A0A3Q0KPX7_SCHMA Loading...

Putative netrin

AlphaFold DB , UniProt , Accession A0A3Q0KPX7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 834 aa.

						>A0A3Q0KPX7_SCHMA|A0A3Q0KPX7
MLPILIISWIIFYFSNICINANNLNPHSDLNQKHYTDEKDSNIKVIYEATRSVCYTKGQAIECSPPFTNIAESVDIKATSTCGQFDQSEEICRYVMGHEKCETCGKGEKFGTHLLTDRHQMNNETCWVSGSVLPGDTVNLTLSLGKRFEVYYISLQPCGQLPDSIALYKSSDFGVTWKPWQYFSTDCYRAFHLPTSNEHNAQISLANIQEVLCVALKSPDVHGNSGQSSNVIAFSTTIGRPSMQPWSSALIDWMTMTDLRISLMRFPEYRDEVQYDSNGLFLNPSFLKPTNVFRVSGSPSIGGFGTNPVLSEAGTLDMSQHLYQSDMHYSKTPKSKTPVHFSFSDLSIGGRCKCNGHANRCIRDRIVGTGITTDNNGQTKSQWGPLRCDCQHNTEGADCERCSPGYLDRPWARGTSESANDCKRCDCNLHSNSCVFSNQLYLMSMKVSGGVCQDCQHNTVGRKCHNCVTGYYRDWTKPVSHDQVCLECRCHPIGSIANQHCDRKTGQCPCKPGVVGQACNRCQEGYKQTRLPDAPCIKAMEHYAHRRKENDQTSHSTKSQLSKPETNIDCPPCERSKKRIRFKKFCRNEAVFRGIVKSRTIHGDLMRLEVGIQNTWRITGAAEHLLPKTASPNLPAYRVWLRIKNNSADKRHSRCLCPNLQVGQSYLFITRSHQVPYGDRMELLLDTHSVVLKWRESWRRRLSKFVRRAARESCDSEKNSVVVDDDNTDDSNYDKLKRTRRVQRLRPGPDYYSSNTQVNQHNRIQSPTSPSTLSSNYHLNRLRSSNKLKKQISQSSIISDPHSSKEISLNYPHDKDKFQYTTNKNVYSSFYSNQ
					

Structure Viewer

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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	49.4	Very low	58	Low	199 Å²	199	122 Å²	122	98%	0.98	62%	0.623	S	S	*	*				0	-27.1	0	-72.3	-61	-176.9	0	0	113.8	P3	M1-P3 VanDerWaalsContact C-CD 3.43Å
2	L	49.6	Very low	57.8	Low	148 Å²	148	123.2 Å²	123.2	78%	0.775	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-26.2	174.1	-117.1	73.4	0	0	0	118.2	I4	L2-I4 PolarHBondContact O-N 2.62Å
3	P	53	Low	57.5	Low	88 Å²	88	125.4 Å²	125.4	57%	0.571	62%	0.619	S	S	*	*	H	α-helix	trans	-82.3	-8.8	-173.9	30.1	-31.1	0	0	0	114.4	M1	M1-P3 VanDerWaalsContact C-CD 3.43Å
4	I	56.4	Low	57.1	Low	119 Å²	119	127.3 Å²	127.3	61%	0.61	62%	0.623	S	S	*	*	H	α-helix	trans	-83.3	-26.7	-178.4	-60.8	174.3	0	0	0	111.4	L2 S8	L2-I4 PolarHBondContact O-N 2.62Å; I4-S8 PolarHBondContact O-N 3.35Å
5	L	57	Low	56.8	Low	125 Å²	125	123.3 Å²	123.3	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-75.5	-28	-179.6	-71.4	166.5	0	0	0	113.1	W9	L5-W9 PolarHBondContact O-N 3.43Å
6	I	64.3	Low	56.1	Low	113 Å²	113	122.2 Å²	122.2	58%	0.579	61%	0.61	S	S	*	*	H	α-helix	trans	-75.1	-35	179.6	-58.2	176.2	0	0	0	111.1	W9 I10	I6-W9 PolarHBondContact O-N 2.7Å; I6-I10 HydrophobicContact CG2-CD1 4.18Å; I6-I10 WeakPolarHBondContact O-CG1 3.39Å; I6-I10 PolarHBondContact O-N 3.41Å; I6-I10 VanDerWaalsContact O-N 3.15Å
7	I	62.7	Low	55.6	Low	108 Å²	108	122.7 Å²	122.7	55%	0.554	61%	0.613	S	S	*	*	H	α-helix	trans	-70	-36.4	176.8	-61.7	173.6	0	0	0	110.6	W9 I10 I11	I7-W9 VanDerWaalsContact C-N 3.34Å; I7-W9 PolarHBondContact O-N 2.7Å; I7-I10 PolarHBondContact O-N 2.76Å; I7-I11 HydrophobicContact CG2-CD1 3.83Å; I7-I11 HydrophobicContact CG2-CG1 4.48Å; I7-I11 VanDerWaalsContact O-CG1 3.28Å; I7-I11 WeakPolarHBondContact O-CG1 3.4Å; I7-I11 PolarHBondContact O-N 2.98Å
8	S	58.5	Low	54.7	Low	63 Å²	63	122.2 Å²	122.2	44%	0.441	62%	0.622	S	S	.	*	H	α-helix	trans	-68	-33.2	176.4	-155.7	0	0	0	0	112.5	I4 F12	I4-S8 PolarHBondContact O-N 3.35Å; S8-F12 PolarHBondContact O-N 2.78Å
9	W	60.2	Low	54	Low	187 Å²	187	122.5 Å²	122.5	71%	0.708	62%	0.623	S	S	*	*	H	α-helix	trans	-71.5	-37.2	175.2	-129.1	63.9	0	0	0	113.1	L5 I6 I7 F12 Y13	L5-W9 PolarHBondContact O-N 3.43Å; I6-W9 PolarHBondContact O-N 2.7Å; I7-W9 VanDerWaalsContact C-N 3.34Å; I7-W9 PolarHBondContact O-N 2.7Å; W9-F12 PolarHBondContact O-N 2.88Å; W9-Y13 HydrophobicContact CE3-CD2 4.38Å; W9-Y13 HydrophobicContact CH2-CE2 4.28Å; W9-Y13 HydrophobicContact CZ3-CD2 4.34Å; W9-Y13 HydrophobicContact CZ3-CE2 4.14Å; W9-Y13 PolarHBondContact O-N 3.25Å
10	I	63.9	Low	53	Low	93 Å²	93	124.2 Å²	124.2	48%	0.477	63%	0.634	S	S	.	*	H	α-helix	trans	-68.9	-39.3	175.7	-66.3	169.6	0	0	0	110.7	I6 I7 Y13 F14	I6-I10 HydrophobicContact CG2-CD1 4.18Å; I6-I10 WeakPolarHBondContact O-CG1 3.39Å; I6-I10 PolarHBondContact O-N 3.41Å; I6-I10 VanDerWaalsContact O-N 3.15Å; I7-I10 PolarHBondContact O-N 2.76Å; I10-Y13 PolarHBondContact O-N 3.1Å; I10-F14 HydrophobicContact CG2-CD2 3.83Å; I10-F14 HydrophobicContact CG2-CE2 4.02Å; I10-F14 WeakPolarHBondContact O-CD2 3.4Å; I10-F14 PolarHBondContact O-N 2.75Å; I10-F14 VanDerWaalsContact O-N 3.08Å
11	I	63	Low	52.2	Low	99 Å²	99	122.8 Å²	122.8	51%	0.508	64%	0.641	S	S	.	*	H	α-helix	trans	-65.8	-41.8	175.8	-65.7	168.3	0	0	0	110.6	I7 Y13 F14 S15	I7-I11 HydrophobicContact CG2-CD1 3.83Å; I7-I11 HydrophobicContact CG2-CG1 4.48Å; I7-I11 VanDerWaalsContact O-CG1 3.28Å; I7-I11 WeakPolarHBondContact O-CG1 3.4Å; I7-I11 PolarHBondContact O-N 2.98Å; I11-Y13 VanDerWaalsContact C-N 3.34Å; I11-Y13 PolarHBondContact O-N 3.12Å; I11-F14 PolarHBondContact O-N 3.03Å; I11-S15 WeakPolarHBondContact O-CB 3.36Å; I11-S15 PolarHBondContact O-N 3.07Å; I11-S15 PolarHBondContact O-OG 3.01Å
12	F	55.2	Low	51.8	Low	136 Å²	136	120.2 Å²	120.2	60%	0.596	63%	0.631	S	S	*	*	H	α-helix	trans	-65.8	-31.5	175.8	-103.5	-88	0	0	0	113.9	S8 W9 N16	S8-F12 PolarHBondContact O-N 2.78Å; W9-F12 PolarHBondContact O-N 2.88Å; F12-N16 PolarHBondContact O-N 2.75Å; F12-N16 PolarHBondContact O-ND2 3.14Å
13	Y	55	Low	51.2	Low	152 Å²	152	120.6 Å²	120.6	60%	0.596	64%	0.635	S	S	*	*	H	α-helix	trans	-77.5	-32.2	178	-121	-88	0	0	0	113.1	W9 I10 I11	W9-Y13 HydrophobicContact CE3-CD2 4.38Å; W9-Y13 HydrophobicContact CH2-CE2 4.28Å; W9-Y13 HydrophobicContact CZ3-CD2 4.34Å; W9-Y13 HydrophobicContact CZ3-CE2 4.14Å; W9-Y13 PolarHBondContact O-N 3.25Å; I10-Y13 PolarHBondContact O-N 3.1Å; I11-Y13 VanDerWaalsContact C-N 3.34Å; I11-Y13 PolarHBondContact O-N 3.12Å
14	F	51.6	Low	50.4	Low	152 Å²	152	125.1 Å²	125.1	67%	0.667	65%	0.653	S	S	*	*	H	α-helix	trans	-82.9	-25.9	175.3	-81.6	-77.4	0	0	0	113.3	I10 I11	I10-F14 HydrophobicContact CG2-CD2 3.83Å; I10-F14 HydrophobicContact CG2-CE2 4.02Å; I10-F14 WeakPolarHBondContact O-CD2 3.4Å; I10-F14 PolarHBondContact O-N 2.75Å; I10-F14 VanDerWaalsContact O-N 3.08Å; I11-F14 PolarHBondContact O-N 3.03Å
15	S	52.1	Low	49.4	Very low	67 Å²	67	126.7 Å²	126.7	47%	0.469	66%	0.662	S	S	.	*	H	α-helix	trans	-76.4	-21.5	174.8	-60.5	0	0	0	0	114.1	I11	I11-S15 WeakPolarHBondContact O-CB 3.36Å; I11-S15 PolarHBondContact O-N 3.07Å; I11-S15 PolarHBondContact O-OG 3.01Å
16	N	46.2	Very low	48.6	Very low	106 Å²	106	125.4 Å²	125.4	57%	0.567	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-4.4	178.7	-82.8	-62.7	0	0	0	115	F12	F12-N16 PolarHBondContact O-N 2.75Å; F12-N16 PolarHBondContact O-ND2 3.14Å
17	I	47.1	Very low	47.1	Very low	131 Å²	131	128.4 Å²	128.4	67%	0.672	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-3.9	176.3	-67.7	172.6	0	0	0	112.1
18	C	40.3	Very low	45.8	Very low	114 Å²	114	128.2 Å²	128.2	77%	0.77	68%	0.681	S	S	*	*	S	Bend	trans	-114.6	14.9	-178.2	-69.5	0	0	0	0	115.7
19	I	40.5	Very low	44.7	Very low	127 Å²	127	132.1 Å²	132.1	65%	0.651	70%	0.697	S	S	*	*	S	Bend	trans	-123.8	77.9	178.4	-51.3	177	0	0	0	110.3
20	N	34.7	Very low	43.4	Very low	157 Å²	157	130.2 Å²	130.2	84%	0.84	70%	0.7	S	S	*	*			trans	172.7	75.1	144.2	-101.4	-28.1	0	0	0	109
21	A	36.4	Very low	41.8	Very low	95 Å²	95	133.3 Å²	133.3	79%	0.785	72%	0.717	S	S	*	*			trans	-119.4	65.4	165.2	0	0	0	0	0	107.7
22	N	41.1	Very low	40.1	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	73%	0.732	S	S	*	*	S	Bend	trans	-159.6	130.5	163	-87.5	-30.1	0	0	0	107.6
23	N	36.2	Very low	38.9	Very low	157 Å²	157	139.6 Å²	139.6	84%	0.84	74%	0.744	S	S	*	*			trans	81.9	88.8	-170.7	-59.3	-27.9	0	0	0	115.6
24	L	36.4	Very low	37.6	Very low	182 Å²	182	139.9 Å²	139.9	95%	0.953	75%	0.75	S	S	*	*				-169.4	106.8	128.7	-95	151.3	0	0	0	108.5
25	N	36.4	Very low	36.5	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	76%	0.758	S	S	*	*			trans	-130.4	159.9	169.5	-143.7	12.7	0	0	0	104.9
26	P	38.9	Very low	35.5	Very low	98 Å²	98	144.2 Å²	144.2	64%	0.636	76%	0.764	S	S	*	*				-120.3	-171	-68.3	29	-10.6	0	0	0	111.1
27	H	33.3	Very low	35	Very low	177 Å²	177	146.5 Å²	146.5	82%	0.819	78%	0.776	S	S	*	*			trans	97.1	136.9	168.7	-80.9	-88.8	0	0	0	120.3
28	S	35.2	Very low	34.6	Very low	104 Å²	104	148.9 Å²	148.9	73%	0.727	78%	0.784	S	S	*	*			trans	73.3	129.5	172.9	71.6	0	0	0	0	114.9
29	D	34.9	Very low	34.9	Very low	145 Å²	145	152.6 Å²	152.6	78%	0.775	79%	0.787	S	S	*	*			cis	-172.2	158.1	8.4	-116.6	-28.3	0	0	0	108.9
30	L	33.3	Very low	35.5	Very low	147 Å²	147	149.9 Å²	149.9	77%	0.77	77%	0.774	S	S	*	*	S	Bend	trans	73.7	73.2	152.9	-76.9	144.7	0	0	0	120.7
31	N	30.7	Very low	36.9	Very low	157 Å²	157	146.4 Å²	146.4	84%	0.84	76%	0.762	S	S	*	*				174.6	62	116.8	-93.4	-31.2	0	0	0	111.2	K33	N31-K33 PolarHBondContact O-N 3.41Å; N31-K33 VanDerWaalsContact O-N 3.17Å
32	Q	27.9	Very low	38.9	Very low	173 Å²	173	145.8 Å²	145.8	81%	0.808	75%	0.746	S	S	*	*			trans	-69.7	100.3	153.6	-88.7	169.4	-21.8	0	0	107.6	H34	Q32-H34 PolarHBondContact O-N 3.15Å
33	K	29.1	Very low	40.8	Very low	195 Å²	195	141.2 Å²	141.2	85%	0.848	72%	0.721	S	S	*	*			trans	-66	95	143.7	-100.8	-179.1	176.6	177.1	0	105.4	N31 Y35	N31-K33 PolarHBondContact O-N 3.41Å; N31-K33 VanDerWaalsContact O-N 3.17Å; K33-Y35 PolarHBondContact O-N 3.05Å
34	H	27	Very low	43.2	Very low	157 Å²	157	138.5 Å²	138.5	73%	0.727	70%	0.701	S	S	*	*			trans	-49.1	92.9	155.1	-107	-88.1	0	0	0	106.9	Q32 T36	Q32-H34 PolarHBondContact O-N 3.15Å; H34-T36 VanDerWaalsContact C-N 3.28Å; H34-T36 PolarHBondContact O-N 3.46Å; H34-T36 VanDerWaalsContact O-N 3.16Å
35	Y	29.2	Very low	45.6	Very low	215 Å²	215	132.1 Å²	132.1	84%	0.843	67%	0.67	S	S	*	*			trans	-74.2	100.1	157.4	-128.6	-93.1	0	0	0	103.8	K33 D37	K33-Y35 PolarHBondContact O-N 3.05Å; Y35-D37 PolarHBondContact O-N 3.48Å
36	T	30.6	Very low	48.1	Very low	96 Å²	96	127.2 Å²	127.2	59%	0.589	64%	0.643	S	S	*	*			trans	-42.4	117.9	177.8	46.6	0	0	0	0	110.8	H34 E38	H34-T36 VanDerWaalsContact C-N 3.28Å; H34-T36 PolarHBondContact O-N 3.46Å; H34-T36 VanDerWaalsContact O-N 3.16Å; T36-E38 PolarHBondContact O-N 3.39Å
37	D	36.6	Very low	50.3	Low	153 Å²	153	124.2 Å²	124.2	82%	0.818	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	23.1	-179.7	-144.9	-1.9	0	0	0	113.4	Y35	Y35-D37 PolarHBondContact O-N 3.48Å
38	E	39	Very low	53	Low	181 Å²	181	120.7 Å²	120.7	85%	0.846	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-5.8	-174.8	-86.5	-168.8	145.8	0	0	114	T36	T36-E38 PolarHBondContact O-N 3.39Å
39	K	45	Very low	55.3	Low	193 Å²	193	116.6 Å²	116.6	84%	0.839	58%	0.576	S	S	*	*	S	Bend	trans	-105.3	-5.8	-178.3	-110	-178.9	-179.7	177.5	0	116.1
40	D	54.4	Low	57.3	Low	70 Å²	70	116.4 Å²	116.4	37%	0.374	58%	0.58	S	S	.	*			trans	-108.4	12.7	-167.5	-111.1	-7.6	0	0	0	115.7	N42 I43	D40-N42 PolarHBondContact O-N 3.04Å; D40-I43 PolarHBondContact O-N 2.97Å
41	S	63.3	Low	59.2	Low	84 Å²	84	120.4 Å²	120.4	59%	0.587	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-9.4	174.4	65	0	0	0	0	114.3
42	N	77.9	Confident	61	Low	81 Å²	81	114.6 Å²	114.6	43%	0.433	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.9	-9	178.6	-66.5	-38	0	0	0	114	D40 R365	D40-N42 PolarHBondContact O-N 3.04Å; N42-R365 WeakPolarHBondContact O-CB 3.28Å; N42-R365 PolarHBondContact O-N 3.42Å
43	I	81.1	Confident	63.7	Low	49 Å²	49	110.7 Å²	110.7	25%	0.251	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127	-171.7	-57.3	-179.9	0	0	0	110.2	D40 I362	D40-I43 PolarHBondContact O-N 2.97Å; I43-I362 HydrophobicContact CD1-CD1 4.47Å; I43-I362 HydrophobicContact CG2-CB 3.66Å; I43-I362 HydrophobicContact CG2-CD1 3.78Å; I43-I362 HydrophobicContact CG2-CG1 4.25Å; I43-I362 HydrophobicContact CG2-CG2 3.89Å
44	K	87.2	Confident	66.8	Low	99 Å²	99	101.6 Å²	101.6	43%	0.43	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	111.2	171.3	-176.4	177.3	-179.4	176	0	109.2	I46 I362 R363 W383	K44-I46 HydrophobicContact CD-CD1 3.86Å; K44-I46 HydrophobicContact CG-CD1 3.74Å; K44-I362 CarbonylContact O-C 3.57Å; K44-I362 WeakPolarHBondContact O-CA 3.25Å; K44-R363 HydrophobicContact CB-CB 4.45Å; K44-R363 PolarHBondContact N-O 3.4Å; K44-R363 PolarHBondContact O-N 2.97Å; K44-W383 HydrophobicContact CB-CD2 3.84Å; K44-W383 HydrophobicContact CB-CE3 3.54Å; K44-W383 HydrophobicContact CB-CH2 3.51Å; K44-W383 HydrophobicContact CB-CZ2 3.78Å; K44-W383 HydrophobicContact CB-CZ3 3.39Å; K44-W383 HydrophobicContact CD-CD2 4.2Å; K44-W383 HydrophobicContact CD-CZ2 4.34Å
