	S	*	*			trans	-62.9	164.5	178.1	-51.7	-19.2	0	0	0	117.3
967	G	30	Very low	34	Very low	81 Å²	81	134 Å²	134	84%	0.835	77%	0.77	S	S	*	*			trans	160.9	149	154.1	0	0	0	0	0	117.2
968	S	33.9	Very low	34.5	Very low	130 Å²	130	133.3 Å²	133.3	91%	0.909	76%	0.758	S	S	*	*			trans	-147	149.9	-175.8	57.8	0	0	0	0	115.4
969	A	31.7	Very low	34.9	Very low	108 Å²	108	137.1 Å²	137.1	89%	0.893	76%	0.761	S	S	*	*			trans	-149.7	173.4	-176.9	0	0	0	0	0	114.9
970	Q	35.6	Very low	35	Very low	168 Å²	168	139.1 Å²	139.1	79%	0.785	76%	0.761	S	S	*	*			trans	-161.6	168.1	-166	-159.8	-169.6	90.6	0	0	115.6
971	Q	35.6	Very low	35.3	Very low	159 Å²	159	141 Å²	141	74%	0.743	76%	0.764	S	S	*	*			trans	107.6	164.9	151.1	-60.3	-160.4	-1.4	0	0	124
972	H	35.6	Very low	34.6	Very low	189 Å²	189	144.6 Å²	144.6	88%	0.875	77%	0.771	S	S	*	*			trans	-85.5	-173.6	-163.8	-55.8	-98	0	0	0	115
973	G	32.8	Very low	34.5	Very low	66 Å²	66	149.7 Å²	149.7	68%	0.68	78%	0.779	S	S	*	*			cis	153.4	152.7	-14.2	0	0	0	0	0	115.9
974	S	36.4	Very low	34.8	Very low	98 Å²	98	152.8 Å²	152.8	69%	0.685	79%	0.789	S	S	*	*			trans	75.7	167.7	159.9	-61.2	0	0	0	0	122
975	R	37.4	Very low	34.9	Very low	170 Å²	170	151.4 Å²	151.4	64%	0.642	78%	0.783	S	S	*	*			cis	-169.6	150	-30.7	-89.7	161.4	-157.6	-163.8	4.4	110.2	D997 G998	R975-D997 IonicContact NH2-OD2 2.82Å; R975-D997 PolarHBondContact NH2-OD2 2.96Å; R975-G998 PolarHBondContact NH1-O 3.16Å; R975-G998 VanDerWaalsContact NH1-O 3.14Å
976	R	41	Very low	35.1	Very low	222 Å²	222	153 Å²	153	84%	0.838	79%	0.787	S	S	*	*			trans	104.1	130.7	145.3	-133.9	-176.6	-160.2	-178.9	7	126.6
977	R	41.9	Very low	35.2	Very low	193 Å²	193	149.2 Å²	149.2	73%	0.728	79%	0.785	S	S	*	*			trans	70.2	155.8	144.2	-100.2	177.1	174	-162.4	3.8	122.9
978	Q	38.5	Very low	35.4	Very low	122 Å²	122	156.5 Å²	156.5	57%	0.57	79%	0.788	S	S	*	*			cis	-156.8	137.4	-1.3	-166.6	160.4	-27.7	0	0	116.7
979	Q	38.4	Very low	35.1	Very low	165 Å²	165	157.7 Å²	157.7	77%	0.771	78%	0.779	S	S	*	*			trans	40.6	119.2	153.5	-68.3	172.5	-56	0	0	127.1
980	Q	30.3	Very low	35.1	Very low	184 Å²	184	164.4 Å²	164.4	86%	0.86	78%	0.781	S	S	*	*				-168	167.2	129.7	-101.4	-149	37.1	0	0	108.6
981	S	34.2	Very low	34.7	Very low	100 Å²	100	161.1 Å²	161.1	70%	0.699	78%	0.777	S	S	*	*			cis	-163	-173.6	-21.1	47.2	0	0	0	0	109.6
982	E	33.3	Very low	34.6	Very low	191 Å²	191	164.2 Å²	164.2	89%	0.893	78%	0.782	S	S	*	*			trans	-106.7	146.3	-163.2	-61.7	-175.8	105.3	0	0	118.2
983	R	30.3	Very low	34.1	Very low	252 Å²	252	166.4 Å²	166.4	95%	0.951	78%	0.782	S	S	*	*			trans	-160.8	157.1	133.1	-114.9	179.8	-174.3	-168.4	1.9	112.7
984	L	38.3	Very low	34.8	Very low	145 Å²	145	169.2 Å²	169.2	76%	0.759	79%	0.788	S	S	*	*			trans	-73.1	161.4	-173.4	-61.4	166.2	0	0	0	112.9
985	Q	36.4	Very low	35	Very low	151 Å²	151	173.9 Å²	173.9	71%	0.706	80%	0.796	S	S	*	*			cis	-159.5	148.6	8.7	-134.8	153.3	7.4	0	0	112.8
986	N	35.3	Very low	35.6	Very low	160 Å²	160	170.7 Å²	170.7	86%	0.856	80%	0.8	S	S	*	*			trans	18.6	145.3	155.1	-53.9	-11.2	0	0	0	121.8
987	G	32.5	Very low	35.1	Very low	79 Å²	79	166.8 Å²	166.8	81%	0.814	80%	0.796	S	S	*	*			cis	171.5	168.6	3.4	0	0	0	0	0	108.4
988	R	33.1	Very low	34.9	Very low	234 Å²	234	159.6 Å²	159.6	88%	0.883	78%	0.781	S	S	*	*			cis	-152.7	172	16.4	-165.7	163	-169.7	168.8	5.2	110.4
989	E	28.7	Very low	34.6	Very low	155 Å²	155	160.2 Å²	160.2	72%	0.724	79%	0.794	S	S	*	*			trans	-57.3	151	-162.5	-62.4	98.1	145.1	0	0	117.5
990	R	32.2	Very low	34.3	Very low	250 Å²	250	159.9 Å²	159.9	94%	0.943	79%	0.792	S	S	*	*			cis	99.8	156.3	19.2	-153	173.7	-160.9	-137.4	6.1	115.3
991	S	27.5	Very low	34.3	Very low	99 Å²	99	159 Å²	159	69%	0.692	79%	0.787	S	S	*	*			trans	-159	154.7	-162.4	-161.3	0	0	0	0	115.2
992	R	33.2	Very low	33.8	Very low	224 Å²	224	158.7 Å²	158.7	85%	0.845	79%	0.791	S	S	*	*			trans	80.5	131.3	156.9	-71.9	164.9	179.3	-166.2	-2.4	123.1
993	R	25.2	Very low	33.3	Very low	235 Å²	235	156.7 Å²	156.7	89%	0.887	79%	0.786	S	S	*	*			trans	70.3	161.7	149.3	-69.2	175.3	171.2	-174.1	-5.1	118.5
994	P	46	Very low	33.2	Very low	124 Å²	124	149.1 Å²	149.1	81%	0.805	77%	0.772	S	S	*	*			cis	-133.8	-172.3	-46.1	39.9	-22.6	0	0	0	113.8
995	K	41.4	Very low	32.7	Very low	197 Å²	197	147.3 Å²	147.3	86%	0.857	77%	0.771	S	S	*	*			trans	-66.2	164.2	175.4	-82.1	-171.9	176.8	-173.3	0	114.1
996	S	50.2	Low	32.3	Very low	102 Å²	102	148.2 Å²	148.2	71%	0.713	78%	0.779	S	S	*	*			cis	-175.2	165.8	-13.4	49.2	0	0	0	0	110.2
997	D	29.8	Very low	32.2	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	77%	0.772	S	S	*	*			trans	-171.2	156.9	157.8	-120.9	-0.4	0	0	0	113.6	R975	R975-D997 IonicContact NH2-OD2 2.82Å; R975-D997 PolarHBondContact NH2-OD2 2.96Å