45	V	86.4	Confident	70	Confident	49 Å²	49	98.1 Å²	98.1	30%	0.297	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132.4	172.3	-173.6	0	0	0	0	109.3	E48 R360 I362	V45-E48 HydrophobicContact CG1-CB 3.76Å; V45-E48 HydrophobicContact CG1-CG 4.49Å; V45-R360 HydrophobicContact CG1-CB 4.45Å; V45-I362 HydrophobicContact CB-CG2 4.45Å; V45-I362 HydrophobicContact CG1-CG2 4.49Å; V45-I362 HydrophobicContact CG2-CG2 4.03Å
46	I	88.5	Confident	72.9	Confident	49 Å²	49	91.2 Å²	91.2	25%	0.251	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-42.3	-178.3	-55	-60.6	0	0	0	111.2	K44 C361 R363 L386	K44-I46 HydrophobicContact CD-CD1 3.86Å; K44-I46 HydrophobicContact CG-CD1 3.74Å; I46-C361 PolarHBondContact N-O 3.04Å; I46-R363 HydrophobicContact CG1-CG 4.26Å; I46-R363 VanDerWaalsContact CG1-NH1 3.3Å; I46-L386 HydrophobicContact CB-CD1 3.95Å; I46-L386 HydrophobicContact CG1-CD1 3.68Å
47	Y	86.9	Confident	75.7	Confident	35 Å²	35	97 Å²	97	14%	0.137	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	122.6	178.6	-57.9	-72.9	0	0	0	108	T68 F148 C352 R360 C361 L386	Y47-T68 HydrophobicContact CD1-CG2 4.16Å; Y47-T68 VanDerWaalsContact CE1-OG1 3.31Å; Y47-T68 WeakPolarHBondContact CE1-OG1 3.48Å; Y47-F148 HydrophobicContact CD2-CE1 4.37Å; Y47-F148 AromaticContact CE2-CE1 3.68Å; Y47-F148 HydrophobicContact CE2-CE1 3.68Å; Y47-F148 AromaticContact CE2-CZ 3.68Å; Y47-F148 HydrophobicContact CE2-CZ 3.68Å; Y47-F148 AromaticContact CZ-CE1 3.99Å; Y47-C352 HydrophobicContact CD2-CB 4.28Å; Y47-R360 CarbonylContact O-C 3.52Å; Y47-R360 WeakPolarHBondContact O-CA 3.28Å; Y47-R360 WeakPolarHBondContact O-CB 3.43Å; Y47-C361 HydrophobicContact CD2-CB 4.13Å; Y47-C361 PolarHBondContact N-O 2.73Å; Y47-C361 PolarHBondContact O-N 3.42Å; Y47-L386 HydrophobicContact CD2-CD2 4.47Å; Y47-L386 HydrophobicContact CE2-CD2 4.02Å
48	E	88.9	Confident	78.1	Confident	102 Å²	102	93.1 Å²	93.1	48%	0.477	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	130.7	-179.9	-175.5	160.4	-135.4	0	0	110.6	V45 P66 R360	V45-E48 HydrophobicContact CG1-CB 3.76Å; V45-E48 HydrophobicContact CG1-CG 4.49Å; E48-P66 WeakPolarHBondContact O-CG 3.44Å; E48-R360 HydrophobicContact CB-CB 4.19Å; E48-R360 HydrophobicContact CG-CB 4.28Å; E48-R360 WeakPolarHBondContact OE1-CD 3.25Å; E48-R360 IonicContact OE1-NH1 2.68Å; E48-R360 PolarHBondContact OE1-NH1 3.42Å
49	A	82.9	Confident	80.6	Confident	18 Å²	18	91.4 Å²	91.4	15%	0.149	47%	0.472	C	S	.	.			trans	-78.4	128.5	178.8	0	0	0	0	0	109.8	R51 S52 N359	A49-R51 PolarHBondContact O-N 3.12Å; A49-R51 VanDerWaalsContact O-N 3.15Å; A49-S52 WeakPolarHBondContact CB-OG 3.36Å; A49-N359 PolarHBondContact N-O 2.99Å
50	T	77.5	Confident	82.9	Confident	142 Å²	142	83 Å²	83	87%	0.871	44%	0.439	S	S	*	.	S	Bend	trans	-63.2	-21.4	179.8	53.7	0	0	0	0	114
51	R	72.3	Confident	84.8	Confident	231 Å²	231	82.9 Å²	82.9	87%	0.872	44%	0.438	S	S	*	.	S	Bend	trans	-139.5	-0.3	-172.6	-65.6	-174.9	-179.5	179.9	0.3	115.9	A49 V53	A49-R51 PolarHBondContact O-N 3.12Å; A49-R51 VanDerWaalsContact O-N 3.15Å; R51-V53 PolarHBondContact O-N 3.08Å
52	S	69.2	Low	86.2	Confident	34 Å²	34	81.5 Å²	81.5	24%	0.238	42%	0.422	C	S	.	.			trans	-90.6	109.6	-176.8	92.6	0	0	0	0	111	A49 S64 N359	A49-S52 WeakPolarHBondContact CB-OG 3.36Å; S52-S64 PolarHBondContact OG-O 3.41Å; S52-N359 VanDerWaalsContact O-CB 3.24Å; S52-N359 WeakPolarHBondContact O-CB 3.46Å; S52-N359 PolarHBondContact O-ND2 3.04Å; S52-N359 WeakPolarHBondContact OG-CB 3.45Å
53	V	85	Confident	87	Confident	92 Å²	92	77.7 Å²	77.7	56%	0.558	40%	0.402	S	S	*	.			trans	-99.8	128.4	169.8	-164.4	0	0	0	0	106.8	R51 Y55 I61	R51-V53 PolarHBondContact O-N 3.08Å; V53-Y55 WeakPolarHBondContact CG1-O 3.4Å; V53-Y55 PolarHBondContact O-N 3.1Å; V53-Y55 VanDerWaalsContact O-N 3.13Å; V53-I61 WeakPolarHBondContact O-CD1 3.06Å; V53-I61 WeakPolarHBondContact O-CG1 3.44Å
54	C	94.1	Very high	87.6	Confident	4 Å²	4	76.4 Å²	76.4	3%	0.027	40%	0.397	C	S	.	.	S	Bend	trans	-68.3	-7.3	176.6	-59.3	0	0	0	0	113.3	A60 I61 C63 Q391 H392	C54-A60 WeakPolarHBondContact O-CA 2.96Å; C54-I61 PolarHBondContact O-N 3.08Å; C54-C63 HydrophobicContact CB-CB 3.84Å; C54-C63 WeakPolarHBondContact CB-SG 3.28Å; C54-C63 WeakPolarHBondContact SG-CB 3.4Å; C54-C63 CovalentContact SG-SG 2.03Å; C54-C63 PolarHBondContact SG-SG 2.8Å; C54-Q391 HydrophobicContact CB-CB 4.01Å; C54-Q391 HydrophobicContact CB-CG 4.05Å; C54-H392 PolarHBondContact O-NE2 2.91Å; C54-H392 VanDerWaalsContact O-NE2 3.12Å
55	Y	93.7	Very high	87.9	Confident	84 Å²	84	71.8 Å²	71.8	33%	0.329	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.5	179	-59	-89.6	0	0	0	110.1	V53 Q59 A60 Q391 H392	V53-Y55 WeakPolarHBondContact CG1-O 3.4Å; V53-Y55 PolarHBondContact O-N 3.1Å; V53-Y55 VanDerWaalsContact O-N 3.13Å; Y55-Q59 CarbonylContact C-O 3.59Å; Y55-Q59 VanDerWaalsContact CA-O 3.28Å; Y55-Q59 WeakPolarHBondContact CA-O 3.05Å; Y55-A60 HydrophobicContact CD1-CB 4.01Å; Y55-A60 HydrophobicContact CE1-CB 3.83Å; Y55-Q391 HydrophobicContact CE2-CB 4.39Å; Y55-H392 AromaticContact CZ-CD2 3.98Å; Y55-H392 PolarHBondContact OH-N 2.83Å
56	T	90.5	Very high	88.2	Confident	70 Å²	70	71 Å²	71	43%	0.429	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.6	172.8	-64	0	0	0	0	108.4	G58 Q59 I61	T56-G58 PolarHBondContact O-N 2.91Å; T56-G58 VanDerWaalsContact O-N 3.17Å; T56-Q59 PolarHBondContact N-O 2.81Å; T56-Q59 WeakPolarHBondContact O-CB 3.3Å; T56-Q59 PolarHBondContact O-N 3.28Å; T56-I61 VanDerWaalsContact OG1-CD1 3.26Å; T56-I61 WeakPolarHBondContact OG1-CD1 3.48Å
57	K	89.1	Confident	88.5	Confident	216 Å²	216	73.2 Å²	73.2	94%	0.939	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.9	-177.1	-58.4	178	-179.9	178.9	0	113.5	Q59	K57-Q59 PolarHBondContact O-N 3.11Å
58	G	86.7	Confident	88.8	Confident	73 Å²	73	73.4 Å²	73.4	75%	0.753	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-7.7	-177.9	0	0	0	0	0	115.3	T56	T56-G58 PolarHBondContact O-N 2.91Å; T56-G58 VanDerWaalsContact O-N 3.17Å
59	Q	91.1	Very high	89.1	Confident	144 Å²	144	70.3 Å²	70.3	67%	0.673	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.5	174.8	-174.2	175.7	-1.1	0	0	110.3	Y55 T56 K57	Y55-Q59 CarbonylContact C-O 3.59Å; Y55-Q59 VanDerWaalsContact CA-O 3.28Å; Y55-Q59 WeakPolarHBondContact CA-O 3.05Å; T56-Q59 PolarHBondContact N-O 2.81Å; T56-Q59 WeakPolarHBondContact O-CB 3.3Å; T56-Q59 PolarHBondContact O-N 3.28Å; K57-Q59 PolarHBondContact O-N 3.11Å
60	A	94.1	Very high	89.7	Confident	18 Å²	18	69.5 Å²	69.5	15%	0.149	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	134.5	173.1	0	0	0	0	0	110.6	C54 Y55 A419 D421	C54-A60 WeakPolarHBondContact O-CA 2.96Å; Y55-A60 HydrophobicContact CD1-CB 4.01Å; Y55-A60 HydrophobicContact CE1-CB 3.83Å; A60-A419 VanDerWaalsContact C-CB 3.43Å; A60-A419 HydrophobicContact CB-CB 3.66Å; A60-A419 WeakPolarHBondContact O-CB 3.36Å; A60-D421 HydrophobicContact CB-CB 4.29Å
61	I	94.1	Very high	90.5	Very high	66 Å²	66	62.7 Å²	62.7	34%	0.338	32%	0.324	S	S	.	.			trans	-130.2	155.3	175	59.8	161.3	0	0	0	109.6	V53 C54 T56 C63 H392	V53-I61 WeakPolarHBondContact O-CD1 3.06Å; V53-I61 WeakPolarHBondContact O-CG1 3.44Å; C54-I61 PolarHBondContact O-N 3.08Å; T56-I61 VanDerWaalsContact OG1-CD1 3.26Å; T56-I61 WeakPolarHBondContact OG1-CD1 3.48Å; I61-C63 PolarHBondContact O-N 2.92Å; I61-H392 PolarHBondContact O-CE1 3.35Å; I61-H392 PolarHBondContact O-NE2 3.44Å; I61-H392 VanDerWaalsContact O-NE2 3.11Å
62	E	93.3	Very high	91.5	Very high	55 Å²	55	56.7 Å²	56.7	26%	0.257	31%	0.306	S	S	.	.			trans	-55.8	132.7	174.2	-173.8	-168.9	167.1	0	0	110.8	T415 S416	E62-T415 WeakPolarHBondContact CB-O 3.35Å; E62-T415 WeakPolarHBondContact OE2-CA 3.48Å; E62-S416 PolarHBondContact OE2-N 3.03Å
63	C	94.5	Very high	92.4	Very high	2 Å²	2	60 Å²	60	1%	0.014	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-134.6	138.7	173.9	58.7	0	0	0	0	110.6	C54 I61 G356 H357 A358 N359	C54-C63 HydrophobicContact CB-CB 3.84Å; C54-C63 WeakPolarHBondContact CB-SG 3.28Å; C54-C63 WeakPolarHBondContact SG-CB 3.4Å; C54-C63 CovalentContact SG-SG 2.03Å; C54-C63 PolarHBondContact SG-SG 2.8Å; I61-C63 PolarHBondContact O-N 2.92Å; C63-G356 PolarHBondContact N-O 3.12Å; C63-G356 VanDerWaalsContact N-O 3.07Å; C63-G356 CarbonylContact O-C 3.29Å; C63-G356 WeakPolarHBondContact O-CA 3.36Å; C63-H357 PolarHBondContact O-N 3.46Å; C63-A358 CarbonylContact C-O 3.56Å; C63-A358 PolarHBondContact O-N 3.12Å; C63-A358 VanDerWaalsContact O-O 3.07Å; C63-A358 PolarHBondContact SG-N 2.9Å; C63-N359 HydrophobicContact CB-CB 4.35Å
64	S	92.8	Very high	92.7	Very high	22 Å²	22	57 Å²	57	15%	0.154	31%	0.311	C	S	.	.			trans	-132.7	151.2	178.7	-72.2	0	0	0	0	110.4	S52 A358	S52-S64 PolarHBondContact OG-O 3.41Å; S64-A358 CarbonylContact C-O 3.59Å; S64-A358 VanDerWaalsContact C-O 3.24Å; S64-A358 WeakPolarHBondContact CA-O 3.18Å; S64-A358 PolarHBondContact N-O 2.87Å
65	P	94.3	Very high	92.6	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.006	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-62.5	161.2	169.6	-20.2	35.9	0	0	0	111.2	C352 C354 A358 N359	P65-C352 HydrophobicContact CB-CB 4.16Å; P65-C352 HydrophobicContact CG-CB 4.03Å; P65-C354 HydrophobicContact CG-CB 4.36Å; P65-C354 VanDerWaalsContact CG-SG 3.59Å; P65-A358 WeakPolarHBondContact CD-O 3.22Å; P65-N359 WeakPolarHBondContact CA-O 3.23Å
66	P	93.6	Very high	92.6	Very high	34 Å²	34	59.8 Å²	59.8	22%	0.221	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-64.2	156.4	-177.5	29.7	-37.1	0	0	0	111.8	E48 T68 R351	E48-P66 WeakPolarHBondContact O-CG 3.44Å; P66-T68 HydrophobicContact CB-CG2 4.23Å; P66-T68 HydrophobicContact CG-CG2 4.1Å; P66-R351 VanDerWaalsContact O-CB 3.31Å; P66-R351 WeakPolarHBondContact O-CB 3.28Å
67	F	93.6	Very high	92.9	Very high	94 Å²	94	64.3 Å²	64.3	41%	0.412	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-80.8	125.4	167.6	-176.7	-90	0	0	0	109.2	Y151 Y152 G349 G350	F67-Y151 HydrophobicContact CD2-CD2 4.1Å; F67-Y151 HydrophobicContact CD2-CE2 4.45Å; F67-Y151 AromaticContact CE2-CD2 3.67Å; F67-Y151 HydrophobicContact CE2-CD2 3.67Å; F67-Y151 HydrophobicContact CE2-CE2 4.44Å; F67-Y151 AromaticContact CE2-CG 3.82Å; F67-Y151 HydrophobicContact CE2-CG 3.82Å; F67-Y152 HydrophobicContact CE1-CE1 4.02Å; F67-Y152 HydrophobicContact CZ-CD1 4.07Å; F67-Y152 AromaticContact CZ-CE1 3.62Å; F67-Y152 HydrophobicContact CZ-CE1 3.62Å; F67-G349 VanDerWaalsContact CZ-C 3.48Å; F67-G350 WeakPolarHBondContact CA-O 3.27Å
68	T	93.9	Very high	93.1	Very high	39 Å²	39	55.1 Å²	55.1	24%	0.239	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	171.1	-175.7	65.1	0	0	0	0	111.2	Y47 P66 I70 G350	Y47-T68 HydrophobicContact CD1-CG2 4.16Å; Y47-T68 VanDerWaalsContact CE1-OG1 3.31Å; Y47-T68 WeakPolarHBondContact CE1-OG1 3.48Å; P66-T68 HydrophobicContact CB-CG2 4.23Å; P66-T68 HydrophobicContact CG-CG2 4.1Å; T68-I70 PolarHBondContact O-N 3.39Å; T68-G350 PolarHBondContact N-O 3.17Å; T68-G350 PolarHBondContact O-N 2.82Å
69	N	95.3	Very high	93.5	Very high	38 Å²	38	55.6 Å²	55.6	20%	0.203	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	108.1	161	-176.4	4.7	0	0	0	108.4	A71 E72 S347 I348	N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.49Å; N69-A71 PolarHBondContact OD1-N 3.49Å; N69-A71 VanDerWaalsContact OD1-N 3.15Å; N69-E72 HydrophobicContact CB-CB 4.48Å; N69-S347 PolarHBondContact ND2-OG 3.36Å; N69-I348 CarbonylContact C-O 3.54Å; N69-I348 WeakPolarHBondContact CA-O 3.37Å; N69-I348 PolarHBondContact OD1-N 2.83Å; N69-I348 PolarHBondContact OD1-O 2.92Å
70	I	95.1	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.1	-175.7	67.8	178.3	0	0	0	112.9	T68 V74 L144 F148 V150 I348	T68-I70 PolarHBondContact O-N 3.39Å; I70-V74 WeakPolarHBondContact O-CG2 2.9Å; I70-L144 HydrophobicContact CB-CD2 4.43Å; I70-L144 HydrophobicContact CD1-CD1 3.65Å; I70-L144 HydrophobicContact CD1-CD2 4.38Å; I70-L144 HydrophobicContact CG1-CD1 4.33Å; I70-L144 HydrophobicContact CG1-CD2 4.2Å; I70-L144 VanDerWaalsContact O-CD2 3.27Å; I70-L144 WeakPolarHBondContact O-CD2 3.17Å; I70-F148 HydrophobicContact CB-CD1 4.01Å; I70-F148 HydrophobicContact CB-CE1 4.01Å; I70-F148 HydrophobicContact CD1-CB 3.56Å; I70-F148 HydrophobicContact CD1-CD1 3.73Å; I70-F148 HydrophobicContact CD1-CD2 4.34Å; I70-F148 HydrophobicContact CD1-CG 3.63Å; I70-F148 HydrophobicContact CG1-CD1 4.48Å; I70-F148 HydrophobicContact CG2-CD1 3.55Å; I70-F148 HydrophobicContact CG2-CE1 3.64Å; I70-F148 HydrophobicContact CG2-CG 4.5Å; I70-V150 HydrophobicContact CD1-CG2 3.99Å; I70-I348 HydrophobicContact CD1-CB 4.45Å; I70-I348 HydrophobicContact CD1-CG2 3.68Å; I70-I348 HydrophobicContact CG1-CB 3.8Å; I70-I348 HydrophobicContact CG1-CG2 3.58Å; I70-I348 WeakPolarHBondContact CG1-O 3.46Å; I70-I348 PolarHBondContact N-O 2.98Å
71	A	95.1	Very high	93.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.8	174.4	0	0	0	0	0	112.7	N69 S73 V74 T116 L142 I348	N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.49Å; N69-A71 PolarHBondContact OD1-N 3.49Å; N69-A71 VanDerWaalsContact OD1-N 3.15Å; A71-S73 PolarHBondContact O-N 3.05Å; A71-V74 WeakPolarHBondContact O-CB 3.42Å; A71-V74 WeakPolarHBondContact O-CG2 3.47Å; A71-V74 PolarHBondContact O-N 3.07Å; A71-T116 HydrophobicContact CB-CG2 4.24Å; A71-T116 WeakPolarHBondContact O-CB 3.41Å; A71-T116 WeakPolarHBondContact O-CG2 3.25Å; A71-L142 HydrophobicContact CB-CD1 3.82Å; A71-I348 HydrophobicContact CB-CB 4.1Å; A71-I348 HydrophobicContact CB-CD1 3.92Å; A71-I348 HydrophobicContact CB-CG1 3.83Å
72	E	92.2	Very high	93.2	Very high	105 Å²	105	47.5 Å²	47.5	49%	0.491	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	126.8	-177.4	-172.8	174.4	-170.4	0	0	111.2	N69 V74	N69-E72 HydrophobicContact CB-CB 4.48Å; E72-V74 PolarHBondContact O-N 3.06Å
73	S	87.6	Confident	92.7	Very high	103 Å²	103	45.2 Å²	45.2	72%	0.72	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	24	-177.5	-51.6	0	0	0	0	115.3	A71 T116	A71-S73 PolarHBondContact O-N 3.05Å; S73-T116 PolarHBondContact N-O 3.46Å
74	V	91.7	Very high	91.9	Very high	29 Å²	29	50.4 Å²	50.4	18%	0.176	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-94.5	126	174.4	-179.1	0	0	0	0	110.2	I70 A71 E72 I76 T116 L142 L144	I70-V74 WeakPolarHBondContact O-CG2 2.9Å; A71-V74 WeakPolarHBondContact O-CB 3.42Å; A71-V74 WeakPolarHBondContact O-CG2 3.47Å; A71-V74 PolarHBondContact O-N 3.07Å; E72-V74 PolarHBondContact O-N 3.06Å; V74-I76 PolarHBondContact O-N 3.32Å; V74-T116 PolarHBondContact O-OG1 3.22Å; V74-L142 HydrophobicContact CB-CD1 4.28Å; V74-L142 HydrophobicContact CB-CG 4.42Å; V74-L142 HydrophobicContact CG1-CD1 4.15Å; V74-L142 HydrophobicContact CG1-CD2 4.09Å; V74-L142 HydrophobicContact CG1-CG 3.75Å; V74-L144 HydrophobicContact CG2-CD2 4.38Å
75	D	91.8	Very high	90.8	Very high	140 Å²	140	56.6 Å²	56.6	75%	0.749	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-62.4	123	177.3	-63.5	-36.2	0	0	0	112.2
76	I	94.9	Very high	89.3	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.5	175.9	-64.2	177.2	0	0	0	110.3	V74 T112 L115 T116 L140 L142 L346	V74-I76 PolarHBondContact O-N 3.32Å; I76-T112 VanDerWaalsContact O-CB 3.31Å; I76-T112 WeakPolarHBondContact O-CB 3.45Å; I76-T112 PolarHBondContact O-OG1 2.98Å; I76-L115 HydrophobicContact CD1-CB 3.78Å; I76-L115 HydrophobicContact CD1-CD1 3.95Å; I76-L115 HydrophobicContact CG2-CD1 4.27Å; I76-T116 HydrophobicContact CD1-CG2 3.48Å; I76-T116 VanDerWaalsContact CD1-CG2 3.48Å; I76-T116 HydrophobicContact CG1-CG2 4.05Å; I76-L140 HydrophobicContact CG2-CB 4.09Å; I76-L140 HydrophobicContact CG2-CD2 4.36Å; I76-L142 HydrophobicContact CD1-CD1 4.22Å; I76-L142 HydrophobicContact CG1-CB 4.29Å; I76-L142 HydrophobicContact CG1-CD1 4.06Å; I76-L142 HydrophobicContact CG1-CG 4.42Å; I76-L346 HydrophobicContact CD1-CD2 3.66Å
77	K	95.2	Very high	88.1	Confident	166 Å²	166	66.1 Å²	66.1	72%	0.722	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.5	172.4	-64.3	-178	-178.7	178.7	0	110.2	L140 T141	K77-L140 CarbonylContact O-C 3.53Å; K77-L140 WeakPolarHBondContact O-CA 2.99Å; K77-T141 PolarHBondContact N-O 2.93Å; K77-T141 PolarHBondContact O-N 3.48Å
78	A	94.9	Very high	87.2	Confident	23 Å²	23	66.1 Å²	66.1	19%	0.19	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	146.3	171.7	0	0	0	0	0	111.1	S80 T112 W127 N139 L140	A78-S80 VanDerWaalsContact C-N 3.34Å; A78-T112 HydrophobicContact CB-CG2 3.49Å; A78-T112 VanDerWaalsContact CB-CG2 3.49Å; A78-W127 HydrophobicContact CB-CZ2 4.04Å; A78-N139 CarbonylContact C-O 3.48Å; A78-N139 WeakPolarHBondContact CA-O 3.07Å; A78-L140 HydrophobicContact CB-CD2 3.57Å
79	T	94.4	Very high	86.6	Confident	82 Å²	82	65.8 Å²	65.8	50%	0.503	35%	0.353	S	S	.	.	S	Bend	trans	-77.4	-20.8	172.3	53.9	0	0	0	0	113.5	N139	T79-N139 HydrophobicContact CG2-CB 3.77Å; T79-N139 PolarHBondContact N-O 3.23Å; T79-N139 PolarHBondContact OG1-N 2.79Å
80	S	91.4	Very high	86	Confident	28 Å²	28	70.1 Å²	70.1	20%	0.196	37%	0.371	C	S	.	.			trans	-148.8	127	178.1	175.6	0	0	0	0	108.8	A78 W127 G130	A78-S80 VanDerWaalsContact C-N 3.34Å; S80-W127 WeakPolarHBondContact O-CZ2 3.29Å; S80-G130 VanDerWaalsContact OG-CA 3.26Å; S80-G130 WeakPolarHBondContact OG-CA 3.45Å; S80-G130 PolarHBondContact OG-N 3.09Å
81	T	91.7	Very high	85.3	Confident	23 Å²	23	70.6 Å²	70.6	14%	0.141	37%	0.374	C	S	.	.			trans	-135.4	140.3	170.9	-59.4	0	0	0	0	106.9	Q84 W127	T81-Q84 WeakPolarHBondContact O-CB 3.1Å; T81-Q84 PolarHBondContact O-N 3.33Å; T81-W127 PolarHBondContact OG1-NE1 2.69Å; T81-W127 VanDerWaalsContact OG1-NE1 3.12Å
82	C	89.6	Confident	84.5	Confident	8 Å²	8	73 Å²	73	5%	0.054	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	149.2	-179.7	72.1	0	0	0	0	110.6	Q84 E89 I91 C104 V128	C82-Q84 VanDerWaalsContact C-N 3.27Å; C82-Q84 PolarHBondContact O-N 2.9Å; C82-E89 WeakPolarHBondContact CA-OE2 3.19Å; C82-E89 VanDerWaalsContact CB-OE2 3.27Å; C82-E89 WeakPolarHBondContact CB-OE2 3.11Å; C82-I91 HydrophobicContact CB-CD1 4.34Å; C82-C104 HydrophobicContact CB-CB 3.67Å; C82-C104 WeakPolarHBondContact CB-SG 3.41Å; C82-C104 PolarHBondContact O-SG 3.26Å; C82-C104 VanDerWaalsContact O-SG 3.38Å; C82-C104 WeakPolarHBondContact SG-CB 3.41Å; C82-C104 CovalentContact SG-SG 2.03Å; C82-C104 PolarHBondContact SG-SG 3.12Å; C82-V128 PolarHBondContact N-O 2.99Å; C82-V128 VanDerWaalsContact N-O 3.12Å
83	G	83.2	Confident	83.6	Confident	7 Å²	7	71.7 Å²	71.7	7%	0.072	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	0.2	178.5	0	0	0	0	0	116.5	F85	G83-F85 VanDerWaalsContact C-N 3.35Å; G83-F85 PolarHBondContact O-N 2.86Å
84	Q	77.2	Confident	82.7	Confident	111 Å²	111	75 Å²	75	52%	0.519	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.6	-176.9	-173.1	171.9	4.2	0	0	114.3	T81 C82	T81-Q84 WeakPolarHBondContact O-CB 3.1Å; T81-Q84 PolarHBondContact O-N 3.33Å; C82-Q84 VanDerWaalsContact C-N 3.27Å; C82-Q84 PolarHBondContact O-N 2.9Å
85	F	70.5	Confident	81.4	Confident	152 Å²	152	77.1 Å²	77.1	67%	0.667	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	26.9	-173.5	-63.8	-71.7	0	0	0	114.2	G83 Q87	G83-F85 VanDerWaalsContact C-N 3.35Å; G83-F85 PolarHBondContact O-N 2.86Å; F85-Q87 PolarHBondContact O-N 2.73Å
86	D	63.5	Low	79.9	Confident	103 Å²	103	79.2 Å²	79.2	55%	0.551	40%	0.399	S	S	*	.	S	Bend	trans	56.7	15.8	-173.9	-69	-23.9	0	0	0	114.1	K106	D86-K106 WeakPolarHBondContact OD1-CD 3.36Å; D86-K106 WeakPolarHBondContact OD1-CE 3.27Å; D86-K106 IonicContact OD1-NZ 2.72Å; D86-K106 PolarHBondContact OD1-NZ 3.16Å; D86-K106 IonicContact OD2-NZ 2.81Å; D86-K106 PolarHBondContact OD2-NZ 3.48Å
87	Q	67.4	Low	78.5	Confident	132 Å²	132	82.4 Å²	82.4	62%	0.617	43%	0.433	S	S	*	.			trans	-96.1	110.2	171.1	-67.8	178.2	5.6	0	0	107.4	F85 E89	F85-Q87 PolarHBondContact O-N 2.73Å; Q87-E89 PolarHBondContact O-N 3.28Å
88	S	75.2	Confident	77.3	Confident	93 Å²	93	81.5 Å²	81.5	65%	0.65	43%	0.431	S	S	*	.			trans	-67.1	113.8	169.2	-67.8	0	0	0	0	108.5	C104	S88-C104 WeakPolarHBondContact CA-O 3.08Å
89	E	80.8	Confident	76.3	Confident	33 Å²	33	85.4 Å²	85.4	15%	0.154	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.8	174.8	-64.3	-176.9	144.7	0	0	109.5	C82 Q87 C104 G130 S131 H340	C82-E89 WeakPolarHBondContact CA-OE2 3.19Å; C82-E89 VanDerWaalsContact CB-OE2 3.27Å; C82-E89 WeakPolarHBondContact CB-OE2 3.11Å; Q87-E89 PolarHBondContact O-N 3.28Å; E89-C104 PolarHBondContact N-O 2.96Å; E89-C104 PolarHBondContact O-N 2.95Å; E89-G130 VanDerWaalsContact OE2-CA 3.32Å; E89-G130 WeakPolarHBondContact OE2-CA 3.32Å; E89-S131 PolarHBondContact OE1-N 2.68Å; E89-S131 VanDerWaalsContact OE1-N 3.08Å; E89-S131 PolarHBondContact OE1-OG 3.47Å; E89-H340 IonicContact OE2-CE1 2.7Å; E89-H340 PolarHBondContact OE2-CE1 2.93Å; E89-H340 IonicContact OE2-ND1 3.38Å
90	E	81.7	Confident	75.6	Confident	128 Å²	128	87.4 Å²	87.4	60%	0.598	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.1	173.9	-174.2	173.1	-155.2	0	0	109.4	C101	E90-C101 HydrophobicContact CG-CB 3.72Å; E90-C101 WeakPolarHBondContact OE1-CB 3.02Å
91	I	81	Confident	75.3	Confident	11 Å²	11	88.3 Å²	88.3	6%	0.056	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.1	-179.5	-56.7	162.2	0	0	0	108.1	C82 C101 E102 C104 F110 V128	C82-I91 HydrophobicContact CB-CD1 4.34Å; I91-C101 CarbonylContact O-C 3.53Å; I91-C101 VanDerWaalsContact O-CA 3.32Å; I91-C101 WeakPolarHBondContact O-CA 3.45Å; I91-E102 PolarHBondContact N-O 3.27Å; I91-E102 PolarHBondContact O-N 2.81Å; I91-C104 HydrophobicContact CD1-CB 3.46Å; I91-C104 VanDerWaalsContact CD1-CB 3.46Å; I91-C104 HydrophobicContact CG1-CB 4.2Å; I91-F110 HydrophobicContact CD1-CD2 4.31Å; I91-F110 HydrophobicContact CD1-CE2 4.19Å; I91-F110 HydrophobicContact CD1-CZ 4.43Å; I91-V128 HydrophobicContact CD1-CB 4.05Å; I91-V128 HydrophobicContact CD1-CG1 3.7Å; I91-V128 HydrophobicContact CD1-CG2 4.18Å; I91-V128 HydrophobicContact CG1-CG1 4.22Å; I91-V128 HydrophobicContact CG2-CG1 4.32Å
92	C	79.5	Confident	74.9	Confident	50 Å²	50	90.4 Å²	90.4	34%	0.338	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.4	177	-60.2	0	0	0	0	111.5	E99 C101	C92-E99 HydrophobicContact CB-CG 3.66Å; C92-E99 VanDerWaalsContact CB-OE1 3.25Å; C92-E99 WeakPolarHBondContact CB-OE1 3.37Å; C92-C101 HydrophobicContact CB-CB 4.13Å; C92-C101 WeakPolarHBondContact CB-SG 3.28Å; C92-C101 WeakPolarHBondContact SG-CB 3.43Å; C92-C101 CovalentContact SG-SG 2.05Å; C92-C101 PolarHBondContact SG-SG 3.29Å
93	R	72.5	Confident	74.6	Confident	77 Å²	77	95 Å²	95	29%	0.291	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.8	173.4	-63.4	-175	-176	-168.9	-0.3	109.5	V95 K100 S342	R93-V95 HydrophobicContact CB-CG2 4.28Å; R93-V95 PolarHBondContact O-N 3.01Å; R93-K100 PolarHBondContact N-O 3.29Å; R93-K100 PolarHBondContact O-N 3.17Å; R93-S342 PolarHBondContact NH2-OG 3.26Å
94	Y	67.8	Low	74.7	Confident	172 Å²	172	94.8 Å²	94.8	68%	0.675	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	107.7	171.3	-78.2	-95.6	0	0	0	109.3	E99	Y94-E99 HydrophobicContact CD1-CB 4.48Å; Y94-E99 HydrophobicContact CE1-CB 4.14Å; Y94-E99 HydrophobicContact CE2-CB 4.49Å; Y94-E99 HydrophobicContact CE2-CG 4.16Å; Y94-E99 PolarHBondContact OH-OE2 2.03Å
95	V	66	Low	74.7	Confident	75 Å²	75	90.7 Å²	90.7	46%	0.455	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.5	177.5	-176.7	0	0	0	0	108	R93 G97 H98	R93-V95 HydrophobicContact CB-CG2 4.28Å; R93-V95 PolarHBondContact O-N 3.01Å; V95-G97 PolarHBondContact O-N 3.01Å; V95-G97 VanDerWaalsContact O-N 3.12Å; V95-H98 PolarHBondContact N-O 3.16Å; V95-H98 PolarHBondContact O-N 3.08Å; V95-H98 VanDerWaalsContact O-O 3.08Å