998	G	37.4	Very low	32.3	Very low	42 Å²	42	151.3 Å²	151.3	43%	0.433	77%	0.769	S	S	.	*			trans	-97.1	-159.8	179.3	0	0	0	0	0	115.7	R975	R975-G998 PolarHBondContact NH1-O 3.16Å; R975-G998 VanDerWaalsContact NH1-O 3.14Å
999	V	33.7	Very low	32.1	Very low	136 Å²	136	147 Å²	147	82%	0.824	76%	0.764	S	S	*	*			cis	-154.9	151.6	10.3	-163.2	0	0	0	0	106.9
1000	Q	30.8	Very low	32.1	Very low	158 Å²	158	146 Å²	146	74%	0.738	76%	0.763	S	S	*	*				165.7	144.3	96.1	-96.9	-173.2	-38.7	0	0	114.5
1001	H	30.1	Very low	32.1	Very low	164 Å²	164	141.2 Å²	141.2	76%	0.759	76%	0.756	S	S	*	*			trans	51.3	151.4	146.4	-61	-61	0	0	0	125.9
1002	A	25.1	Very low	32.3	Very low	94 Å²	94	140.4 Å²	140.4	78%	0.777	75%	0.75	S	S	*	*			trans	72.3	148.9	154.7	0	0	0	0	0	118.9
1003	D	22.7	Very low	32.4	Very low	149 Å²	149	137.7 Å²	137.7	80%	0.797	75%	0.747	S	S	*	*			cis	-167.7	169.9	-34.3	-143.4	-38.8	0	0	0	108
1004	S	26.8	Very low	32.6	Very low	93 Å²	93	134.4 Å²	134.4	65%	0.65	75%	0.746	S	S	*	*			trans	56	125.5	167.6	59.6	0	0	0	0	117.9
1005	S	28.4	Very low	31.7	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	74%	0.744	S	S	*	*				63.6	119.3	52.2	82.6	0	0	0	0	115.4
1006	I	27.9	Very low	31.1	Very low	170 Å²	170	133.5 Å²	133.5	87%	0.872	74%	0.743	S	S	*	*			trans	-160.1	144.6	145.8	-105.5	155.4	0	0	0	107.7
1007	M	33.3	Very low	30.1	Very low	144 Å²	144	133 Å²	133	71%	0.709	74%	0.739	S	S	*	*			trans	-121.8	169.2	178.8	-61	-144.1	-51.6	0	0	110.8
1008	E	34.4	Very low	30.1	Very low	160 Å²	160	134.8 Å²	134.8	75%	0.748	74%	0.743	S	S	*	*			trans	66.1	159.4	163.1	-72.3	137.4	171.3	0	0	115.1
1009	D	29.8	Very low	29.5	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	75%	0.751	S	S	*	*			cis	-151.9	-173.8	20.3	-141.9	-29.5	0	0	0	113.6
1010	D	29.1	Very low	29.1	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	75%	0.749	S	S	*	*			trans	73.9	98.1	153.3	-93.3	-40.7	0	0	0	123.7
1011	L	31.5	Very low	29	Very low	151 Å²	151	141.4 Å²	141.4	79%	0.791	75%	0.752	S	S	*	*				48.3	138.1	113	-139.4	79.2	0	0	0	125.5
1012	S	32.2	Very low	29.6	Very low	82 Å²	82	138.5 Å²	138.5	57%	0.573	75%	0.748	S	S	*	*			trans	90.4	116.2	141.7	-86.3	0	0	0	0	124.8
1013	Q	34.5	Very low	29.6	Very low	166 Å²	166	142.7 Å²	142.7	78%	0.776	75%	0.751	S	S	*	*			trans	66.9	126.2	131.3	-60.4	178.4	45.8	0	0	123.4
1014	L	29.2	Very low	30.6	Very low	166 Å²	166	141 Å²	141	87%	0.869	75%	0.749	S	S	*	*				-169.8	179.6	100.7	-99.4	167.7	0	0	0	112.5
1015	V	28.2	Very low	30.6	Very low	126 Å²	126	140.6 Å²	140.6	76%	0.764	75%	0.751	S	S	*	*			trans	-135.5	158.4	-153.2	-178.3	0	0	0	0	114.6
1016	Q	27.6	Very low	30.5	Very low	176 Å²	176	141 Å²	141	82%	0.822	75%	0.753	S	S	*	*			trans	122.9	134.6	164.8	-68.7	167.3	2.2	0	0	112.7
1017	S	30.3	Very low	30.5	Very low	91 Å²	91	137.6 Å²	137.6	64%	0.636	75%	0.75	S	S	*	*			cis	88.2	142.9	24.4	89.3	0	0	0	0	114.1
1018	E	28.2	Very low	30.1	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	75%	0.751	S	S	*	*			cis	-156.1	178	10.5	-100.1	137.5	95.8	0	0	108.4
1019	D	26.4	Very low	29.9	Very low	113 Å²	113	133.3 Å²	133.3	60%	0.604	75%	0.752	S	S	*	*			cis	-171.1	163.8	-23.7	179	27.1	0	0	0	108.9
1020	R	24.5	Very low	29.7	Very low	204 Å²	204	130.6 Å²	130.6	77%	0.77	76%	0.759	S	S	*	*			trans	64.6	129.6	168.1	-66.4	152.9	-160.7	-147.4	-0.6	119.4
1021	I	27.9	Very low	29.6	Very low	157 Å²	157	128.1 Å²	128.1	81%	0.805	77%	0.765	S	S	*	*				57.4	135.3	61.9	-58.9	-179.2	0	0	0	113.2
1022	P	42.6	Very low	29.5	Very low	103 Å²	103	126.6 Å²	126.6	67%	0.669	77%	0.767	S	S	*	*			cis	-139.2	169.1	-9.4	39.4	-21	0	0	0	118.3
1023	Q	26.5	Very low	29.5	Very low	183 Å²	183	134.2 Å²	134.2	86%	0.855	78%	0.783	S	S	*	*			trans	57	177.8	143.2	-77.1	-171.4	26	0	0	121.1
1024	P	43.3	Very low	29.3	Very low	114 Å²	114	133 Å²	133	74%	0.74	79%	0.787	S	S	*	*			cis	-128	-166.5	-11.9	31.9	-10	0	0	0	115.3
1025	A	25.9	Very low	29.4	Very low	84 Å²	84	136.6 Å²	136.6	69%	0.694	79%	0.789	S	S	*	*			trans	87.4	87.4	146.7	0	0	0	0	0	122.8
1026	S	26.7	Very low	29.5	Very low	114 Å²	114	137 Å²	137	80%	0.797	79%	0.792	S	S	*	*				39.4	146.2	119.7	62.6	0	0	0	0	124.9
1027	A	27.7	Very low	29.7	Very low	99 Å²	99	135.7 Å²	135.7	82%	0.818	79%	0.79	S	S	*	*			trans	76.6	146.3	159.7	0	0	0	0	0	117.5
1028	S	26.6	Very low	29.7	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	80%	0.801	S	S	*	*			cis	-164	166.4	-10.6	48.7	0	0	0	0	112.7
1029	S	28.4	Very low	29.8	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	80%	0.8	S	S	*	*			trans	59.2	111	147.4	67	0	0	0	0	122.5
1030	G	25.6	Very low	29.9	Very low	87 Å²	87	137 Å²	137	90%	0.897	81%	0.805	S	S	*	*				90.4	164.9	124	0	0	0	0	0	119.9
1031	G	27.6	Very low	30.3	Very low	82 Å²	82	131.9 Å²	131.9	85%	0.845	80%	0.799	S	S	*	*			trans	114.6	94.6	168	0	0	0	0	0	115.6
1032	S	29.2	Very low	30.5	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	80%	0.796	S	S	*	*			trans	-81.1	124.3	168.4	175.4	0	0	0	0	111.3
1033	R	33.4	Very low	30.3	Very low	242 Å²	242	134.8 Å²	134.8	91%	0.913	79%	0.791	S	S	*	*				-176.7	147.7	127.5	-100.6	160.1	-178.5	-172	-0.1	113.7
1034	T	29.4	Very low	30.6	Very low	140 Å²	140	133.3 Å²	133.3	86%	0.859	78%	0.784	S	S	*	*			trans	-81.2	122.4	-178.4	43.3	0	0	0	0	112.9
1035	R	31.9	Very low	30.1	Very low	241 Å²	241	131.4 Å²	131.4	91%	0.909	78%	0.778	S	S	*	*			trans	-156.2	89.3	151.5	-147.6	172.2	-173.8	179.2	0.4	112.9
1036	T	29.8	Very low	30.5	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	78%	0.783	S	S	*	*			trans	-78.5	132.2	179.2	-43.7	0	0	0	0	111.9
1037	L	32.2	Very low	30.7	Very low	149 Å²	149	133.7 Å²	133.7	78%	0.78	77%	0.769	S	S	*	*			trans	-146.6	145.7	160.7	-91.8	-178.5	0	0	0	110.4
1038	L	30.8	Very low	30.5	Very low	165 Å²	165	131.9 Å²	131.9	86%	0.864	75%	0.75	S	S	*	*			trans	63	74.3	159.7	-59.7	169	0	0	0	118.6
1039	A	30.5	Very low	30.8	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	74%	0.744	S	S	*	*			trans	-158.1	107.4	138	0	0	0	0	0	110.9
1040	M	27.1	Very low	31.2	Very low	144 Å²	144	134.7 Å²	134.7	71%	0.709	75%	0.747	S	S	*	*			trans	-161.5	144	174.8	-97.7	-78.1	-154.9	0	0	107.1	F1043	M1040-F1043 HydrophobicContact CE-CB 3.73Å; M1040-F1043 HydrophobicContact CE-CD1 4.37Å; M1040-F1043 HydrophobicContact CE-CG 4.27Å; M1040-F1043 HydrophobicContact SD-CB 3.68Å
1041	P	34.3	Very low	31.1	Very low	98 Å²	98	137.5 Å²	137.5	64%	0.636	74%	0.737	S	S	*	*	S	Bend	cis	-129.7	126.9	11.6	36	-17.6	0	0	0	115.2
1042	Y	31.2	Very low	31.2	Very low	192 Å²	192	139.7 Å²	139.7	75%	0.753	73%	0.729	S	S	*	*	S	Bend	trans	-120.6	1.3	140.1	-127.2	-94.3	0	0	0	113.2	Q1044 A1045	Y1042-Q1044 PolarHBondContact O-N 2.89Å; Y1042-A1045 HydrophobicContact CD1-CB 4.01Å; Y1042-A1045 HydrophobicContact CE1-CB 3.61Å; Y1042-A1045 PolarHBondContact O-N 2.83Å
1043	F	37.9	Very low	31.2	Very low	128 Å²	128	141.8 Å²	141.8	56%	0.561	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	41.3	163.2	-148.5	-86.6	0	0	0	111.7	M1040 L1047	M1040-F1043 HydrophobicContact CE-CB 3.73Å; M1040-F1043 HydrophobicContact CE-CD1 4.37Å; M1040-F1043 HydrophobicContact CE-CG 4.27Å; M1040-F1043 HydrophobicContact SD-CB 3.68Å; F1043-L1047 WeakPolarHBondContact CD1-O 3.11Å; F1043-L1047 HydrophobicContact CE1-CB 4.01Å; F1043-L1047 WeakPolarHBondContact CE1-O 3.36Å; F1043-L1047 HydrophobicContact CE2-CB 4.07Å; F1043-L1047 HydrophobicContact CE2-CD1 4.27Å; F1043-L1047 HydrophobicContact CZ-CB 3.76Å; F1043-L1047 HydrophobicContact CZ-CD1 4.13Å
1044	Q	33.5	Very low	31	Very low	152 Å²	152	141 Å²	141	71%	0.71	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.2	25.6	161.7	-135.8	172.5	-7.7	0	0	114.4	Y1042	Y1042-Q1044 PolarHBondContact O-N 2.89Å
1045	A	32.1	Very low	31.3	Very low	74 Å²	74	138.2 Å²	138.2	61%	0.612	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	-25	158.3	0	0	0	0	0	112.5	Y1042	Y1042-A1045 HydrophobicContact CD1-CB 4.01Å; Y1042-A1045 HydrophobicContact CE1-CB 3.61Å; Y1042-A1045 PolarHBondContact O-N 2.83Å
1046	L	35.2	Very low	31.1	Very low	151 Å²	151	133.9 Å²	133.9	79%	0.791	71%	0.705	S	S	*	*	S	Bend	trans	-129.4	23.1	-177.2	-135.4	152.4	0	0	0	113.9
1047	L	30.4	Very low	31.1	Very low	95 Å²	95	136.3 Å²	136.3	50%	0.497	71%	0.708	S	S	.	*			trans	-172.6	99.6	150.6	-109.3	170.7	0	0	0	111.2	F1043	F1043-L1047 WeakPolarHBondContact CD1-O 3.11Å; F1043-L1047 HydrophobicContact CE1-CB 4.01Å; F1043-L1047 WeakPolarHBondContact CE1-O 3.36Å; F1043-L1047 HydrophobicContact CE2-CB 4.07Å; F1043-L1047 HydrophobicContact CE2-CD1 4.27Å; F1043-L1047 HydrophobicContact CZ-CB 3.76Å; F1043-L1047 HydrophobicContact CZ-CD1 4.13Å
1048	S	24.3	Very low	30.8	Very low	62 Å²	62	139.1 Å²	139.1	43%	0.434	71%	0.708	S	S	.	*			trans	-148.8	100.9	155.6	68.4	0	0	0	0	110.9
1049	N	31.7	Very low	30.4	Very low	113 Å²	113	139.8 Å²	139.8	60%	0.604	70%	0.704	S	S	*	*			trans	68.2	127	177.6	-37.1	-74.1	0	0	0	113.7	Q1051	N1049-Q1051 HydrophobicContact CB-CB 4.19Å
1050	L	36.9	Very low	30.2	Very low	159 Å²	159	142.2 Å²	142.2	83%	0.832	70%	0.696	S	S	*	*			cis	59.6	49.2	7.2	-136.5	178.6	0	0	0	114.2
1051	Q	24.4	Very low	30.2	Very low	147 Å²	147	140.8 Å²	140.8	69%	0.687	69%	0.691	S	S	*	*			trans	-167.2	134.2	162.5	-100.7	155.7	59.7	0	0	106.3	N1049	N1049-Q1051 HydrophobicContact CB-CB 4.19Å