96	M	59.5	Low	74.5	Confident	184 Å²	184	91.1 Å²	91.1	91%	0.906	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	35.7	175.1	-64.9	-85	-69.1	0	0	113.8	H98	M96-H98 VanDerWaalsContact C-N 3.31Å; M96-H98 PolarHBondContact O-N 2.59Å
97	G	65.8	Low	74.6	Confident	72 Å²	72	88.8 Å²	88.8	74%	0.742	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-1.4	-179.8	0	0	0	0	0	115.7	V95	V95-G97 PolarHBondContact O-N 3.01Å; V95-G97 VanDerWaalsContact O-N 3.12Å
98	H	69.4	Low	74.8	Confident	147 Å²	147	90 Å²	90	68%	0.681	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.8	173	-68.4	-75.8	0	0	0	111.3	V95 M96 K100	V95-H98 PolarHBondContact N-O 3.16Å; V95-H98 PolarHBondContact O-N 3.08Å; V95-H98 VanDerWaalsContact O-O 3.08Å; M96-H98 VanDerWaalsContact C-N 3.31Å; M96-H98 PolarHBondContact O-N 2.59Å; H98-K100 PolarHBondContact O-N 2.86Å
99	E	75.1	Confident	75.1	Confident	105 Å²	105	91.7 Å²	91.7	49%	0.491	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	112.2	172.2	-170.5	167.7	-142.5	0	0	108.9	C92 Y94	C92-E99 HydrophobicContact CB-CG 3.66Å; C92-E99 VanDerWaalsContact CB-OE1 3.25Å; C92-E99 WeakPolarHBondContact CB-OE1 3.37Å; Y94-E99 HydrophobicContact CD1-CB 4.48Å; Y94-E99 HydrophobicContact CE1-CB 4.14Å; Y94-E99 HydrophobicContact CE2-CB 4.49Å; Y94-E99 HydrophobicContact CE2-CG 4.16Å; Y94-E99 PolarHBondContact OH-OE2 2.03Å
100	K	79.8	Confident	75.4	Confident	124 Å²	124	91 Å²	91	54%	0.539	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.1	174.4	-172.1	-175.8	179.1	-159.5	0	108.4	R93 H98 E102	R93-K100 PolarHBondContact N-O 3.29Å; R93-K100 PolarHBondContact O-N 3.17Å; H98-K100 PolarHBondContact O-N 2.86Å; K100-E102 IonicContact NZ-OE1 3.38Å; K100-E102 PolarHBondContact NZ-OE1 2.94Å
101	C	83.6	Confident	75.7	Confident	48 Å²	48	85.5 Å²	85.5	32%	0.324	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	138.2	178.7	-53.5	0	0	0	0	111.4	E90 I91 C92	E90-C101 HydrophobicContact CG-CB 3.72Å; E90-C101 WeakPolarHBondContact OE1-CB 3.02Å; I91-C101 CarbonylContact O-C 3.53Å; I91-C101 VanDerWaalsContact O-CA 3.32Å; I91-C101 WeakPolarHBondContact O-CA 3.45Å; C92-C101 HydrophobicContact CB-CB 4.13Å; C92-C101 WeakPolarHBondContact CB-SG 3.28Å; C92-C101 WeakPolarHBondContact SG-CB 3.43Å; C92-C101 CovalentContact SG-SG 2.05Å; C92-C101 PolarHBondContact SG-SG 3.29Å
102	E	83.8	Confident	76.2	Confident	67 Å²	67	86.5 Å²	86.5	31%	0.313	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.8	174.7	-63	-171	-170.7	0	0	109.6	I91 K100 K109	I91-E102 PolarHBondContact N-O 3.27Å; I91-E102 PolarHBondContact O-N 2.81Å; K100-E102 IonicContact NZ-OE1 3.38Å; K100-E102 PolarHBondContact NZ-OE1 2.94Å; E102-K109 IonicContact OE2-NZ 2.74Å; E102-K109 PolarHBondContact OE2-NZ 3.26Å
103	T	84.1	Confident	76.8	Confident	104 Å²	104	87.8 Å²	87.8	64%	0.638	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.5	177.7	50.4	0	0	0	0	110.9
104	C	84.2	Confident	77.7	Confident	2 Å²	2	84.9 Å²	84.9	1%	0.014	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	92.4	170.2	-176.4	0	0	0	0	110	C82 S88 E89 I91 F110	C82-C104 HydrophobicContact CB-CB 3.67Å; C82-C104 WeakPolarHBondContact CB-SG 3.41Å; C82-C104 PolarHBondContact O-SG 3.26Å; C82-C104 VanDerWaalsContact O-SG 3.38Å; C82-C104 WeakPolarHBondContact SG-CB 3.41Å; C82-C104 CovalentContact SG-SG 2.03Å; C82-C104 PolarHBondContact SG-SG 3.12Å; S88-C104 WeakPolarHBondContact CA-O 3.08Å; E89-C104 PolarHBondContact N-O 2.96Å; E89-C104 PolarHBondContact O-N 2.95Å; I91-C104 HydrophobicContact CD1-CB 3.46Å; I91-C104 VanDerWaalsContact CD1-CB 3.46Å; I91-C104 HydrophobicContact CG1-CB 4.2Å; C104-F110 HydrophobicContact CB-CD2 3.9Å; C104-F110 HydrophobicContact CB-CE2 4.08Å; C104-F110 VanDerWaalsContact SG-CD2 3.58Å
105	G	77.4	Confident	78.9	Confident	25 Å²	25	76.7 Å²	76.7	26%	0.258	42%	0.417	S	S	.	.			trans	-91	-173	173.6	0	0	0	0	0	113.2	G107	G105-G107 VanDerWaalsContact C-N 3.32Å; G105-G107 PolarHBondContact O-N 3.12Å
106	K	67.5	Low	80.2	Confident	162 Å²	162	73.3 Å²	73.3	70%	0.704	40%	0.397	S	S	*	.	S	Bend	trans	-67	85.2	175	-161.5	-170.7	-153.8	144.1	0	110.3	D86	D86-K106 WeakPolarHBondContact OD1-CD 3.36Å; D86-K106 WeakPolarHBondContact OD1-CE 3.27Å; D86-K106 IonicContact OD1-NZ 2.72Å; D86-K106 PolarHBondContact OD1-NZ 3.16Å; D86-K106 IonicContact OD2-NZ 2.81Å; D86-K106 PolarHBondContact OD2-NZ 3.48Å
107	G	65	Low	81.8	Confident	54 Å²	54	66.6 Å²	66.6	56%	0.557	37%	0.365	S	S	*	.	S	Bend	trans	-167.6	155.1	-179.5	0	0	0	0	0	112.2	G105 K109	G105-G107 VanDerWaalsContact C-N 3.32Å; G105-G107 PolarHBondContact O-N 3.12Å; G107-K109 PolarHBondContact O-N 3.3Å; G107-K109 VanDerWaalsContact O-N 3.08Å
108	E	71.8	Confident	82.9	Confident	157 Å²	157	72.5 Å²	72.5	73%	0.734	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-72.1	1.6	-175.2	-67.1	-165.6	156.7	0	0	114.4	F110 G111 H113	E108-F110 PolarHBondContact O-N 3.05Å; E108-G111 PolarHBondContact O-N 3.17Å; E108-H113 PolarHBondContact O-CE1 3.45Å; E108-H113 VanDerWaalsContact O-CE1 3.29Å
109	K	81.3	Confident	83.7	Confident	128 Å²	128	67.6 Å²	67.6	56%	0.557	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-55.4	-27.7	-173.5	-173.6	-179.8	170.8	-165.9	0	114.5	E102 G107 L114	E102-K109 IonicContact OE2-NZ 2.74Å; E102-K109 PolarHBondContact OE2-NZ 3.26Å; G107-K109 PolarHBondContact O-N 3.3Å; G107-K109 VanDerWaalsContact O-N 3.08Å; K109-L114 WeakPolarHBondContact O-CD1 3.49Å
110	F	85.9	Confident	84.2	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.079	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-125.7	24.7	179.6	-57.9	-70.5	0	0	0	112.4	I91 C104 E108 W127 V128	I91-F110 HydrophobicContact CD1-CD2 4.31Å; I91-F110 HydrophobicContact CD1-CE2 4.19Å; I91-F110 HydrophobicContact CD1-CZ 4.43Å; C104-F110 HydrophobicContact CB-CD2 3.9Å; C104-F110 HydrophobicContact CB-CE2 4.08Å; C104-F110 VanDerWaalsContact SG-CD2 3.58Å; E108-F110 PolarHBondContact O-N 3.05Å; F110-W127 VanDerWaalsContact O-CD1 3.24Å; F110-V128 HydrophobicContact CB-CB 4.2Å; F110-V128 HydrophobicContact CB-CG2 4.18Å; F110-V128 HydrophobicContact CD1-CB 4.46Å; F110-V128 HydrophobicContact CD1-CG2 3.59Å; F110-V128 HydrophobicContact CE1-CG2 4.21Å; F110-V128 HydrophobicContact CG-CB 4.44Å; F110-V128 HydrophobicContact CG-CG2 4.05Å; F110-V128 PolarHBondContact O-N 3.46Å
111	G	89.2	Confident	84.2	Confident	13 Å²	13	67.3 Å²	67.3	13%	0.134	34%	0.344	C	S	.	.			trans	-67.1	163.8	-176.9	0	0	0	0	0	113.8	E108 H113 L114	E108-G111 PolarHBondContact O-N 3.17Å; G111-H113 PolarHBondContact O-N 3.07Å; G111-L114 WeakPolarHBondContact O-CB 3.42Å; G111-L114 PolarHBondContact O-N 2.9Å
112	T	91.6	Very high	84.2	Confident	32 Å²	32	72.8 Å²	72.8	20%	0.196	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-68.6	-18.6	-177.9	51.8	0	0	0	0	114.2	I76 A78 L114 L115	I76-T112 VanDerWaalsContact O-CB 3.31Å; I76-T112 WeakPolarHBondContact O-CB 3.45Å; I76-T112 PolarHBondContact O-OG1 2.98Å; A78-T112 HydrophobicContact CB-CG2 3.49Å; A78-T112 VanDerWaalsContact CB-CG2 3.49Å; T112-L114 PolarHBondContact O-N 2.89Å; T112-L115 WeakPolarHBondContact O-CB 3.29Å; T112-L115 PolarHBondContact O-N 2.87Å; T112-L115 VanDerWaalsContact O-N 3.15Å
113	H	90.7	Very high	84.3	Confident	77 Å²	77	75 Å²	75	36%	0.356	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-63.2	-25.5	177	67.5	-86.8	0	0	0	112.5	E108 G111 L115 T116 D117	E108-H113 PolarHBondContact O-CE1 3.45Å; E108-H113 VanDerWaalsContact O-CE1 3.29Å; G111-H113 PolarHBondContact O-N 3.07Å; H113-L115 PolarHBondContact O-N 3.38Å; H113-T116 PolarHBondContact O-N 2.05Å; H113-T116 VanDerWaalsContact O-N 3.17Å; H113-T116 PolarHBondContact O-OG1 3.36Å; H113-D117 PolarHBondContact O-N 2.94Å
114	L	92	Very high	84.2	Confident	16 Å²	16	74.2 Å²	74.2	8%	0.084	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-71.3	-5.1	176.1	-56.4	176.4	0	0	0	113.8	K109 G111 T112 T116 T125	K109-L114 WeakPolarHBondContact O-CD1 3.49Å; G111-L114 WeakPolarHBondContact O-CB 3.42Å; G111-L114 PolarHBondContact O-N 2.9Å; T112-L114 PolarHBondContact O-N 2.89Å; L114-T116 VanDerWaalsContact C-N 3.33Å; L114-T125 HydrophobicContact CD2-CG2 4.07Å
115	L	93.5	Very high	84.5	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-83.2	-16	171.2	-70.4	168.3	0	0	0	112.1	I76 T112 H113 W127 L140 F343 L346	I76-L115 HydrophobicContact CD1-CB 3.78Å; I76-L115 HydrophobicContact CD1-CD1 3.95Å; I76-L115 HydrophobicContact CG2-CD1 4.27Å; T112-L115 WeakPolarHBondContact O-CB 3.29Å; T112-L115 PolarHBondContact O-N 2.87Å; T112-L115 VanDerWaalsContact O-N 3.15Å; H113-L115 PolarHBondContact O-N 3.38Å; L115-W127 HydrophobicContact CD1-CB 4.11Å; L115-W127 HydrophobicContact CD1-CD2 4.11Å; L115-W127 HydrophobicContact CD1-CE3 4.28Å; L115-W127 HydrophobicContact CD1-CG 4.03Å; L115-W127 HydrophobicContact CD2-CB 3.84Å; L115-W127 HydrophobicContact CD2-CE3 4.26Å; L115-W127 HydrophobicContact CD2-CG 4.45Å; L115-W127 HydrophobicContact CG-CB 3.64Å; L115-W127 HydrophobicContact CG-CG 4.13Å; L115-L140 HydrophobicContact CD1-CD1 4.03Å; L115-L140 HydrophobicContact CD1-CD2 4.37Å; L115-F343 HydrophobicContact CD2-CB 3.67Å; L115-L346 HydrophobicContact CB-CB 4.33Å; L115-L346 PolarHBondContact O-N 3.36Å
116	T	93.8	Very high	85.2	Confident	4 Å²	4	75.2 Å²	75.2	3%	0.025	37%	0.374	C	S	.	.	S	Bend	trans	-132.5	10.5	-170.4	55.5	0	0	0	0	112.5	A71 S73 V74 I76 H113 L114	A71-T116 HydrophobicContact CB-CG2 4.24Å; A71-T116 WeakPolarHBondContact O-CB 3.41Å; A71-T116 WeakPolarHBondContact O-CG2 3.25Å; S73-T116 PolarHBondContact N-O 3.46Å; V74-T116 PolarHBondContact O-OG1 3.22Å; I76-T116 HydrophobicContact CD1-CG2 3.48Å; I76-T116 VanDerWaalsContact CD1-CG2 3.48Å; I76-T116 HydrophobicContact CG1-CG2 4.05Å; H113-T116 PolarHBondContact O-N 2.05Å; H113-T116 VanDerWaalsContact O-N 3.17Å; H113-T116 PolarHBondContact O-OG1 3.36Å; L114-T116 VanDerWaalsContact C-N 3.33Å
117	D	92	Very high	86.4	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.23	34%	0.341	C	S	.	.	S	Bend	trans	-74.3	178	173	68.3	-22	0	0	0	110	H113 H119 T125	H113-D117 PolarHBondContact O-N 2.94Å; D117-H119 PolarHBondContact O-N 2.98Å; D117-T125 PolarHBondContact OD1-OG1 3.26Å; D117-T125 WeakPolarHBondContact OD2-CB 3.34Å; D117-T125 PolarHBondContact OD2-OG1 2.83Å
118	R	89.5	Confident	87.7	Confident	197 Å²	197	65 Å²	65	74%	0.743	32%	0.315	S	S	*	.			trans	-76.2	95.3	177.4	-176.7	177.2	174.7	171.1	-0.7	108.9	Q120	R118-Q120 PolarHBondContact O-N 3.47Å
119	H	86.8	Confident	88.7	Confident	43 Å²	43	57.5 Å²	57.5	20%	0.199	28%	0.28	C	S	.	.			trans	-58	129.3	-179.8	-174.5	69.9	0	0	0	112.8	D117 M121 D345	D117-H119 PolarHBondContact O-N 2.98Å; H119-M121 WeakPolarHBondContact NE2-CE 3.47Å; H119-D345 HydrophobicContact CB-CB 4.14Å
120	Q	85.5	Confident	89.1	Confident	100 Å²	100	51.6 Å²	51.6	47%	0.467	26%	0.255	S	S	.	.			trans	-127.9	117.6	176.9	-65	-179.9	19.5	0	0	109.7	R118 N122 N123 E124	R118-Q120 PolarHBondContact O-N 3.47Å; Q120-N122 PolarHBondContact O-N 3.19Å; Q120-N122 VanDerWaalsContact O-N 3.11Å; Q120-N123 CarbonylContact O-C 3.55Å; Q120-N123 PolarHBondContact O-N 2.66Å; Q120-E124 PolarHBondContact O-N 3.15Å
121	M	80.1	Confident	89.2	Confident	124 Å²	124	53 Å²	53	61%	0.611	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29	-178.1	-64.1	-69.1	168.1	0	0	113.6	H119	H119-M121 WeakPolarHBondContact NE2-CE 3.47Å
122	N	82.5	Confident	89.3	Confident	163 Å²	163	52.5 Å²	52.5	87%	0.872	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16	-178.3	-62.3	-1.3	0	0	0	113	Q120	Q120-N122 PolarHBondContact O-N 3.19Å; Q120-N122 VanDerWaalsContact O-N 3.11Å
123	N	85.8	Confident	89.3	Confident	112 Å²	112	55.1 Å²	55.1	60%	0.599	27%	0.273	S	S	*	.	S	Bend	trans	-144.7	67.5	-176.6	-171	29.4	0	0	0	109	Q120 T125	Q120-N123 CarbonylContact O-C 3.55Å; Q120-N123 PolarHBondContact O-N 2.66Å; N123-T125 PolarHBondContact O-N 2.7Å
124	E	82.7	Confident	89.3	Confident	89 Å²	89	53.1 Å²	53.1	42%	0.416	27%	0.268	S	S	.	.			trans	-68.6	117.5	-175.4	-62.2	-174.3	154.4	0	0	110.9	Q120	Q120-E124 PolarHBondContact O-N 3.15Å