1052	L	28.5	Very low	29.9	Very low	128 Å²	128	140.6 Å²	140.6	67%	0.67	69%	0.692	S	S	*	*			cis	-140.6	-176.9	8.9	-65.5	99.5	0	0	0	111.6	P1055	L1052-P1055 HydrophobicContact CD2-CG 4.3Å
1053	L	30.7	Very low	29.9	Very low	162 Å²	162	143 Å²	143	85%	0.848	70%	0.7	S	S	*	*	S	Bend	trans	99.4	100	171.2	-57.2	173.4	0	0	0	112.3
1054	W	27.7	Very low	29.5	Very low	226 Å²	226	140.1 Å²	140.1	86%	0.856	71%	0.707	S	S	*	*			cis	-50.5	145.7	5.8	-81.3	43.6	0	0	0	115.1	L1056	W1054-L1056 HydrophobicContact CZ3-CD1 4.35Å
1055	P	35.6	Very low	29.2	Very low	82 Å²	82	141.5 Å²	141.5	53%	0.532	71%	0.713	S	S	.	*				-145.9	148.8	87.8	38.2	-21.8	0	0	0	116.7	L1052 Q1057	L1052-P1055 HydrophobicContact CD2-CG 4.3Å; P1055-Q1057 PolarHBondContact O-N 3.09Å
1056	L	28.9	Very low	29	Very low	149 Å²	149	144.5 Å²	144.5	78%	0.78	71%	0.714	S	S	*	*			trans	-75.2	100.4	155.2	-82.8	170.5	0	0	0	110.4	W1054	W1054-L1056 HydrophobicContact CZ3-CD1 4.35Å
1057	Q	28.3	Very low	28.6	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	71%	0.712	S	S	*	*				-179	152.8	124.1	-101	-175.4	21.2	0	0	115.3	P1055	P1055-Q1057 PolarHBondContact O-N 3.09Å
1058	R	26.3	Very low	28.4	Very low	208 Å²	208	144.9 Å²	144.9	79%	0.785	72%	0.716	S	S	*	*			trans	-67.2	149.2	171.2	-61.4	169.1	171.2	163.6	-5.3	110.2
1059	F	23.1	Very low	28.5	Very low	178 Å²	178	149.7 Å²	149.7	78%	0.781	73%	0.731	S	S	*	*				-179	141.9	78	-104.7	-65.6	0	0	0	115.3
1060	K	26.6	Very low	28.4	Very low	152 Å²	152	147.3 Å²	147.3	66%	0.661	73%	0.734	S	S	*	*			trans	90	104.8	145.8	-70.7	-155.7	146	-67.7	0	122.9
1061	D	27.7	Very low	28	Very low	113 Å²	113	148.5 Å²	148.5	60%	0.604	74%	0.735	S	S	*	*				89.6	102.1	118.6	-57.7	-2	0	0	0	121
1062	S	27.8	Very low	28.2	Very low	95 Å²	95	145.1 Å²	145.1	66%	0.664	73%	0.733	S	S	*	*				93.9	111.1	121.1	-73.9	0	0	0	0	123.3
1063	R	30.2	Very low	28.1	Very low	242 Å²	242	146.3 Å²	146.3	91%	0.913	74%	0.739	S	S	*	*			trans	94.6	133.9	130.9	-63.6	163.7	-169.1	-137.9	-3.3	120.4
1064	G	29.7	Very low	27.8	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	73%	0.731	S	S	*	*			trans	97.1	122.5	169.8	0	0	0	0	0	112.9
1065	Q	27.3	Very low	27.9	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	73%	0.73	S	S	*	*			cis	59	134	7.6	-88.4	-170.9	-17.8	0	0	115.3
1066	H	27.1	Very low	27.4	Very low	136 Å²	136	143.4 Å²	143.4	63%	0.63	73%	0.734	S	S	*	*			cis	-157.9	-165.2	-1.9	-158	-133	0	0	0	109.7	L1068	H1066-L1068 VanDerWaalsContact CE1-CD1 3.46Å; H1066-L1068 WeakPolarHBondContact CE1-CD1 3.44Å
1067	L	28.3	Very low	27.4	Very low	144 Å²	144	144.3 Å²	144.3	75%	0.754	74%	0.739	S	S	*	*			trans	79.2	116.8	178.2	-52.5	169.1	0	0	0	113
1068	L	25.7	Very low	27.3	Very low	111 Å²	111	142.3 Å²	142.3	58%	0.581	73%	0.734	S	S	*	*			cis	72.3	134.3	32.8	-55.4	168.5	0	0	0	115.5	H1066	H1066-L1068 VanDerWaalsContact CE1-CD1 3.46Å; H1066-L1068 WeakPolarHBondContact CE1-CD1 3.44Å
1069	Q	26.4	Very low	27.2	Very low	162 Å²	162	139.6 Å²	139.6	76%	0.757	73%	0.734	S	S	*	*			trans	65.1	142.5	151.5	-69.2	154.4	-59.3	0	0	118
1070	G	28.4	Very low	27.3	Very low	64 Å²	64	136.7 Å²	136.7	66%	0.66	74%	0.736	S	S	*	*			cis	162	-161.9	-7	0	0	0	0	0	113.4
1071	E	29.9	Very low	27.3	Very low	183 Å²	183	132.8 Å²	132.8	86%	0.855	74%	0.738	S	S	*	*			trans	75.7	145.3	157.7	-62.7	-179.5	-173.6	0	0	117.7
1072	A	28.1	Very low	27.5	Very low	77 Å²	77	136.6 Å²	136.6	64%	0.636	75%	0.749	S	S	*	*			cis	-164.9	169.6	-16.7	0	0	0	0	0	111.2
1073	L	27.3	Very low	27.5	Very low	153 Å²	153	139 Å²	139	80%	0.801	76%	0.755	S	S	*	*			trans	20.7	143.3	136.7	-56.2	169.3	0	0	0	118.1
1074	K	24.5	Very low	27.3	Very low	158 Å²	158	135.4 Å²	135.4	69%	0.687	75%	0.746	S	S	*	*			cis	-175.9	145.7	37.4	-141.1	166.6	-174.4	179.2	0	106.8
1075	F	27.9	Very low	27.3	Very low	190 Å²	190	137.2 Å²	137.2	83%	0.833	74%	0.74	S	S	*	*				170.4	173.4	89.6	-99.8	-75.5	0	0	0	107.7
1076	G	26.7	Very low	27.5	Very low	60 Å²	60	135.9 Å²	135.9	62%	0.619	73%	0.734	S	S	*	*			trans	-149.3	158.8	161.4	0	0	0	0	0	110.9
1077	I	27.7	Very low	27.4	Very low	169 Å²	169	136.1 Å²	136.1	87%	0.867	74%	0.74	S	S	*	*			trans	-173.3	119.4	157.6	-97.3	150	0	0	0	107.8
1078	D	26.1	Very low	27.3	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	73%	0.733	S	S	*	*			trans	42.3	159.5	137.2	-139.2	-2.6	0	0	0	124.8
1079	L	25.5	Very low	27.3	Very low	152 Å²	152	134.8 Å²	134.8	80%	0.796	74%	0.737	S	S	*	*			trans	84.2	149.7	161.4	-61.2	-178.2	0	0	0	121.8
1080	S	24.7	Very low	27.4	Very low	117 Å²	117	133.4 Å²	133.4	82%	0.818	73%	0.731	S	S	*	*			trans	-105.5	162.7	-164.3	56	0	0	0	0	114.5
1081	G	26.6	Very low	27.4	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	73%	0.732	S	S	*	*			trans	132.4	128.2	167.7	0	0	0	0	0	110.1
1082	K	31.7	Very low	27.4	Very low	193 Å²	193	136.7 Å²	136.7	84%	0.839	73%	0.73	S	S	*	*			cis	60.3	109.1	44.7	-72.6	-164.7	172.6	-172.8	0	114.5
1083	D	27	Very low	28.4	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	73%	0.734	S	S	*	*				-148.4	139.4	124.5	-84.4	-33.1	0	0	0	105.6
1084	F	27.6	Very low	28.4	Very low	167 Å²	167	135.3 Å²	135.3	73%	0.732	73%	0.732	S	S	*	*				68.7	142.3	66	-75.9	-66.6	0	0	0	112.3
1085	D	29.6	Very low	28.5	Very low	106 Å²	106	135.1 Å²	135.1	57%	0.567	73%	0.733	S	S	*	*			cis	-157.8	167	21.9	-136.9	-31.2	0	0	0	115.9
1086	Q	30.2	Very low	28.3	Very low	152 Å²	152	134.2 Å²	134.2	71%	0.71	73%	0.731	S	S	*	*			trans	47.5	145.7	149.1	-84.4	147.1	53.2	0	0	122.7
1087	D	25.5	Very low	28.1	Very low	142 Å²	142	139 Å²	139	76%	0.759	74%	0.742	S	S	*	*			cis	-147.7	-172.8	-2.6	-143.2	10.8	0	0	0	108.4
1088	E	26.8	Very low	29.5	Very low	130 Å²	130	136.3 Å²	136.3	61%	0.607	74%	0.736	S	S	*	*			cis	-146.5	-167	14.7	-150	-124	135	0	0	106.4	E1090	E1088-E1090 PolarHBondContact OE1-N 3.21Å
1089	S	25.6	Very low	31	Very low	97 Å²	97	135 Å²	135	68%	0.678	74%	0.735	S	S	*	*			cis	-148.1	167	20	-55.4	0	0	0	0	116.3
1090	E	28.7	Very low	31	Very low	133 Å²	133	134.6 Å²	134.6	62%	0.621	73%	0.729	S	S	*	*			trans	-66.8	159	173.9	-65.9	-166.4	156.3	0	0	115.6	E1088	E1088-E1090 PolarHBondContact OE1-N 3.21Å
1091	R	27.2	Very low	31.1	Very low	179 Å²	179	134.9 Å²	134.9	68%	0.675	73%	0.726	S	S	*	*			cis	-171.1	106.1	-19.7	173.4	-173	-80.6	121.4	6.2	112.7
1092	V	29.8	Very low	31	Very low	137 Å²	137	137.8 Å²	137.8	83%	0.83	72%	0.724	S	S	*	*			trans	54.3	-162.7	146.9	-145.9	0	0	0	0	114.6
1093	P	50.3	Low	30.7	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	72%	0.722	S	S	*	*			cis	-135.4	166.8	-17.4	44.2	-26.4	0	0	0	119.7
1094	A	26.8	Very low	30.5	Very low	91 Å²	91	134.7 Å²	134.7	75%	0.752	72%	0.719	S	S	*	*			trans	63.3	158.4	157.5	0	0	0	0	0	119.5
1095	E	27.1	Very low	31.2	Very low	154 Å²	154	132 Å²	132	72%	0.72	72%	0.718	S	S	*	*			cis	-158.6	150.2	1.5	-141.1	171.6	141.9	0	0	112.9
1096	Q	23.7	Very low	31.2	Very low	171 Å²	171	131.1 Å²	131.1	80%	0.799	72%	0.721	S	S	*	*			trans	69.1	179	151.5	-82.5	158.2	28.3	0	0	124.4
1097	L	22.5	Very low	31.2	Very low	161 Å²	161	131.2 Å²	131.2	84%	0.843	73%	0.726	S	S	*	*			trans	-125.6	-151	-156.7	-75.1	166.2	0	0	0	111.8
1098	P	57.4	Low	32.3	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	72%	0.723	S	S	*	*				-108.3	-153.3	-82.1	41.2	-27.1	0	0	0	110.4
1099	P	56.1	Low	32.2	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	73%	0.732	S	S	*	*			cis	-125.9	-160.6	-13.3	47.8	-31.9	0	0	0	111.5
1100	E	26.3	Very low	32.4	Very low	145 Å²	145	137.8 Å²	137.8	68%	0.678	74%	0.742	S	S	*	*			cis	-132.4	-125.7	-6.8	-155.9	-158.3	-63.8	0	0	110.1	L1102	E1100-L1102 PolarHBondContact OE2-N 3.04Å
1101	V	26.1	Very low	32.3	Very low	123 Å²	123	140 Å²	140	75%	0.745	75%	0.752	S	S	*	*			cis	-140.2	137.2	4.6	-175	0	0	0	0	110.3
1102	L	24.3	Very low	32.4	Very low	129 Å²	129	140.1 Å²	140.1	68%	0.675	76%	0.761	S	S	*	*			trans	20.3	105.9	172.4	-87.3	88.2	0	0	0	120	E1100	E1100-L1102 PolarHBondContact OE2-N 3.04Å
1103	H	25.2	Very low	33	Very low	171 Å²	171	138.5 Å²	138.5	79%	0.792	75%	0.753	S	S	*	*				70.4	100.7	127	-72.6	85.4	0	0	0	122.6
1104	S	24.8	Very low	31.8	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	76%	0.755	S	S	*	*			trans	-57.7	-171.2	132.7	45.2	0	0	0	0	112.7
1105	P	42.2	Very low	31.7	Very low	110 Å²	110	143.7 Å²	143.7	71%	0.714	76%	0.761	S	S	*	*			cis	-121.1	176.9	3.4	20.3	6.4	0	0	0	113.3
1106	S	27.9	Very low	31.6	Very low	89 Å²	89	142.4 Å²	142.4	62%	0.622	77%	0.769	S	S	*	*			cis	84.8	105.2	22.4	85.2	0	0	0	0	118.3
1107	D	30.1	Very low	31.5	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	77%	0.767	S	S	*	*			trans	64.8	175.9	146.4	-55.5	-33.9	0	0	0	118.7
1108	P	50.2	Low	32.5	Very low	107 Å²	107	135.2 Å²	135.2	70%	0.695	76%	0.76	S	S	*	*			cis	-131.2	-158.6	-35.1	29.3	-6.8	0	0	0	112.6
1109	E	24.6	Very low	30.9	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.794	77%	0.767	S	S	*	*			trans	71.9	152	156.1	-68.8	-178.9	121.7	0	0	120.2
1110	Y	28.4	Very low	29.5	Very low	231 Å²	231	136.9 Å²	136.9	91%	0.906	76%	0.762	S	S	*	*			trans	-150.1	135.1	174.4	-117.6	-88.2	0	0	0	111.2
1111	H	27.7	Very low	29.4	Very low	180 Å²	180	137.8 Å²	137.8	83%	0.833	77%	0.771	S	S	*	*			trans	-137.1	153.1	172.2	-100.3	-81.4	0	0	0	109.2
1112	E	28.7	Very low	29.5	Very low	181 Å²	181	138 Å²	138	85%	0.846	77%	0.772	S	S	*	*			trans	-74.9	-177.1	166.7	-60.4	-165.9	105.6	0	0	111.2
1113	P	41.9	Very low	30.1	Very low	103 Å²	103	137.6 Å²	137.6	67%	0.669	78%	0.777	S	S	*	*			cis	-147.8	179.5	8.8	44.9	-25.4	0	0	0	119.3