125	T	90.2	Very high	89.2	Confident	40 Å²	40	54.2 Å²	54.2	25%	0.245	28%	0.283	C	S	.	.			trans	-82.5	147.8	164.6	47.7	0	0	0	0	108.8	L114 D117 N123 S344	L114-T125 HydrophobicContact CD2-CG2 4.07Å; D117-T125 PolarHBondContact OD1-OG1 3.26Å; D117-T125 WeakPolarHBondContact OD2-CB 3.34Å; D117-T125 PolarHBondContact OD2-OG1 2.83Å; N123-T125 PolarHBondContact O-N 2.7Å; T125-S344 WeakPolarHBondContact O-CA 3.36Å; T125-S344 WeakPolarHBondContact O-CB 3.35Å
126	C	90.9	Very high	89.2	Confident	8 Å²	8	57.7 Å²	57.7	5%	0.054	30%	0.301	C	S	.	.			trans	-140.9	131.2	-179.7	-57	0	0	0	0	110.8	C158 S342 F343	C126-C158 HydrophobicContact CB-CB 3.79Å; C126-C158 WeakPolarHBondContact CB-SG 3.19Å; C126-C158 WeakPolarHBondContact SG-CB 3.42Å; C126-C158 CovalentContact SG-SG 2.04Å; C126-C158 PolarHBondContact SG-SG 3.01Å; C126-S342 WeakPolarHBondContact CB-OG 3.01Å; C126-F343 WeakPolarHBondContact CA-O 3.5Å
127	W	93.4	Very high	89.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	147.4	160.9	166	76.7	0	0	0	110	A78 S80 T81 F110 L115 V138 L140 L263 S342 F343	A78-W127 HydrophobicContact CB-CZ2 4.04Å; S80-W127 WeakPolarHBondContact O-CZ2 3.29Å; T81-W127 PolarHBondContact OG1-NE1 2.69Å; T81-W127 VanDerWaalsContact OG1-NE1 3.12Å; F110-W127 VanDerWaalsContact O-CD1 3.24Å; L115-W127 HydrophobicContact CD1-CB 4.11Å; L115-W127 HydrophobicContact CD1-CD2 4.11Å; L115-W127 HydrophobicContact CD1-CE3 4.28Å; L115-W127 HydrophobicContact CD1-CG 4.03Å; L115-W127 HydrophobicContact CD2-CB 3.84Å; L115-W127 HydrophobicContact CD2-CE3 4.26Å; L115-W127 HydrophobicContact CD2-CG 4.45Å; L115-W127 HydrophobicContact CG-CB 3.64Å; L115-W127 HydrophobicContact CG-CG 4.13Å; W127-V138 HydrophobicContact CH2-CG1 3.94Å; W127-V138 HydrophobicContact CZ2-CG1 4.2Å; W127-L140 HydrophobicContact CE3-CD1 4.48Å; W127-L140 HydrophobicContact CH2-CD1 4.34Å; W127-L140 HydrophobicContact CH2-CD2 3.69Å; W127-L140 HydrophobicContact CH2-CG 4.33Å; W127-L140 HydrophobicContact CZ2-CD2 3.66Å; W127-L140 HydrophobicContact CZ3-CD1 4.07Å; W127-L140 HydrophobicContact CZ3-CD2 4.16Å; W127-L263 HydrophobicContact CH2-CD1 4.02Å; W127-L263 HydrophobicContact CZ3-CD1 3.96Å; W127-S342 WeakPolarHBondContact O-CA 3.46Å; W127-S342 WeakPolarHBondContact O-CB 3.23Å; W127-S342 PolarHBondContact O-OG 3.47Å; W127-F343 HydrophobicContact CE3-CD2 4.24Å; W127-F343 AromaticContact CZ3-CD2 3.99Å; W127-F343 HydrophobicContact CZ3-CD2 3.99Å; W127-F343 PolarHBondContact N-O 3.45Å; W127-F343 PolarHBondContact O-N 3.06Å
128	V	92.2	Very high	89.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.6	177.5	-170.9	0	0	0	0	110.5	C82 I91 F110 H340 F341	C82-V128 PolarHBondContact N-O 2.99Å; C82-V128 VanDerWaalsContact N-O 3.12Å; I91-V128 HydrophobicContact CD1-CB 4.05Å; I91-V128 HydrophobicContact CD1-CG1 3.7Å; I91-V128 HydrophobicContact CD1-CG2 4.18Å; I91-V128 HydrophobicContact CG1-CG1 4.22Å; I91-V128 HydrophobicContact CG2-CG1 4.32Å; F110-V128 HydrophobicContact CB-CB 4.2Å; F110-V128 HydrophobicContact CB-CG2 4.18Å; F110-V128 HydrophobicContact CD1-CB 4.46Å; F110-V128 HydrophobicContact CD1-CG2 3.59Å; F110-V128 HydrophobicContact CE1-CG2 4.21Å; F110-V128 HydrophobicContact CG-CB 4.44Å; F110-V128 HydrophobicContact CG-CG2 4.05Å; F110-V128 PolarHBondContact O-N 3.46Å; V128-H340 HydrophobicContact CG1-CB 3.77Å; V128-F341 WeakPolarHBondContact CA-O 3.47Å
129	S	92.5	Very high	89.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.282	C	S	.	.			trans	-69	159.4	173.7	75	0	0	0	0	111.4	V132 H340 F341	S129-V132 WeakPolarHBondContact OG-CG2 3.13Å; S129-H340 PolarHBondContact O-ND1 2.93Å; S129-F341 PolarHBondContact N-O 2.81Å; S129-F341 PolarHBondContact OG-N 2.72Å
130	G	90.1	Very high	90.3	Very high	3 Å²	3	49 Å²	49	3%	0.031	27%	0.273	C	S	.	.			trans	-64.5	179.7	162.6	0	0	0	0	0	111.8	S80 E89 V132 H340	S80-G130 VanDerWaalsContact OG-CA 3.26Å; S80-G130 WeakPolarHBondContact OG-CA 3.45Å; S80-G130 PolarHBondContact OG-N 3.09Å; E89-G130 VanDerWaalsContact OE2-CA 3.32Å; E89-G130 WeakPolarHBondContact OE2-CA 3.32Å; G130-V132 WeakPolarHBondContact O-CG2 3.49Å; G130-V132 PolarHBondContact O-N 3.23Å; G130-H340 PolarHBondContact O-ND1 2.9Å
131	S	89.1	Confident	90.9	Very high	49 Å²	49	45.8 Å²	45.8	34%	0.343	26%	0.26	S	S	.	.			trans	-56.2	120.4	177.5	-60.2	0	0	0	0	112.5	E89 H340	E89-S131 PolarHBondContact OE1-N 2.68Å; E89-S131 VanDerWaalsContact OE1-N 3.08Å; E89-S131 PolarHBondContact OE1-OG 3.47Å; S131-H340 PolarHBondContact N-CE1 2.84Å
132	V	90.7	Very high	91.6	Very high	2 Å²	2	40 Å²	40	1%	0.012	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-108	116.3	-179.6	-171.8	0	0	0	0	110.7	S129 G130 D136 V138 R265 V339 F341	S129-V132 WeakPolarHBondContact OG-CG2 3.13Å; G130-V132 WeakPolarHBondContact O-CG2 3.49Å; G130-V132 PolarHBondContact O-N 3.23Å; V132-D136 HydrophobicContact CG1-CB 3.79Å; V132-V138 HydrophobicContact CG1-CG2 4.5Å; V132-V138 HydrophobicContact CG2-CG2 3.61Å; V132-R265 HydrophobicContact CG1-CB 4.26Å; V132-R265 PolarHBondContact O-NH1 3.05Å; V132-V339 HydrophobicContact CB-CG2 4.28Å; V132-V339 WeakPolarHBondContact CB-O 3.37Å; V132-V339 PolarHBondContact N-O 2.89Å; V132-V339 PolarHBondContact O-N 2.81Å; V132-V339 VanDerWaalsContact O-N 3.15Å; V132-F341 HydrophobicContact CB-CE2 4.28Å; V132-F341 HydrophobicContact CB-CZ 4.45Å; V132-F341 HydrophobicContact CG1-CE2 3.8Å; V132-F341 HydrophobicContact CG1-CZ 4.01Å; V132-F341 HydrophobicContact CG2-CD2 4Å; V132-F341 HydrophobicContact CG2-CE2 4Å
133	L	91.2	Very high	92.3	Very high	86 Å²	86	35.5 Å²	35.5	45%	0.45	21%	0.213	S	C	.	.			trans	-86.2	161.1	177.6	-58.9	172.7	0	0	0	111.7	G135 D136 P338	L133-G135 PolarHBondContact O-N 2.76Å; L133-D136 VanDerWaalsContact CB-OD2 3.27Å; L133-D136 WeakPolarHBondContact CB-OD2 3.23Å; L133-D136 PolarHBondContact N-OD2 2.81Å; L133-D136 WeakPolarHBondContact O-CB 2.99Å; L133-D136 PolarHBondContact O-N 2.91Å; L133-P338 HydrophobicContact CD2-CB 4.12Å
134	P	90.6	Very high	92.7	Very high	36 Å²	36	30.8 Å²	30.8	23%	0.234	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	124.6	172.2	-25.4	35.2	0	0	0	111.9	F266	P134-F266 WeakPolarHBondContact CA-O 3.37Å; P134-F266 WeakPolarHBondContact CB-O 3.16Å
135	G	89.9	Confident	93.1	Very high	39 Å²	39	28.7 Å²	28.7	40%	0.402	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	-11.8	-176.1	0	0	0	0	0	114.9	L133 R265 F266	L133-G135 PolarHBondContact O-N 2.76Å; G135-R265 VanDerWaalsContact CA-O 3.29Å; G135-R265 WeakPolarHBondContact CA-O 3.14Å; G135-R265 PolarHBondContact N-O 2.8Å; G135-F266 PolarHBondContact N-O 2.84Å
136	D	93.1	Very high	93.4	Very high	72 Å²	72	26.9 Å²	26.9	39%	0.385	18%	0.179	S	C	.	.			trans	-77.4	161.2	177.7	-69.6	-17.4	0	0	0	112.4	V132 L133 R265	V132-D136 HydrophobicContact CG1-CB 3.79Å; L133-D136 VanDerWaalsContact CB-OD2 3.27Å; L133-D136 WeakPolarHBondContact CB-OD2 3.23Å; L133-D136 PolarHBondContact N-OD2 2.81Å; L133-D136 WeakPolarHBondContact O-CB 2.99Å; L133-D136 PolarHBondContact O-N 2.91Å; D136-R265 PolarHBondContact O-N 3.5Å
137	T	95	Very high	93.7	Very high	57 Å²	57	30.5 Å²	30.5	35%	0.35	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.3	176.9	-60.7	0	0	0	0	110.6	L263 M264	T137-L263 CarbonylContact C-O 3.46Å; T137-L263 VanDerWaalsContact CA-O 3.29Å; T137-L263 WeakPolarHBondContact CA-O 3.48Å; T137-M264 HydrophobicContact CG2-CG 3.9Å
138	V	96.3	Very high	93.9	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.5	172.7	-177	0	0	0	0	108.9	W127 V132 L263 F341	W127-V138 HydrophobicContact CH2-CG1 3.94Å; W127-V138 HydrophobicContact CZ2-CG1 4.2Å; V132-V138 HydrophobicContact CG1-CG2 4.5Å; V132-V138 HydrophobicContact CG2-CG2 3.61Å; V138-L263 HydrophobicContact CB-CB 4.39Å; V138-L263 PolarHBondContact N-O 3.24Å; V138-L263 PolarHBondContact O-N 2.98Å; V138-F341 HydrophobicContact CB-CD2 4.49Å; V138-F341 HydrophobicContact CG2-CD2 4.28Å
139	N	97.5	Very high	94	Very high	40 Å²	40	30.8 Å²	30.8	21%	0.214	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131	178.2	-61.3	-57.4	0	0	0	110.9	A78 T79 R260 I261 S262	A78-N139 CarbonylContact C-O 3.48Å; A78-N139 WeakPolarHBondContact CA-O 3.07Å; T79-N139 HydrophobicContact CG2-CB 3.77Å; T79-N139 PolarHBondContact N-O 3.23Å; T79-N139 PolarHBondContact OG1-N 2.79Å; N139-R260 HydrophobicContact CB-CG 4.48Å; N139-I261 CarbonylContact C-O 3.59Å; N139-I261 WeakPolarHBondContact CA-O 3.13Å; N139-S262 VanDerWaalsContact OD1-CB 3.29Å; N139-S262 WeakPolarHBondContact OD1-CB 3.2Å; N139-S262 PolarHBondContact OD1-OG 3Å
140	L	97.2	Very high	94.2	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127.9	166.5	-55.1	176.3	0	0	0	108.2	I76 K77 A78 L115 W127 R260 I261 L263	I76-L140 HydrophobicContact CG2-CB 4.09Å; I76-L140 HydrophobicContact CG2-CD2 4.36Å; K77-L140 CarbonylContact O-C 3.53Å; K77-L140 WeakPolarHBondContact O-CA 2.99Å; A78-L140 HydrophobicContact CB-CD2 3.57Å; L115-L140 HydrophobicContact CD1-CD1 4.03Å; L115-L140 HydrophobicContact CD1-CD2 4.37Å; W127-L140 HydrophobicContact CE3-CD1 4.48Å; W127-L140 HydrophobicContact CH2-CD1 4.34Å; W127-L140 HydrophobicContact CH2-CD2 3.69Å; W127-L140 HydrophobicContact CH2-CG 4.33Å; W127-L140 HydrophobicContact CZ2-CD2 3.66Å; W127-L140 HydrophobicContact CZ3-CD1 4.07Å; W127-L140 HydrophobicContact CZ3-CD2 4.16Å; L140-R260 CarbonylContact O-C 2.96Å; L140-R260 VanDerWaalsContact O-CA 3.25Å; L140-R260 WeakPolarHBondContact O-CA 3.03Å; L140-I261 HydrophobicContact CB-CB 4.22Å; L140-I261 PolarHBondContact N-O 3.39Å; L140-I261 PolarHBondContact O-N 3.25Å; L140-L263 HydrophobicContact CD1-CD1 4.36Å
141	T	97.5	Very high	94.5	Very high	32 Å²	32	32.7 Å²	32.7	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.7	179.3	-54.6	0	0	0	0	110.6	K77 W177 L259	K77-T141 PolarHBondContact N-O 2.93Å; K77-T141 PolarHBondContact O-N 3.48Å; T141-W177 HydrophobicContact CG2-CH2 4.1Å; T141-W177 HydrophobicContact CG2-CZ2 4.34Å; T141-L259 WeakPolarHBondContact CA-O 3.41Å
142	L	96.1	Very high	94.8	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.3	179.1	-178.7	156.7	0	0	0	109.1	A71 V74 I76 L144 D258 L259 L346 I348	A71-L142 HydrophobicContact CB-CD1 3.82Å; V74-L142 HydrophobicContact CB-CD1 4.28Å; V74-L142 HydrophobicContact CB-CG 4.42Å; V74-L142 HydrophobicContact CG1-CD1 4.15Å; V74-L142 HydrophobicContact CG1-CD2 4.09Å; V74-L142 HydrophobicContact CG1-CG 3.75Å; I76-L142 HydrophobicContact CD1-CD1 4.22Å; I76-L142 HydrophobicContact CG1-CB 4.29Å; I76-L142 HydrophobicContact CG1-CD1 4.06Å; I76-L142 HydrophobicContact CG1-CG 4.42Å; L142-L144 HydrophobicContact CD2-CD1 4.39Å; L142-L144 HydrophobicContact CD2-CD2 3.5Å; L142-L144 VanDerWaalsContact CD2-CD2 3.5Å; L142-L144 HydrophobicContact CD2-CG 3.55Å; L142-D258 CarbonylContact O-C 3.59Å; L142-D258 VanDerWaalsContact O-CA 3.23Å; L142-D258 WeakPolarHBondContact O-CA 3.43Å; L142-D258 WeakPolarHBondContact O-CB 3.27Å; L142-L259 HydrophobicContact CB-CB 4.43Å; L142-L259 PolarHBondContact N-O 3.31Å; L142-L259 PolarHBondContact O-N 3.44Å; L142-L346 HydrophobicContact CD1-CD2 4.29Å; L142-I348 HydrophobicContact CD1-CD1 4.02Å; L142-I348 HydrophobicContact CD2-CD1 4.42Å
143	S	96.1	Very high	95.1	Very high	70 Å²	70	34.4 Å²	34.4	49%	0.49	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115.1	179.8	-73.1	0	0	0	0	111	D258	S143-D258 WeakPolarHBondContact CA-OD1 3.43Å; S143-D258 WeakPolarHBondContact CB-OD1 3.42Å; S143-D258 PolarHBondContact OG-OD1 3.12Å