1114	S	25	Very low	30.2	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	78%	0.777	S	S	*	*			trans	71.3	165.8	145.2	84.1	0	0	0	0	119.3
1115	K	24.7	Very low	30.5	Very low	200 Å²	200	138.4 Å²	138.4	87%	0.87	78%	0.778	S	S	*	*			cis	-168.1	137.1	-26.2	-115.2	-174	175.5	-179.1	0	109.6
1116	S	25.4	Very low	30.8	Very low	127 Å²	127	138.3 Å²	138.3	89%	0.888	78%	0.778	S	S	*	*			trans	-175.6	144.8	150.6	46.6	0	0	0	0	112
1117	G	22.4	Very low	31.3	Very low	74 Å²	74	140 Å²	140	76%	0.763	79%	0.787	S	S	*	*			trans	-106.5	-152.7	178.8	0	0	0	0	0	113.4
1118	P	43.2	Very low	31.3	Very low	108 Å²	108	141 Å²	141	70%	0.701	79%	0.786	S	S	*	*			cis	-134.8	-172.3	15.6	45.2	-29	0	0	0	116.1
1119	E	24.7	Very low	30.4	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	79%	0.788	S	S	*	*			trans	64.2	147.6	158.6	-69	164.3	142.2	0	0	119.4
1120	A	25.3	Very low	30.8	Very low	79 Å²	79	140.8 Å²	140.8	65%	0.653	79%	0.788	S	S	*	*			cis	-162.4	157	-22.2	0	0	0	0	0	111.9
1121	D	25.3	Very low	30.8	Very low	163 Å²	163	137.9 Å²	137.9	87%	0.872	78%	0.782	S	S	*	*			trans	67.3	155.7	154.3	-61.2	-28.3	0	0	0	125.3
1122	V	28.2	Very low	30.6	Very low	127 Å²	127	133.5 Å²	133.5	77%	0.77	78%	0.778	S	S	*	*			trans	-149.2	131.4	-166	167.4	0	0	0	0	106.8
1123	P	37.2	Very low	30.5	Very low	121 Å²	121	133.7 Å²	133.7	79%	0.786	77%	0.77	S	S	*	*				-147.2	-179.7	88.2	29.8	-6	0	0	0	114.2
1124	H	27.3	Very low	29.6	Very low	168 Å²	168	137.4 Å²	137.4	78%	0.778	77%	0.771	S	S	*	*			cis	98.4	85.1	17.2	-121.4	82.3	0	0	0	118
1125	V	30.1	Very low	29.5	Very low	124 Å²	124	138.1 Å²	138.1	75%	0.752	76%	0.763	S	S	*	*			trans	80.7	-145.4	147.6	-159	0	0	0	0	118.1
1126	P	48.8	Very low	29.7	Very low	108 Å²	108	134.4 Å²	134.4	70%	0.701	76%	0.757	S	S	*	*				-81.5	179.6	-121.5	37.8	-33.9	0	0	0	117.5
1127	P	37.4	Very low	29.7	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	73%	0.734	S	S	*	*			cis	-138.3	-106.3	19.4	39.6	-15.3	0	0	0	118.6
1128	H	30.5	Very low	30	Very low	174 Å²	174	129.4 Å²	129.4	81%	0.806	72%	0.72	S	S	*	*			trans	-154.3	154.1	-161	-95.4	-106.1	0	0	0	113.5
1129	M	30.7	Very low	29.2	Very low	150 Å²	150	125.2 Å²	125.2	74%	0.739	70%	0.695	S	S	*	*			trans	50.1	149	148.2	-88.6	178.1	161.5	0	0	123.1
1130	P	34.8	Very low	29.3	Very low	122 Å²	122	120.5 Å²	120.5	79%	0.792	69%	0.687	S	S	*	*				-139.8	-178.7	104.9	39.8	-28	0	0	0	116
1131	H	27.2	Very low	29.3	Very low	169 Å²	169	121.1 Å²	121.1	78%	0.782	69%	0.687	S	S	*	*			trans	-88.6	-174.1	172	-51.7	-106.2	0	0	0	110.5
1132	A	25	Very low	29.4	Very low	89 Å²	89	119 Å²	119	74%	0.736	68%	0.68	S	S	*	*			cis	-164.6	147.7	12.3	0	0	0	0	0	108.7
1133	R	26.1	Very low	29.3	Very low	184 Å²	184	119.7 Å²	119.7	69%	0.694	68%	0.684	S	S	*	*				99.9	125.7	80.4	179	-170.9	175.6	-161.9	-2.1	116.4
1134	W	22.7	Very low	28.8	Very low	181 Å²	181	118.3 Å²	118.3	69%	0.686	68%	0.683	S	S	*	*			trans	79	154.6	151.9	-78.5	15.2	0	0	0	120.9
1135	E	23.2	Very low	28.8	Very low	124 Å²	124	116.6 Å²	116.6	58%	0.579	68%	0.684	S	S	*	*			cis	150.2	154.3	-19.1	-98.3	173.5	-138.3	0	0	108.4
1136	T	28.3	Very low	29.1	Very low	121 Å²	121	116.8 Å²	116.8	74%	0.742	69%	0.688	S	S	*	*			cis	-157.7	171.8	3.4	19.7	0	0	0	0	109.3
1137	G	25.7	Very low	28.1	Very low	40 Å²	40	116.1 Å²	116.1	41%	0.412	69%	0.686	S	S	.	*			trans	-144.8	-92.7	172.1	0	0	0	0	0	118.5	G528	G528-G1137 CarbonylContact O-C 3.59Å; G528-G1137 WeakPolarHBondContact O-CA 3.49Å
1138	A	29.6	Very low	27.7	Very low	57 Å²	57	117 Å²	117	47%	0.471	68%	0.683	S	S	.	*			trans	73.2	141.1	-176.3	0	0	0	0	0	120.1	G528	G528-A1138 PolarHBondContact N-O 3.43Å; G528-A1138 CarbonylContact O-C 3.02Å; G528-A1138 VanDerWaalsContact O-C 3.27Å; G528-A1138 WeakPolarHBondContact O-CA 3.46Å; G528-A1138 PolarHBondContact O-N 2.9Å; G528-A1138 VanDerWaalsContact O-O 3.06Å
1139	A	25.1	Very low	28.2	Very low	20 Å²	20	114.8 Å²	114.8	17%	0.165	68%	0.684	C	S	.	*			trans	-142.6	77.7	177.9	0	0	0	0	0	115.2	R527 E529	R527-A1139 HydrophobicContact CB-CB 4.13Å; R527-A1139 HydrophobicContact CG-CB 3.8Å; R527-A1139 PolarHBondContact NH2-O 2.83Å; E529-A1139 HydrophobicContact CG-CB 3.53Å; E529-A1139 WeakPolarHBondContact OE2-CB 3.33Å
1140	A	26.9	Very low	28.1	Very low	84 Å²	84	113.8 Å²	113.8	69%	0.694	68%	0.682	S	S	*	*			trans	-57.7	167.2	172.9	0	0	0	0	0	114.7	R527	R527-A1140 PolarHBondContact NE-O 3.36Å; R527-A1140 PolarHBondContact NH2-O 3.21Å
1141	S	26	Very low	27.7	Very low	93 Å²	93	115.9 Å²	115.9	65%	0.65	69%	0.686	S	S	*	*				-180	127.1	111.9	-159.5	0	0	0	0	116.2
1142	T	25.9	Very low	27.7	Very low	119 Å²	119	111 Å²	111	73%	0.73	68%	0.682	S	S	*	*			trans	49.1	124.9	141.2	56	0	0	0	0	124.1
1143	T	27.8	Very low	27.9	Very low	140 Å²	140	116.3 Å²	116.3	86%	0.859	69%	0.689	S	S	*	*				173.1	158.6	109.2	31.9	0	0	0	0	109.4
1144	A	25.7	Very low	27.8	Very low	93 Å²	93	112.7 Å²	112.7	77%	0.769	69%	0.687	S	S	*	*			cis	-160.5	167.3	-31.8	0	0	0	0	0	109
1145	V	27.2	Very low	27.9	Very low	131 Å²	131	114.1 Å²	114.1	79%	0.794	69%	0.694	S	S	*	*			trans	-85	159.7	-172.5	-142.3	0	0	0	0	113.4
1146	P	36.9	Very low	27.9	Very low	129 Å²	129	118.2 Å²	118.2	84%	0.838	70%	0.704	S	S	*	*				-140.7	177.7	104.1	39.3	-26.1	0	0	0	114.8
1147	S	27.5	Very low	27.8	Very low	94 Å²	94	123.2 Å²	123.2	66%	0.657	71%	0.709	S	S	*	*			trans	-144.8	152.7	-154.5	58.7	0	0	0	0	117
1148	L	28.6	Very low	27.7	Very low	143 Å²	143	129.4 Å²	129.4	75%	0.749	73%	0.729	S	S	*	*			trans	70.1	160.6	154.2	-79.8	167.8	0	0	0	116.9
1149	P	42.4	Very low	27.8	Very low	127 Å²	127	134.8 Å²	134.8	83%	0.825	75%	0.749	S	S	*	*			cis	-132.7	-160	35.2	43.3	-24	0	0	0	117.9
1150	N	28.1	Very low	27.9	Very low	129 Å²	129	137.5 Å²	137.5	69%	0.69	78%	0.779	S	S	*	*			trans	-94.4	-174.1	-157.4	-68	-16.5	0	0	0	117
1151	D	25.6	Very low	27.9	Very low	166 Å²	166	141.7 Å²	141.7	89%	0.888	78%	0.784	S	S	*	*			trans	94.8	142.6	157.7	-56.7	-19.2	0	0	0	117.3
1152	G	27.2	Very low	28	Very low	67 Å²	67	147.8 Å²	147.8	69%	0.691	79%	0.793	S	S	*	*			cis	173.2	109.3	-7.6	0	0	0	0	0	115.3
1153	F	29.2	Very low	28	Very low	201 Å²	201	147 Å²	147	88%	0.882	79%	0.793	S	S	*	*			trans	28.6	144.4	154.5	-76	-74.8	0	0	0	125.1
1154	V	24.5	Very low	28	Very low	108 Å²	108	149.5 Å²	149.5	66%	0.655	80%	0.795	S	S	*	*			trans	75.6	141	156.1	171.5	0	0	0	0	114
1155	Y	24.9	Very low	28.3	Very low	211 Å²	211	151.4 Å²	151.4	83%	0.827	80%	0.801	S	S	*	*				-136.5	144.8	55.5	-67.3	-90.7	0	0	0	111.9
1156	R	22.3	Very low	28.4	Very low	210 Å²	210	150.3 Å²	150.3	79%	0.792	80%	0.799	S	S	*	*				81.6	114	52.3	-173.4	-178.3	174.4	-177.2	-0.9	114.3
1157	W	26.6	Very low	28.1	Very low	226 Å²	226	152 Å²	152	86%	0.856	80%	0.796	S	S	*	*			trans	-71	151.5	177	-72.4	77.7	0	0	0	114.6
1158	M	24.5	Very low	28.1	Very low	170 Å²	170	154.1 Å²	154.1	84%	0.837	80%	0.795	S	S	*	*			trans	-146.4	157.9	149.2	-73.8	-161.4	-69.5	0	0	111
1159	L	30.4	Very low	28	Very low	170 Å²	170	153 Å²	153	89%	0.89	80%	0.798	S	S	*	*			trans	-115.1	156.9	-179.7	-69.8	159.7	0	0	0	110.4
1160	G	27.8	Very low	27.3	Very low	77 Å²	77	149.9 Å²	149.9	79%	0.794	79%	0.789	S	S	*	*			trans	-178	153	174	0	0	0	0	0	113.2
1161	E	26.5	Very low	27.5	Very low	171 Å²	171	148.7 Å²	148.7	80%	0.799	80%	0.797	S	S	*	*			trans	-128.2	146.5	-163.1	-87.9	-156.6	118.3	0	0	116.1
1162	W	27.9	Very low	27.7	Very low	221 Å²	221	145.6 Å²	145.6	84%	0.837	79%	0.794	S	S	*	*			trans	50.2	129.5	149	-67.1	56.4	0	0	0	121.5
1163	S	26.5	Very low	27.7	Very low	103 Å²	103	145.2 Å²	145.2	72%	0.72	79%	0.79	S	S	*	*				173.8	140.5	94.9	49	0	0	0	0	117.2
1164	Q	26.9	Very low	27.6	Very low	193 Å²	193	142.1 Å²	142.1	90%	0.902	79%	0.794	S	S	*	*			trans	66.2	161.9	147	-69.5	-173.5	-2.2	0	0	123.5
1165	C	32.1	Very low	27.8	Very low	132 Å²	132	140.1 Å²	140.1	89%	0.892	80%	0.795	S	S	*	*			trans	-132.1	160	-167.5	-54.9	0	0	0	0	113.2
1166	S	29.4	Very low	27.7	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	80%	0.798	S	S	*	*			trans	-161.3	145	166.1	54.9	0	0	0	0	109.1
1167	Q	30.3	Very low	28	Very low	166 Å²	166	136.7 Å²	136.7	78%	0.776	80%	0.8	S	S	*	*			cis	-158.8	159.1	-3.9	-118.9	-175.9	-76.9	0	0	107.2
1168	E	28.3	Very low	27.7	Very low	138 Å²	138	131.6 Å²	131.6	65%	0.645	80%	0.797	S	S	*	*			cis	-137.9	-103.5	-3.1	-170.7	-166.5	-77.4	0	0	111.6	G1170	E1168-G1170 PolarHBondContact OE2-N 3.2Å
1169	C	25.7	Very low	27.7	Very low	120 Å²	120	134.6 Å²	134.6	81%	0.811	80%	0.799	S	S	*	*			cis	-139.9	131.2	-2.8	-64.9	0	0	0	0	110.8
1170	G	28.4	Very low	28.2	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	79%	0.791	S	S	*	*			trans	-87.8	-178.3	175.3	0	0	0	0	0	114.3	E1168	E1168-G1170 PolarHBondContact OE2-N 3.2Å
1171	A	33	Very low	28	Very low	103 Å²	103	139.5 Å²	139.5	85%	0.851	80%	0.796	S	S	*	*			cis	-159.7	-175.7	-8	0	0	0	0	0	107.2
1172	A	29.5	Very low	27.9	Very low	101 Å²	101	140 Å²	140	84%	0.835	80%	0.799	S	S	*	*			cis	-156.4	-177.9	6	0	0	0	0	0	107.8
1173	G	26.4	Very low	29.3	Very low	59 Å²	59	134.9 Å²	134.9	61%	0.608	79%	0.794	S	S	*	*			cis	166	169.9	-2.5	0	0	0	0	0	112.1
1174	S	27.4	Very low	29.2	Very low	137 Å²	137	135.9 Å²	135.9	96%	0.958	80%	0.801	S	S	*	*			trans	59.2	141.9	174.9	61.4	0	0	0	0	117.8
1175	G	28.3	Very low	29.2	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	80%	0.799	S	S	*	*			cis	149.7	126.8	-0	0	0	0	0	0	109