144	L	94.2	Very high	95.2	Very high	12 Å²	12	31.1 Å²	31.1	6%	0.063	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-17.4	-174.6	-63.4	166.1	0	0	0	113.5	I70 V74 L142 K146 F148 M256 T257	I70-L144 HydrophobicContact CB-CD2 4.43Å; I70-L144 HydrophobicContact CD1-CD1 3.65Å; I70-L144 HydrophobicContact CD1-CD2 4.38Å; I70-L144 HydrophobicContact CG1-CD1 4.33Å; I70-L144 HydrophobicContact CG1-CD2 4.2Å; I70-L144 VanDerWaalsContact O-CD2 3.27Å; I70-L144 WeakPolarHBondContact O-CD2 3.17Å; V74-L144 HydrophobicContact CG2-CD2 4.38Å; L142-L144 HydrophobicContact CD2-CD1 4.39Å; L142-L144 HydrophobicContact CD2-CD2 3.5Å; L142-L144 VanDerWaalsContact CD2-CD2 3.5Å; L142-L144 HydrophobicContact CD2-CG 3.55Å; L144-K146 PolarHBondContact O-N 3.35Å; L144-K146 VanDerWaalsContact O-N 3.12Å; L144-F148 HydrophobicContact CB-CD2 3.89Å; L144-F148 HydrophobicContact CB-CE2 3.75Å; L144-F148 HydrophobicContact CD1-CB 4.31Å; L144-F148 HydrophobicContact CD1-CD2 3.62Å; L144-F148 HydrophobicContact CD1-CE2 4.21Å; L144-F148 HydrophobicContact CD1-CG 4.13Å; L144-F148 HydrophobicContact CD2-CE2 4.49Å; L144-F148 HydrophobicContact CG-CD2 4.26Å; L144-F148 HydrophobicContact CG-CE2 4.38Å; L144-M256 HydrophobicContact CD1-CE 3.61Å; L144-T257 VanDerWaalsContact CB-O 3.29Å; L144-T257 WeakPolarHBondContact CB-O 3.35Å; L144-T257 PolarHBondContact N-O 2.96Å
145	G	92.1	Very high	95.4	Very high	45 Å²	45	29.7 Å²	29.7	46%	0.464	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	68.4	5.4	-178.8	0	0	0	0	0	115.2
146	K	95	Very high	95.5	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.013	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158	178.8	175.7	57.9	165.3	69.7	0	109.2	L144 F148 K353 L386 C388 A397 D398	L144-K146 PolarHBondContact O-N 3.35Å; L144-K146 VanDerWaalsContact O-N 3.12Å; K146-F148 HydrophobicContact CB-CD2 4.45Å; K146-F148 HydrophobicContact CB-CE2 3.83Å; K146-F148 HydrophobicContact CG-CE2 4.17Å; K146-F148 VanDerWaalsContact O-CD2 3.27Å; K146-F148 WeakPolarHBondContact O-CD2 3.1Å; K146-K353 PolarHBondContact NZ-O 2.96Å; K146-L386 HydrophobicContact CB-CB 4.08Å; K146-L386 HydrophobicContact CB-CD2 3.97Å; K146-L386 HydrophobicContact CB-CG 4.18Å; K146-L386 WeakPolarHBondContact CD-O 3.41Å; K146-L386 HydrophobicContact CG-CB 4.49Å; K146-L386 HydrophobicContact CG-CD2 4.17Å; K146-L386 HydrophobicContact CG-CG 4.19Å; K146-C388 PolarHBondContact NZ-SG 2.78Å; K146-A397 WeakPolarHBondContact CE-O 3.47Å; K146-A397 PolarHBondContact NZ-O 3.03Å; K146-D398 WeakPolarHBondContact CE-OD1 3.37Å; K146-D398 IonicContact NZ-OD1 3.18Å; K146-D398 PolarHBondContact NZ-OD1 3.26Å
147	R	97.5	Very high	95.4	Very high	84 Å²	84	26.4 Å²	26.4	32%	0.317	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.7	172.3	-60.3	-170.1	-135.9	-117.8	3.6	111	S171 T255 M256 T257 K353 D398	R147-S171 PolarHBondContact NH1-O 3.26Å; R147-T255 HydrophobicContact CB-CG2 4.13Å; R147-T255 HydrophobicContact CG-CG2 4.32Å; R147-M256 WeakPolarHBondContact CA-O 3.25Å; R147-T257 HydrophobicContact CB-CG2 4.34Å; R147-T257 HydrophobicContact CG-CG2 3.58Å; R147-K353 HydrophobicContact CB-CB 4.15Å; R147-K353 HydrophobicContact CB-CD 4.17Å; R147-K353 VanDerWaalsContact O-CB 3.26Å; R147-K353 WeakPolarHBondContact O-CB 3.09Å; R147-K353 PolarHBondContact O-N 3.33Å; R147-D398 WeakPolarHBondContact CD-OD2 3.47Å; R147-D398 IonicContact CZ-OD2 3.29Å; R147-D398 IonicContact NE-OD2 3.79Å; R147-D398 PolarHBondContact NE-OD2 3.24Å
148	F	97.4	Very high	94.9	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	152.6	174.5	-73.2	-100.1	0	0	0	110.7	Y47 I70 L144 K146 V150 T255 M256 R351 C352 L386	Y47-F148 HydrophobicContact CD2-CE1 4.37Å; Y47-F148 AromaticContact CE2-CE1 3.68Å; Y47-F148 HydrophobicContact CE2-CE1 3.68Å; Y47-F148 AromaticContact CE2-CZ 3.68Å; Y47-F148 HydrophobicContact CE2-CZ 3.68Å; Y47-F148 AromaticContact CZ-CE1 3.99Å; I70-F148 HydrophobicContact CB-CD1 4.01Å; I70-F148 HydrophobicContact CB-CE1 4.01Å; I70-F148 HydrophobicContact CD1-CB 3.56Å; I70-F148 HydrophobicContact CD1-CD1 3.73Å; I70-F148 HydrophobicContact CD1-CD2 4.34Å; I70-F148 HydrophobicContact CD1-CG 3.63Å; I70-F148 HydrophobicContact CG1-CD1 4.48Å; I70-F148 HydrophobicContact CG2-CD1 3.55Å; I70-F148 HydrophobicContact CG2-CE1 3.64Å; I70-F148 HydrophobicContact CG2-CG 4.5Å; L144-F148 HydrophobicContact CB-CD2 3.89Å; L144-F148 HydrophobicContact CB-CE2 3.75Å; L144-F148 HydrophobicContact CD1-CB 4.31Å; L144-F148 HydrophobicContact CD1-CD2 3.62Å; L144-F148 HydrophobicContact CD1-CE2 4.21Å; L144-F148 HydrophobicContact CD1-CG 4.13Å; L144-F148 HydrophobicContact CD2-CE2 4.49Å; L144-F148 HydrophobicContact CG-CD2 4.26Å; L144-F148 HydrophobicContact CG-CE2 4.38Å; K146-F148 HydrophobicContact CB-CD2 4.45Å; K146-F148 HydrophobicContact CB-CE2 3.83Å; K146-F148 HydrophobicContact CG-CE2 4.17Å; K146-F148 VanDerWaalsContact O-CD2 3.27Å; K146-F148 WeakPolarHBondContact O-CD2 3.1Å; F148-V150 HydrophobicContact CB-CG2 4.44Å; F148-T255 WeakPolarHBondContact O-CA 3.4Å; F148-M256 PolarHBondContact N-O 3.31Å; F148-M256 PolarHBondContact O-N 2.64Å; F148-R351 WeakPolarHBondContact CA-O 3.03Å; F148-R351 VanDerWaalsContact CD1-C 3.45Å; F148-R351 WeakPolarHBondContact CD1-O 3.24Å; F148-C352 HydrophobicContact CD1-CB 4.24Å; F148-C352 HydrophobicContact CE1-CB 3.89Å; F148-C352 HydrophobicContact CZ-CB 4.48Å; F148-L386 HydrophobicContact CE2-CD2 4.37Å; F148-L386 HydrophobicContact CZ-CD2 3.91Å
149	E	95.9	Very high	94.2	Very high	5 Å²	5	26.4 Å²	26.4	2%	0.023	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	106.5	167.9	-60.4	-174.6	158.8	0	0	107.9	Y151 G350 R351 K353 R413	E149-Y151 HydrophobicContact CB-CE2 4.4Å; E149-G350 CarbonylContact O-C 3.55Å; E149-G350 WeakPolarHBondContact O-CA 3.44Å; E149-R351 HydrophobicContact CB-CG 4.32Å; E149-R351 PolarHBondContact N-O 2.8Å; E149-R351 PolarHBondContact O-N 3.21Å; E149-K353 HydrophobicContact CG-CB 3.95Å; E149-K353 HydrophobicContact CG-CD 4.23Å; E149-K353 HydrophobicContact CG-CG 3.9Å; E149-R413 IonicContact OE1-CZ 2.81Å; E149-R413 IonicContact OE1-NH1 3.96Å; E149-R413 PolarHBondContact OE1-NH1 3.49Å; E149-R413 IonicContact OE1-NH2 2.9Å; E149-R413 PolarHBondContact OE1-NH2 3.5Å; E149-R413 IonicContact OE2-CZ 3.17Å; E149-R413 IonicContact OE2-NH2 3.91Å; E149-R413 PolarHBondContact OE2-NH2 2.92Å
150	V	96.5	Very high	93.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	129.8	-174.8	180	0	0	0	0	109.5	I70 F148 I153 W180 T236 M254 M256 I348	I70-V150 HydrophobicContact CD1-CG2 3.99Å; F148-V150 HydrophobicContact CB-CG2 4.44Å; V150-I153 HydrophobicContact CG1-CG1 4.1Å; V150-W180 HydrophobicContact CB-CH2 3.72Å; V150-W180 HydrophobicContact CB-CZ2 4.37Å; V150-W180 HydrophobicContact CG1-CH2 3.77Å; V150-W180 HydrophobicContact CG1-CZ3 4.49Å; V150-W180 HydrophobicContact CG2-CH2 4.12Å; V150-T236 HydrophobicContact CG1-CG2 4.47Å; V150-T236 WeakPolarHBondContact O-CG2 3.48Å; V150-T236 PolarHBondContact O-OG1 2.82Å; V150-M254 PolarHBondContact N-O 2.9Å; V150-M256 HydrophobicContact CG2-CB 3.98Å; V150-M256 HydrophobicContact CG2-CE 3.85Å; V150-M256 HydrophobicContact CG2-SD 4.46Å; V150-I348 HydrophobicContact CG1-CG2 3.7Å; V150-I348 HydrophobicContact CG2-CG2 4.1Å
151	Y	94.5	Very high	93	Very high	42 Å²	42	30.9 Å²	30.9	17%	0.165	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-37.5	-180	-72.1	-107.2	0	0	0	111.5	F67 E149 T236 W246 M254 G349	F67-Y151 HydrophobicContact CD2-CD2 4.1Å; F67-Y151 HydrophobicContact CD2-CE2 4.45Å; F67-Y151 AromaticContact CE2-CD2 3.67Å; F67-Y151 HydrophobicContact CE2-CD2 3.67Å; F67-Y151 HydrophobicContact CE2-CE2 4.44Å; F67-Y151 AromaticContact CE2-CG 3.82Å; F67-Y151 HydrophobicContact CE2-CG 3.82Å; E149-Y151 HydrophobicContact CB-CE2 4.4Å; Y151-T236 WeakPolarHBondContact CA-OG1 3.4Å; Y151-T236 PolarHBondContact O-N 2.77Å; Y151-T236 PolarHBondContact O-OG1 3.11Å; Y151-T236 VanDerWaalsContact O-OG1 3.14Å; Y151-W246 HydrophobicContact CE1-CH2 4.14Å; Y151-W246 WeakPolarHBondContact OH-CH2 3.34Å; Y151-M254 HydrophobicContact CD1-CE 3.75Å; Y151-M254 HydrophobicContact CD2-CE 3.91Å; Y151-M254 HydrophobicContact CE1-CE 3.71Å; Y151-M254 HydrophobicContact CE2-CE 3.86Å; Y151-M254 HydrophobicContact CG-CE 3.86Å; Y151-G349 PolarHBondContact N-O 3.02Å
152	Y	95.7	Very high	92.8	Very high	85 Å²	85	29.4 Å²	29.4	33%	0.333	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.1	173.8	72.2	-96	0	0	0	112.5	F67 F234 G349	F67-Y152 HydrophobicContact CE1-CE1 4.02Å; F67-Y152 HydrophobicContact CZ-CD1 4.07Å; F67-Y152 AromaticContact CZ-CE1 3.62Å; F67-Y152 HydrophobicContact CZ-CE1 3.62Å; Y152-F234 CarbonylContact C-O 3.43Å; Y152-F234 WeakPolarHBondContact CA-O 3.43Å; Y152-F234 WeakPolarHBondContact CB-O 3.31Å; Y152-G349 PolarHBondContact N-O 3.09Å; Y152-G349 PolarHBondContact O-N 2.76Å
153	I	96.8	Very high	92.7	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.6	166.2	-63.2	170.4	0	0	0	107.1	V150 L167 W180 A233 F234 L259 L346 S347 I348	V150-I153 HydrophobicContact CG1-CG1 4.1Å; I153-L167 HydrophobicContact CD1-CD1 4.25Å; I153-L167 HydrophobicContact CG2-CD1 4.48Å; I153-W180 HydrophobicContact CD1-CE3 3.82Å; I153-W180 HydrophobicContact CD1-CH2 4.21Å; I153-W180 HydrophobicContact CD1-CZ3 3.38Å; I153-W180 HydrophobicContact CG1-CZ3 4.48Å; I153-A233 CarbonylContact O-C 3.52Å; I153-A233 WeakPolarHBondContact O-CA 3.31Å; I153-F234 HydrophobicContact CD1-CD1 4.34Å; I153-F234 PolarHBondContact N-O 3.11Å; I153-F234 PolarHBondContact O-N 3.08Å; I153-L259 HydrophobicContact CD1-CD1 3.68Å; I153-L259 HydrophobicContact CD1-CD2 3.85Å; I153-L259 HydrophobicContact CD1-CG 4.44Å; I153-L259 HydrophobicContact CG2-CD2 4.32Å; I153-L346 HydrophobicContact CG2-CD1 3.86Å; I153-S347 WeakPolarHBondContact CA-O 3.37Å; I153-I348 HydrophobicContact CG1-CG1 4.33Å; I153-I348 HydrophobicContact CG1-CG2 4.23Å
154	S	95.1	Very high	92.6	Very high	17 Å²	17	26.5 Å²	26.5	12%	0.119	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.5	174	55.6	0	0	0	0	111.5	I232 S347	S154-I232 CarbonylContact C-O 3.51Å; S154-I232 VanDerWaalsContact CA-O 3.27Å; S154-I232 WeakPolarHBondContact CA-O 3.35Å; S154-S347 PolarHBondContact N-O 3.03Å; S154-S347 PolarHBondContact O-N 3.34Å; S154-S347 VanDerWaalsContact OG-CB 3.31Å; S154-S347 WeakPolarHBondContact OG-CB 3.14Å
155	L	94.2	Very high	92.7	Very high	5 Å²	5	26 Å²	26	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.9	175.4	-74.2	164.4	0	0	0	108.5	P157 I232 I261 F343 D345 L346	L155-P157 WeakPolarHBondContact O-CD 3.36Å; L155-I232 HydrophobicContact CB-CB 4.3Å; L155-I232 PolarHBondContact N-O 3.03Å; L155-I232 PolarHBondContact O-N 2.85Å; L155-I261 HydrophobicContact CD1-CD1 4.26Å; L155-I261 HydrophobicContact CD1-CG2 4.13Å; L155-I261 HydrophobicContact CD2-CD1 3.97Å; L155-I261 HydrophobicContact CG-CD1 4.47Å; L155-F343 HydrophobicContact CB-CD1 3.98Å; L155-F343 HydrophobicContact CB-CE1 4Å; L155-F343 HydrophobicContact CD1-CE1 4.46Å; L155-F343 HydrophobicContact CD2-CD1 4.22Å; L155-D345 WeakPolarHBondContact CA-O 3.36Å; L155-L346 HydrophobicContact CD2-CB 4.18Å; L155-L346 HydrophobicContact CD2-CD1 3.67Å; L155-L346 HydrophobicContact CD2-CG 4.42Å; L155-L346 HydrophobicContact CG-CD1 4.19Å
156	Q	92	Very high	93	Very high	22 Å²	22	23.8 Å²	23.8	10%	0.103	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	110.2	174.1	-175.2	66.8	4.6	0	0	109.6	F343 S344 D345	Q156-F343 CarbonylContact O-C 3.21Å; Q156-F343 WeakPolarHBondContact O-CA 3.46Å; Q156-F343 WeakPolarHBondContact O-CB 3.16Å; Q156-S344 WeakPolarHBondContact CB-OG 3.45Å; Q156-S344 WeakPolarHBondContact CG-OG 3.49Å; Q156-S344 PolarHBondContact O-N 3.19Å; Q156-S344 PolarHBondContact O-OG 2.63Å; Q156-D345 HydrophobicContact CB-CB 4.01Å; Q156-D345 PolarHBondContact N-O 2.65Å
157	P	90.6	Very high	93.1	Very high	20 Å²	20	23.8 Å²	23.8	13%	0.13	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	141.3	176.9	-13.3	28.8	0	0	0	112.1	L155 L161 N230 I232 F343	L155-P157 WeakPolarHBondContact O-CD 3.36Å; P157-L161 HydrophobicContact CB-CD2 3.69Å; P157-L161 HydrophobicContact CG-CD2 3.5Å; P157-L161 VanDerWaalsContact CG-CD2 3.5Å; P157-N230 WeakPolarHBondContact CD-O 3.49Å; P157-N230 WeakPolarHBondContact CG-O 3.5Å; P157-I232 HydrophobicContact CG-CD1 4Å; P157-I232 HydrophobicContact CG-CG1 4.34Å; P157-F343 HydrophobicContact CB-CD1 4.33Å; P157-F343 HydrophobicContact CB-CE1 4.27Å; P157-F343 HydrophobicContact CG-CD1 4.4Å; P157-F343 HydrophobicContact CG-CE1 4.15Å