1176	L	24.4	Very low	28.9	Very low	172 Å²	172	137.8 Å²	137.8	90%	0.901	80%	0.798	S	S	*	*				-176.2	174	92.4	-96.1	162.3	0	0	0	112.7
1177	Q	26.6	Very low	28.7	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	80%	0.798	S	S	*	*			trans	-93.2	-178.8	-173.8	-57.9	156.2	-33.9	0	0	111.5
1178	C	21.8	Very low	28.5	Very low	118 Å²	118	135.4 Å²	135.4	80%	0.797	80%	0.798	S	S	*	*			cis	-159	-173.3	14.2	-151	0	0	0	0	114.1
1179	R	23.3	Very low	29.3	Very low	233 Å²	233	134.2 Å²	134.2	88%	0.879	80%	0.802	S	S	*	*			trans	-72.9	-175.8	175.9	-63.6	174.9	161	172.8	-5	113.1
1180	P	42.2	Very low	29.4	Very low	111 Å²	111	136.3 Å²	136.3	72%	0.721	80%	0.8	S	S	*	*			cis	-143.5	175.7	4.6	41.8	-21.3	0	0	0	119.8
1181	R	23.6	Very low	29.3	Very low	240 Å²	240	139 Å²	139	91%	0.906	80%	0.804	S	S	*	*			trans	55.9	124.6	148.7	-78.7	-179.5	172.8	173.2	-2.1	123.7
1182	Q	24.5	Very low	28.9	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	80%	0.802	S	S	*	*			trans	6	165.9	137.3	-83.7	-164.3	-5.8	0	0	122.9
1183	P	55.8	Low	28.7	Very low	112 Å²	112	140.8 Å²	140.8	73%	0.727	80%	0.795	S	S	*	*			cis	-141.8	176.4	-27.6	39.5	-21.9	0	0	0	114.9
1184	S	25.2	Very low	28.6	Very low	124 Å²	124	144.1 Å²	144.1	87%	0.867	80%	0.803	S	S	*	*			trans	-159	-177.2	162.9	58.6	0	0	0	0	113.9
1185	Y	26.4	Very low	28.6	Very low	222 Å²	222	146 Å²	146	87%	0.871	80%	0.799	S	S	*	*			trans	-151.2	162	-150.9	-141.1	-80.6	0	0	0	113
1186	V	26.4	Very low	28.6	Very low	143 Å²	143	148.6 Å²	148.6	87%	0.867	80%	0.804	S	S	*	*			trans	79.9	134.3	168.1	-169.7	0	0	0	0	118.3
1187	G	25.1	Very low	28.8	Very low	74 Å²	74	143.8 Å²	143.8	76%	0.763	80%	0.796	S	S	*	*			trans	160.7	108.8	160.7	0	0	0	0	0	115.9
1188	I	27.2	Very low	29.4	Very low	150 Å²	150	141 Å²	141	77%	0.769	79%	0.794	S	S	*	*			trans	-129.8	132.8	179.3	-77.7	175.3	0	0	0	107
1189	P	43.3	Very low	29.4	Very low	114 Å²	114	147.1 Å²	147.1	74%	0.74	80%	0.8	S	S	*	*				-154.9	154.9	85.6	38.9	-17.6	0	0	0	120.2
1190	H	28.1	Very low	29.6	Very low	164 Å²	164	140 Å²	140	76%	0.759	79%	0.791	S	S	*	*				16.3	146.9	127.6	-64.7	-77.2	0	0	0	120.1
1191	V	26.6	Very low	28.8	Very low	116 Å²	116	140.4 Å²	140.4	70%	0.703	80%	0.795	S	S	*	*			cis	-169.5	170.6	12.3	104.7	0	0	0	0	113.6
1192	I	25.7	Very low	28.9	Very low	159 Å²	159	135.1 Å²	135.1	82%	0.815	79%	0.789	S	S	*	*			trans	72.1	143.9	-179.8	-40.3	-169.5	0	0	0	115.1
1193	A	25	Very low	28.9	Very low	83 Å²	83	132.6 Å²	132.6	69%	0.686	78%	0.782	S	S	*	*			cis	174.7	171.5	-47.2	0	0	0	0	0	108.9
1194	V	24.5	Very low	27.4	Very low	130 Å²	130	135.1 Å²	135.1	79%	0.788	78%	0.782	S	S	*	*			trans	89.3	107.4	168.4	-171.3	0	0	0	0	117.3
1195	M	26.7	Very low	27.5	Very low	176 Å²	176	135.7 Å²	135.7	87%	0.867	77%	0.774	S	S	*	*			trans	49.5	124.1	149.7	-55.9	-61.1	-168.9	0	0	122.1
1196	P	28.4	Very low	27.4	Very low	120 Å²	120	129.1 Å²	129.1	78%	0.779	77%	0.765	S	S	*	*			trans	-121	138.8	149.3	36.2	-24.6	0	0	0	113.5
1197	G	28	Very low	27.3	Very low	71 Å²	71	128.9 Å²	128.9	73%	0.732	76%	0.764	S	S	*	*			trans	-85.7	159.8	134.5	0	0	0	0	0	108.4
1198	P	38.6	Very low	27.5	Very low	120 Å²	120	134.6 Å²	134.6	78%	0.779	79%	0.792	S	S	*	*				-143.4	-174.4	84.7	41.8	-24.2	0	0	0	111.4
1199	W	23.7	Very low	27.5	Very low	245 Å²	245	133.9 Å²	133.9	93%	0.928	79%	0.794	S	S	*	*			cis	74	137.7	26.6	-85.2	63.1	0	0	0	116.7
1200	A	26.1	Very low	26.7	Very low	84 Å²	84	134.9 Å²	134.9	69%	0.694	80%	0.796	S	S	*	*			trans	60.6	126.7	-176.4	0	0	0	0	0	116
1201	C	25.3	Very low	26.6	Very low	119 Å²	119	133.3 Å²	133.3	80%	0.804	80%	0.799	S	S	*	*			cis	82	153.5	32.8	-54.3	0	0	0	0	114.8
1202	V	25.8	Very low	26.6	Very low	130 Å²	130	134.3 Å²	134.3	79%	0.788	80%	0.804	S	S	*	*			trans	77.9	125.2	169.6	-173.8	0	0	0	0	113.3
1203	D	24.7	Very low	26.7	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	80%	0.803	S	S	*	*			cis	-154.5	164.8	5.9	-132.8	-7.8	0	0	0	117.9
1204	F	24.3	Very low	26.8	Very low	165 Å²	165	136.1 Å²	136.1	72%	0.724	81%	0.811	S	S	*	*			trans	33.5	128.6	145.5	-92.6	-140.4	0	0	0	125.9
1205	I	26.6	Very low	27	Very low	136 Å²	136	136.5 Å²	136.5	70%	0.697	81%	0.813	S	S	*	*			trans	69.1	114	132.5	-64.8	-173.5	0	0	0	121.2
1206	A	25.6	Very low	27	Very low	84 Å²	84	133.5 Å²	133.5	69%	0.694	81%	0.809	S	S	*	*			trans	39.3	140.6	136.5	0	0	0	0	0	120.8
1207	T	24.6	Very low	26.9	Very low	137 Å²	137	134.6 Å²	134.6	84%	0.84	81%	0.811	S	S	*	*			cis	-160.1	144.8	47.4	34.1	0	0	0	0	113.7
1208	S	29.2	Very low	26.8	Very low	195 Å²	195	140.4 Å²	140.4	100%	1.364	82%	0.818	S	S	*	*			trans	-165.4	0	140.2	66.4	0	0	0	0	109.7

Retrieved 1,208 of 1,208 residues in 690.9 ms (Link to these results)

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