158	C	85.6	Confident	93.2	Very high	26 Å²	26	22.7 Å²	22.7	18%	0.176	12%	0.117	C	C	.	.	S	Bend	trans	-105.5	-9.6	171.1	-71.5	0	0	0	0	113.9	C126 S342 S344	C126-C158 HydrophobicContact CB-CB 3.79Å; C126-C158 WeakPolarHBondContact CB-SG 3.19Å; C126-C158 WeakPolarHBondContact SG-CB 3.42Å; C126-C158 CovalentContact SG-SG 2.04Å; C126-C158 PolarHBondContact SG-SG 3.01Å; C158-S342 WeakPolarHBondContact CB-OG 3.16Å; C158-S342 PolarHBondContact N-O 3.27Å; C158-S344 VanDerWaalsContact SG-CA 3.56Å; C158-S344 WeakPolarHBondContact SG-CB 3.4Å; C158-S344 PolarHBondContact SG-N 3.01Å; C158-S344 PolarHBondContact SG-OG 2.98Å
159	G	80.9	Confident	93.2	Very high	36 Å²	36	22.9 Å²	22.9	37%	0.371	12%	0.118	S	C	.	.	S	Bend	trans	-155.3	-150.2	-168.8	0	0	0	0	0	111.9	L161	G159-L161 PolarHBondContact O-N 3.35Å
160	Q	81.6	Confident	93.3	Very high	108 Å²	108	22.7 Å²	22.7	51%	0.505	12%	0.117	S	C	.	.	P	Polyproline II helix	trans	-62.8	131.1	-178.8	-171.6	168.7	27.8	0	0	111.2
161	L	88.3	Confident	93.2	Very high	30 Å²	30	23.8 Å²	23.8	16%	0.157	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-70.7	140.9	174.9	-70.9	179.8	0	0	0	111	P157 G159 L216 I232	P157-L161 HydrophobicContact CB-CD2 3.69Å; P157-L161 HydrophobicContact CG-CD2 3.5Å; P157-L161 VanDerWaalsContact CG-CD2 3.5Å; G159-L161 PolarHBondContact O-N 3.35Å; L161-L216 HydrophobicContact CB-CD2 4.2Å; L161-L216 HydrophobicContact CD1-CD2 4.35Å; L161-L216 HydrophobicContact CD1-CG 4.28Å; L161-I232 HydrophobicContact CD2-CD1 3.84Å
162	P	93	Very high	93.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-58.1	156.8	164.6	-19.2	30.5	0	0	0	111.6	S164 I165 L216 L263 F341 F343	P162-S164 VanDerWaalsContact C-N 3.27Å; P162-S164 PolarHBondContact O-N 3.46Å; P162-I165 HydrophobicContact CB-CG1 4.14Å; P162-I165 HydrophobicContact CG-CD1 4.33Å; P162-I165 HydrophobicContact CG-CG1 4.05Å; P162-L216 WeakPolarHBondContact O-CD2 3.29Å; P162-L263 HydrophobicContact CB-CB 4.3Å; P162-L263 HydrophobicContact CG-CB 3.92Å; P162-L263 HydrophobicContact CG-CD2 3.99Å; P162-L263 HydrophobicContact CG-CG 4.41Å; P162-F341 VanDerWaalsContact CA-CE1 3.48Å; P162-F341 HydrophobicContact CB-CD1 4.25Å; P162-F341 HydrophobicContact CB-CE1 3.85Å; P162-F341 HydrophobicContact CB-CE2 4.2Å; P162-F341 HydrophobicContact CB-CZ 3.81Å; P162-F341 HydrophobicContact CG-CD1 3.81Å; P162-F341 HydrophobicContact CG-CD2 4.18Å; P162-F341 HydrophobicContact CG-CE1 3.95Å; P162-F341 HydrophobicContact CG-CE2 4.27Å; P162-F341 HydrophobicContact CG-CG 3.94Å; P162-F341 HydrophobicContact CG-CZ 4.16Å; P162-F343 HydrophobicContact CG-CZ 4.31Å
163	D	92.7	Very high	93.3	Very high	11 Å²	11	25.4 Å²	25.4	6%	0.059	14%	0.137	C	C	.	.	S	Bend	trans	-69.5	-32.2	174.9	-67.6	-32.8	0	0	0	111.5	S184 T185 M264 R265 F266 K334	D163-S184 PolarHBondContact O-OG 3.45Å; D163-T185 PolarHBondContact O-N 2.89Å; D163-T185 PolarHBondContact O-OG1 2.85Å; D163-T185 VanDerWaalsContact O-OG1 3.08Å; D163-M264 PolarHBondContact N-O 2.04Å; D163-R265 WeakPolarHBondContact OD2-CA 3.16Å; D163-R265 WeakPolarHBondContact OD2-CG 3.16Å; D163-F266 HydrophobicContact CB-CD1 4.46Å; D163-F266 HydrophobicContact CB-CD2 3.53Å; D163-F266 HydrophobicContact CB-CE2 3.76Å; D163-F266 HydrophobicContact CB-CG 3.91Å; D163-F266 HydrophobicContact CB-CZ 4.31Å; D163-F266 PolarHBondContact OD2-N 2.9Å; D163-K334 IonicContact OD1-NZ 2.59Å; D163-K334 PolarHBondContact OD1-NZ 3.02Å
164	S	95.2	Very high	93.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	146.7	176	-56.6	0	0	0	0	111.9	P162 F183 S184 A190 M264 F266	P162-S164 VanDerWaalsContact C-N 3.27Å; P162-S164 PolarHBondContact O-N 3.46Å; S164-F183 CarbonylContact C-O 3.25Å; S164-F183 VanDerWaalsContact CA-O 3.29Å; S164-F183 WeakPolarHBondContact CA-O 3.07Å; S164-S184 WeakPolarHBondContact OG-CB 3.28Å; S164-S184 PolarHBondContact OG-OG 2.76Å; S164-A190 WeakPolarHBondContact OG-CB 3.31Å; S164-M264 PolarHBondContact N-O 2.7Å; S164-M264 PolarHBondContact O-N 2.99Å; S164-F266 WeakPolarHBondContact OG-CZ 3.29Å
165	I	96.5	Very high	93.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.7	175.7	-56.5	172.8	0	0	0	108.2	P162 L167 F183 L216 I232 I261 S262 L263 F343	P162-I165 HydrophobicContact CB-CG1 4.14Å; P162-I165 HydrophobicContact CG-CD1 4.33Å; P162-I165 HydrophobicContact CG-CG1 4.05Å; I165-L167 HydrophobicContact CG2-CD2 4.32Å; I165-F183 HydrophobicContact CB-CB 4.26Å; I165-F183 HydrophobicContact CB-CD2 4.46Å; I165-F183 PolarHBondContact N-O 3.25Å; I165-F183 PolarHBondContact O-N 2.88Å; I165-L216 HydrophobicContact CD1-CD1 4.37Å; I165-I232 HydrophobicContact CD1-CD1 3.66Å; I165-I261 HydrophobicContact CG2-CG2 3.87Å; I165-S262 CarbonylContact C-O 3.5Å; I165-S262 WeakPolarHBondContact CA-O 3.27Å; I165-L263 HydrophobicContact CD1-CD2 4.44Å; I165-L263 HydrophobicContact CG1-CD2 4.06Å; I165-L263 HydrophobicContact CG2-CD2 4.17Å; I165-F343 HydrophobicContact CD1-CZ 4.42Å
166	A	97.5	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.9	174.1	0	0	0	0	0	111.2	Y168 Y182 F191 I261 S262	A166-Y168 HydrophobicContact CB-CD2 4.32Å; A166-Y168 HydrophobicContact CB-CE2 3.56Å; A166-Y182 HydrophobicContact CB-CD1 3.56Å; A166-Y182 HydrophobicContact CB-CE1 3.61Å; A166-F191 HydrophobicContact CB-CE1 4.05Å; A166-F191 HydrophobicContact CB-CZ 3.95Å; A166-I261 WeakPolarHBondContact O-CA 3.36Å; A166-S262 PolarHBondContact N-O 2.93Å; A166-S262 PolarHBondContact O-N 3.14Å
167	L	98	Very high	93.7	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.9	172.1	-55.4	-171.5	0	0	0	109.5	I153 I165 W180 Q181 F183 F234 I261	I153-L167 HydrophobicContact CD1-CD1 4.25Å; I153-L167 HydrophobicContact CG2-CD1 4.48Å; I165-L167 HydrophobicContact CG2-CD2 4.32Å; L167-W180 HydrophobicContact CB-CB 4.42Å; L167-W180 WeakPolarHBondContact O-CB 3.38Å; L167-W180 PolarHBondContact O-N 2.8Å; L167-Q181 HydrophobicContact CB-CB 4.31Å; L167-Q181 HydrophobicContact CD1-CB 4.12Å; L167-Q181 HydrophobicContact CG-CB 4.37Å; L167-Q181 PolarHBondContact N-O 2.93Å; L167-Q181 PolarHBondContact O-N 2.89Å; L167-F183 HydrophobicContact CD1-CE2 4.26Å; L167-F234 HydrophobicContact CD1-CB 3.94Å; L167-F234 HydrophobicContact CD1-CD1 3.9Å; L167-F234 HydrophobicContact CD1-CG 4.15Å; L167-I261 HydrophobicContact CD2-CB 4.23Å; L167-I261 HydrophobicContact CD2-CD1 4.42Å; L167-I261 HydrophobicContact CD2-CG1 3.87Å; L167-I261 HydrophobicContact CD2-CG2 3.87Å
168	Y	98.2	Very high	94	Very high	60 Å²	60	40.6 Å²	40.6	24%	0.235	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.8	171.7	-60	-87.7	0	0	0	109.9	A166 K178 P179 R260	A166-Y168 HydrophobicContact CB-CD2 4.32Å; A166-Y168 HydrophobicContact CB-CE2 3.56Å; Y168-K178 CarbonylContact C-O 3.52Å; Y168-K178 VanDerWaalsContact CA-O 3.3Å; Y168-K178 WeakPolarHBondContact CA-O 3.36Å; Y168-P179 HydrophobicContact CD1-CB 4.28Å; Y168-P179 HydrophobicContact CE1-CB 4.19Å; Y168-R260 PolarHBondContact N-O 2.85Å; Y168-R260 PolarHBondContact O-N 2.84Å
169	K	97.9	Very high	94.5	Very high	7 Å²	7	41.9 Å²	41.9	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.3	174.2	69.6	167.8	-168.7	162.3	0	112.1	W177 K178 W180 D252 W253 T255 M256 D258	K169-W177 WeakPolarHBondContact O-CA 3.13Å; K169-K178 PolarHBondContact N-O 2.97Å; K169-K178 PolarHBondContact O-N 3.19Å; K169-W180 HydrophobicContact CB-CD2 4.05Å; K169-W180 HydrophobicContact CB-CE3 3.74Å; K169-W180 HydrophobicContact CB-CG 4.42Å; K169-W180 HydrophobicContact CB-CZ3 4.13Å; K169-W180 HydrophobicContact CD-CD2 3.71Å; K169-W180 HydrophobicContact CD-CE3 4.15Å; K169-W180 HydrophobicContact CD-CG 3.95Å; K169-W180 HydrophobicContact CD-CH2 4.42Å; K169-W180 HydrophobicContact CD-CZ2 4.05Å; K169-W180 HydrophobicContact CD-CZ3 4.46Å; K169-W180 HydrophobicContact CG-CB 4.3Å; K169-W180 HydrophobicContact CG-CD2 4.07Å; K169-W180 HydrophobicContact CG-CE3 4.29Å; K169-W180 HydrophobicContact CG-CG 4.09Å; K169-D252 PolarHBondContact NZ-O 3.04Å; K169-W253 VanDerWaalsContact NZ-C 3.26Å; K169-W253 PolarHBondContact NZ-O 3.36Å; K169-T255 PolarHBondContact NZ-O 3.28Å; K169-M256 HydrophobicContact CB-CG 4.11Å; K169-M256 HydrophobicContact CB-SD 4.34Å; K169-D258 WeakPolarHBondContact CA-O 3.45Å
170	S	98	Very high	95.2	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.007	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.4	159.9	179.9	0	0	0	0	109.7	D172 G174 T176 M256 T257 D258	S170-D172 PolarHBondContact OG-N 3.26Å; S170-D172 PolarHBondContact OG-OD1 3.37Å; S170-G174 WeakPolarHBondContact OG-CA 3.16Å; S170-G174 PolarHBondContact OG-N 3.32Å; S170-T176 WeakPolarHBondContact CA-O 3.34Å; S170-T176 WeakPolarHBondContact CB-O 3.29Å; S170-T176 PolarHBondContact OG-O 3.23Å; S170-M256 CarbonylContact O-C 3.35Å; S170-M256 WeakPolarHBondContact O-CA 3.45Å; S170-T257 PolarHBondContact O-N 2.94Å; S170-T257 PolarHBondContact O-OG1 2.97Å; S170-D258 PolarHBondContact N-O 2.87Å; S170-D258 PolarHBondContact O-N 2.84Å
171	S	95.8	Very high	95.9	Very high	23 Å²	23	35.1 Å²	35.1	16%	0.161	19%	0.186	C	C	.	.	S	Bend	trans	-120.2	7.8	172.5	-50.8	0	0	0	0	111.9	R147 T255	R147-S171 PolarHBondContact NH1-O 3.26Å; S171-T255 PolarHBondContact OG-O 2.85Å
172	D	95.7	Very high	96.2	Very high	52 Å²	52	35 Å²	35	28%	0.278	18%	0.184	S	C	.	.	S	Bend	trans	-136.8	34	-172.8	63.6	-0.4	0	0	0	112.6	S170 V175 T176 T257	S170-D172 PolarHBondContact OG-N 3.26Å; S170-D172 PolarHBondContact OG-OD1 3.37Å; D172-V175 WeakPolarHBondContact O-CG2 3.31Å; D172-V175 PolarHBondContact OD1-N 2.87Å; D172-T176 VanDerWaalsContact CG-OG1 3.27Å; D172-T176 PolarHBondContact OD1-N 2.83Å; D172-T176 PolarHBondContact OD1-OG1 3.34Å; D172-T176 WeakPolarHBondContact OD2-CB 3.4Å; D172-T176 WeakPolarHBondContact OD2-CG2 3.13Å; D172-T176 PolarHBondContact OD2-N 3.31Å; D172-T176 PolarHBondContact OD2-OG1 3.33Å; D172-T257 PolarHBondContact N-OG1 2.71Å
173	F	96.3	Very high	96.3	Very high	108 Å²	108	35.6 Å²	35.6	47%	0.474	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	43.3	173.1	-51.7	-84.9	0	0	0	113.7	V175 T257 D258	F173-V175 PolarHBondContact O-N 2.61Å; F173-T257 HydrophobicContact CD1-CG2 3.9Å; F173-T257 HydrophobicContact CD2-CG2 4.43Å; F173-T257 HydrophobicContact CE1-CG2 3.78Å; F173-T257 HydrophobicContact CE2-CG2 4.31Å; F173-T257 HydrophobicContact CG-CG2 4.24Å; F173-T257 HydrophobicContact CZ-CG2 4Å; F173-T257 PolarHBondContact N-OG1 3.02Å; F173-D258 VanDerWaalsContact C-OD2 3.29Å; F173-D258 WeakPolarHBondContact CA-OD2 3.26Å
174	G	94.9	Very high	96.4	Very high	28 Å²	28	35 Å²	35	29%	0.289	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	2.8	174	0	0	0	0	0	115.4	S170 W177 D258	S170-G174 WeakPolarHBondContact OG-CA 3.16Å; S170-G174 PolarHBondContact OG-N 3.32Å; G174-W177 PolarHBondContact O-NE1 3.32Å; G174-W177 VanDerWaalsContact O-NE1 3.09Å; G174-D258 PolarHBondContact N-OD2 3.46Å
175	V	96.5	Very high	96.2	Very high	117 Å²	117	38 Å²	38	71%	0.709	20%	0.201	S	C	*	.	S	Bend	trans	-73	-46.4	-178.5	178	0	0	0	0	111.4	D172 F173	D172-V175 WeakPolarHBondContact O-CG2 3.31Å; D172-V175 PolarHBondContact OD1-N 2.87Å; F173-V175 PolarHBondContact O-N 2.61Å
176	T	97.4	Very high	95.9	Very high	69 Å²	69	41.2 Å²	41.2	42%	0.423	22%	0.219	S	C	.	.			trans	-121.9	146.7	174.6	67.6	0	0	0	0	111.3	S170 D172	S170-T176 WeakPolarHBondContact CA-O 3.34Å; S170-T176 WeakPolarHBondContact CB-O 3.29Å; S170-T176 PolarHBondContact OG-O 3.23Å; D172-T176 VanDerWaalsContact CG-OG1 3.27Å; D172-T176 PolarHBondContact OD1-N 2.83Å; D172-T176 PolarHBondContact OD1-OG1 3.34Å; D172-T176 WeakPolarHBondContact OD2-CB 3.4Å; D172-T176 WeakPolarHBondContact OD2-CG2 3.13Å; D172-T176 PolarHBondContact OD2-N 3.31Å; D172-T176 PolarHBondContact OD2-OG1 3.33Å
177	W	97.3	Very high	95.6	Very high	67 Å²	67	41.2 Å²	41.2	25%	0.254	22%	0.219	S	C	.	.			trans	-123.6	130.5	-179.5	-68.4	87.4	0	0	0	109.2	T141 K169 G174 D258 R260	T141-W177 HydrophobicContact CG2-CH2 4.1Å; T141-W177 HydrophobicContact CG2-CZ2 4.34Å; K169-W177 WeakPolarHBondContact O-CA 3.13Å; G174-W177 PolarHBondContact O-NE1 3.32Å; G174-W177 VanDerWaalsContact O-NE1 3.09Å; W177-D258 HydrophobicContact CH2-CB 3.55Å; W177-D258 HydrophobicContact CZ2-CB 4.12Å; W177-D258 HydrophobicContact CZ3-CB 4.24Å; W177-R260 HydrophobicContact CE3-CB 3.89Å; W177-R260 HydrophobicContact CH2-CB 3.79Å; W177-R260 HydrophobicContact CZ3-CB 3.4Å; W177-R260 VanDerWaalsContact CZ3-CB 3.4Å
178	K	96.6	Very high	95.3	Very high	106 Å²	106	48.5 Å²	48.5	46%	0.461	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.3	176.4	-65.3	-178.4	-176.8	176.4	0	109.8	Y168 K169	Y168-K178 CarbonylContact C-O 3.52Å; Y168-K178 VanDerWaalsContact CA-O 3.3Å; Y168-K178 WeakPolarHBondContact CA-O 3.36Å; K169-K178 PolarHBondContact N-O 2.97Å; K169-K178 PolarHBondContact O-N 3.19Å
179	P	96.5	Very high	95	Very high	52 Å²	52	50 Å²	50	34%	0.338	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	144.8	171.5	29	-34.4	0	0	0	110.2	Y168 Y182 V211	Y168-P179 HydrophobicContact CD1-CB 4.28Å; Y168-P179 HydrophobicContact CE1-CB 4.19Å; P179-Y182 HydrophobicContact CB-CE1 4.49Å; P179-Y182 HydrophobicContact CB-CE2 4.17Å; P179-Y182 WeakPolarHBondContact CB-OH 3.45Å; P179-V211 HydrophobicContact CB-CG1 4.35Å; P179-V211 HydrophobicContact CB-CG2 4.18Å; P179-V211 HydrophobicContact CG-CG2 4.13Å; P179-V211 VanDerWaalsContact O-CG2 3.31Å; P179-V211 WeakPolarHBondContact O-CG2 3.14Å
180	W	95.5	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	-44.2	-174.6	-155.3	15.3	0	0	0	112.8	V150 I153 L167 K169 F234 T236 W253 M256 L259	V150-W180 HydrophobicContact CB-CH2 3.72Å; V150-W180 HydrophobicContact CB-CZ2 4.37Å; V150-W180 HydrophobicContact CG1-CH2 3.77Å; V150-W180 HydrophobicContact CG1-CZ3 4.49Å; V150-W180 HydrophobicContact CG2-CH2 4.12Å; I153-W180 HydrophobicContact CD1-CE3 3.82Å; I153-W180 HydrophobicContact CD1-CH2 4.21Å; I153-W180 HydrophobicContact CD1-CZ3 3.38Å; I153-W180 HydrophobicContact CG1-CZ3 4.48Å; L167-W180 HydrophobicContact CB-CB 4.42Å; L167-W180 WeakPolarHBondContact O-CB 3.38Å; L167-W180 PolarHBondContact O-N 2.8Å; K169-W180 HydrophobicContact CB-CD2 4.05Å; K169-W180 HydrophobicContact CB-CE3 3.74Å; K169-W180 HydrophobicContact CB-CG 4.42Å; K169-W180 HydrophobicContact CB-CZ3 4.13Å; K169-W180 HydrophobicContact CD-CD2 3.71Å; K169-W180 HydrophobicContact CD-CE3 4.15Å; K169-W180 HydrophobicContact CD-CG 3.95Å; K169-W180 HydrophobicContact CD-CH2 4.42Å; K169-W180 HydrophobicContact CD-CZ2 4.05Å; K169-W180 HydrophobicContact CD-CZ3 4.46Å; K169-W180 HydrophobicContact CG-CB 4.3Å; K169-W180 HydrophobicContact CG-CD2 4.07Å; K169-W180 HydrophobicContact CG-CE3 4.29Å; K169-W180 HydrophobicContact CG-CG 4.09Å; W180-F234 AromaticContact CD1-CE1 3.97Å; W180-F234 AromaticContact CD1-CZ 3.85Å; W180-F234 AromaticContact CD2-CE1 3.56Å; W180-F234 HydrophobicContact CD2-CE1 3.56Å; W180-F234 HydrophobicContact CD2-CZ 4.22Å; W180-F234 AromaticContact CE2-CE1 3.65Å; W180-F234 HydrophobicContact CE3-CE1 4.04Å; W180-F234 AromaticContact CG-CE1 3.83Å; W180-F234 HydrophobicContact CG-CE1 3.83Å; W180-F234 HydrophobicContact CG-CZ 4.09Å; W180-F234 HydrophobicContact CZ2-CE1 4.24Å; W180-F234 AromaticContact NE1-CE1 3.84Å; W180-F234 AromaticContact NE1-CZ 3.84Å; W180-T236 HydrophobicContact CH2-CG2 4.05Å; W180-T236 HydrophobicContact CZ2-CG2 3.36Å; W180-W253 AromaticContact CD1-CE2 3.63Å; W180-W253 AromaticContact CD1-CH2 3.4Å; W180-W253 VanDerWaalsContact CD1-CH2 3.4Å; W180-W253 AromaticContact CD1-CZ2 3.3Å; W180-W253 AromaticContact CD1-CZ3 3.74Å; W180-W253 HydrophobicContact CG-CZ2 4.5Å; W180-W253 AromaticContact NE1-CD2 3.74Å; W180-W253 AromaticContact NE1-CE2 3.42Å; W180-W253 AromaticContact NE1-CZ2 3.6Å; W180-W253 AromaticContact NE1-NE1 3.78Å; W180-W253 PolarHBondContact NE1-O 2.9Å; W180-W253 VanDerWaalsContact O-CH2 3.31Å; W180-W253 WeakPolarHBondContact O-CH2 3.19Å; W180-M256 HydrophobicContact CE3-SD 4.38Å; W180-M256 HydrophobicContact CH2-CB 4.17Å; W180-M256 HydrophobicContact CH2-SD 3.95Å; W180-M256 HydrophobicContact CZ3-CB 4.48Å; W180-M256 HydrophobicContact CZ3-CG 4.43Å; W180-M256 HydrophobicContact CZ3-SD 3.43Å; W180-M256 WeakPolarHBondContact CZ3-SD 3.48Å; W180-L259 HydrophobicContact CE3-CD1 4.28Å; W180-L259 HydrophobicContact CZ3-CD1 4.32Å
181	Q	95.3	Very high	94.4	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	145.9	175	-177.5	60.8	36.7	0	0	110	L167 F183 L212 V214 F234	L167-Q181 HydrophobicContact CB-CB 4.31Å; L167-Q181 HydrophobicContact CD1-CB 4.12Å; L167-Q181 HydrophobicContact CG-CB 4.37Å; L167-Q181 PolarHBondContact N-O 2.93Å; L167-Q181 PolarHBondContact O-N 2.89Å; Q181-F183 HydrophobicContact CB-CE2 4.38Å; Q181-F183 HydrophobicContact CG-CD2 4.21Å; Q181-F183 HydrophobicContact CG-CE1 4.35Å; Q181-F183 HydrophobicContact CG-CE2 3.5Å; Q181-F183 HydrophobicContact CG-CZ 3.59Å; Q181-L212 PolarHBondContact NE2-O 3.38Å; Q181-V214 VanDerWaalsContact NE2-CG2 3.33Å; Q181-F234 HydrophobicContact CB-CB 4.45Å; Q181-F234 HydrophobicContact CB-CD1 4.13Å; Q181-F234 HydrophobicContact CB-CD2 3.58Å; Q181-F234 HydrophobicContact CB-CE1 4.26Å; Q181-F234 HydrophobicContact CB-CE2 3.73Å; Q181-F234 HydrophobicContact CB-CG 3.78Å; Q181-F234 HydrophobicContact CB-CZ 4.06Å; Q181-F234 HydrophobicContact CG-CB 4.19Å; Q181-F234 HydrophobicContact CG-CD2 3.47Å; Q181-F234 VanDerWaalsContact CG-CD2 3.47Å; Q181-F234 HydrophobicContact CG-CE2 3.98Å; Q181-F234 HydrophobicContact CG-CG 3.87Å
182	Y	96	Very high	94.3	Very high	29 Å²	29	57.9 Å²	57.9	11%	0.114	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.4	171.8	-61.3	-62.9	0	0	0	111.3	A166 P179 F191 L193 V211 L212 C213 V214	A166-Y182 HydrophobicContact CB-CD1 3.56Å; A166-Y182 HydrophobicContact CB-CE1 3.61Å; P179-Y182 HydrophobicContact CB-CE1 4.49Å; P179-Y182 HydrophobicContact CB-CE2 4.17Å; P179-Y182 WeakPolarHBondContact CB-OH 3.45Å; Y182-F191 AromaticContact CD1-CD1 3.65Å; Y182-F191 HydrophobicContact CD1-CD1 3.65Å; Y182-F191 AromaticContact CD1-CD2 3.88Å; Y182-F191 HydrophobicContact CD1-CD2 3.88Å; Y182-F191 AromaticContact CD1-CE1 3.49Å; Y182-F191 HydrophobicContact CD1-CE1 3.49Å; Y182-F191 VanDerWaalsContact CD1-CE1 3.49Å; Y182-F191 AromaticContact CD1-CE2 3.71Å; Y182-F191 HydrophobicContact CD1-CE2 3.71Å; Y182-F191 AromaticContact CD1-CG 3.85Å; Y182-F191 HydrophobicContact CD1-CG 3.85Å; Y182-F191 AromaticContact CD1-CZ 3.52Å; Y182-F191 HydrophobicContact CD1-CZ 3.52Å; Y182-F191 HydrophobicContact CD2-CB 4.39Å; Y182-F191 HydrophobicContact CD2-CD2 4.41Å; Y182-F191 HydrophobicContact CD2-CG 4.2Å; Y182-F191 AromaticContact CE1-CD1 3.62Å; Y182-F191 HydrophobicContact CE1-CD1 3.62Å; Y182-F191 AromaticContact CE1-CE1 3.58Å; Y182-F191 HydrophobicContact CE1-CE1 3.58Å; Y182-F191 HydrophobicContact CE1-CG 4.17Å; Y182-F191 HydrophobicContact CE1-CZ 4.1Å; Y182-F191 HydrophobicContact CE2-CG 4.49Å; Y182-F191 HydrophobicContact CG-CD1 4.14Å; Y182-F191 AromaticContact CG-CD2 3.74Å; Y182-F191 HydrophobicContact CG-CD2 3.74Å; Y182-F191 HydrophobicContact CG-CE1 4.31Å; Y182-F191 AromaticContact CG-CE2 3.92Å; Y182-F191 HydrophobicContact CG-CE2 3.92Å; Y182-F191 AromaticContact CG-CG 3.85Å; Y182-F191 HydrophobicContact CG-CG 3.85Å; Y182-F191 HydrophobicContact CG-CZ 4.21Å; Y182-L193 HydrophobicContact CD2-CD1 3.56Å; Y182-L193 HydrophobicContact CE2-CD1 3.83Å; Y182-V211 HydrophobicContact CD2-CG1 3.57Å; Y182-V211 HydrophobicContact CE2-CG1 3.58Å; Y182-L212 PolarHBondContact N-O 3.22Å; Y182-C213 WeakPolarHBondContact O-CA 2.99Å; Y182-V214 PolarHBondContact O-N 3.43Å
183	F	94.6	Very high	94	Very high	12 Å²	12	57.9 Å²	57.9	5%	0.053	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.8	167.6	-57	-86.7	0	0	0	108.6	S164 I165 L167 Q181 V214 L216 I232 F234	S164-F183 CarbonylContact C-O 3.25Å; S164-F183 VanDerWaalsContact CA-O 3.29Å; S164-F183 WeakPolarHBondContact CA-O 3.07Å; I165-F183 HydrophobicContact CB-CB 4.26Å; I165-F183 HydrophobicContact CB-CD2 4.46Å; I165-F183 PolarHBondContact N-O 3.25Å; I165-F183 PolarHBondContact O-N 2.88Å; L167-F183 HydrophobicContact CD1-CE2 4.26Å; Q181-F183 HydrophobicContact CB-CE2 4.38Å; Q181-F183 HydrophobicContact CG-CD2 4.21Å; Q181-F183 HydrophobicContact CG-CE1 4.35Å; Q181-F183 HydrophobicContact CG-CE2 3.5Å; Q181-F183 HydrophobicContact CG-CZ 3.59Å; F183-V214 VanDerWaalsContact CA-O 3.28Å; F183-V214 WeakPolarHBondContact CA-O 3.19Å; F183-V214 HydrophobicContact CD1-CB 3.89Å; F183-V214 HydrophobicContact CD1-CG1 4.22Å; F183-V214 HydrophobicContact CE1-CB 4.06Å; F183-V214 HydrophobicContact CE1-CG1 4.3Å; F183-L216 HydrophobicContact CB-CD1 4.06Å; F183-I232 HydrophobicContact CD1-CG2 4.23Å; F183-I232 HydrophobicContact CD2-CG2 4.14Å; F183-I232 HydrophobicContact CE1-CG2 4.17Å; F183-I232 HydrophobicContact CE2-CG2 4.07Å; F183-I232 HydrophobicContact CG-CG2 4.21Å; F183-I232 HydrophobicContact CZ-CG2 4.09Å; F183-F234 HydrophobicContact CE2-CB 4.29Å; F183-F234 HydrophobicContact CZ-CB 3.98Å
184	S	94.2	Very high	93.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	149.4	178.7	-171.9	0	0	0	0	111.8	D163 S164 D186 A190 V214 A215 L216	D163-S184 PolarHBondContact O-OG 3.45Å; S164-S184 WeakPolarHBondContact OG-CB 3.28Å; S164-S184 PolarHBondContact OG-OG 2.76Å; S184-D186 PolarHBondContact OG-N 3.45Å; S184-D186 PolarHBondContact OG-O 2.71Å; S184-D186 VanDerWaalsContact OG-O 3.09Å; S184-A190 WeakPolarHBondContact OG-CB 3.36Å; S184-V214 PolarHBondContact N-O 3.12Å; S184-A215 CarbonylContact O-C 3.43Å; S184-A215 WeakPolarHBondContact O-CA 3.3Å; S184-L216 PolarHBondContact O-N 3.13Å
185	T	90.7	Very high	93.4	Very high	62 Å²	62	60 Å²	60	38%	0.38	31%	0.307	S	S	.	.	S	Bend	trans	-69.2	-22.9	164.6	51.7	0	0	0	0	112	D163 L216 F266	D163-T185 PolarHBondContact O-N 2.89Å; D163-T185 PolarHBondContact O-OG1 2.85Å; D163-T185 VanDerWaalsContact O-OG1 3.08Å; T185-L216 HydrophobicContact CG2-CB 4.35Å; T185-F266 WeakPolarHBondContact OG1-CE2 3.47Å
186	D	90.6	Very high	92.8	Very high	67 Å²	67	55.6 Å²	55.6	36%	0.358	28%	0.282	S	S	.	.	S	Bend	trans	-145.2	87.9	174.1	-175.9	-16.4	0	0	0	109.8	S184 Y188 R189 A190 F266	S184-D186 PolarHBondContact OG-N 3.45Å; S184-D186 PolarHBondContact OG-O 2.71Å; S184-D186 VanDerWaalsContact OG-O 3.09Å; D186-Y188 PolarHBondContact O-N 2.79Å; D186-Y188 PolarHBondContact OD1-N 3.2Å; D186-R189 HydrophobicContact CB-CB 3.93Å; D186-R189 PolarHBondContact O-N 2.91Å; D186-R189 WeakPolarHBondContact OD1-CB 3.27Å; D186-R189 PolarHBondContact OD1-N 3.29Å; D186-R189 WeakPolarHBondContact OD2-CB 3.34Å; D186-A190 WeakPolarHBondContact O-CB 3.37Å; D186-A190 PolarHBondContact O-N 2.77Å; D186-F266 HydrophobicContact CB-CE2 4.14Å; D186-F266 HydrophobicContact CB-CZ 4.05Å
187	C	92.7	Very high	91.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-34.6	-177.8	-80.8	0	0	0	0	113.5	F191 H192 L193 C213	C187-F191 PolarHBondContact O-N 2.85Å; C187-H192 PolarHBondContact O-N 2.84Å; C187-L193 CarbonylContact C-O 3.59Å; C187-L193 VanDerWaalsContact C-O 3.25Å; C187-L193 WeakPolarHBondContact CB-O 3.47Å; C187-L193 PolarHBondContact O-N 3.19Å; C187-C213 VanDerWaalsContact CA-SG 3.51Å; C187-C213 HydrophobicContact CB-CB 3.71Å; C187-C213 WeakPolarHBondContact CB-SG 3.32Å; C187-C213 VanDerWaalsContact SG-C 3.52Å; C187-C213 WeakPolarHBondContact SG-CB 3.41Å; C187-C213 CovalentContact SG-SG 2.03Å; C187-C213 PolarHBondContact SG-SG 3.27Å
188	Y	91.2	Very high	90.1	Very high	156 Å²	156	54.3 Å²	54.3	61%	0.612	28%	0.276	S	S	*	.	H	α-helix	trans	-74.4	-42	-177.8	-171.7	-98.2	0	0	0	111	D186 H192 L193	D186-Y188 PolarHBondContact O-N 2.79Å; D186-Y188 PolarHBondContact OD1-N 3.2Å; Y188-H192 VanDerWaalsContact O-CA 3.27Å; Y188-H192 WeakPolarHBondContact O-CA 3.2Å; Y188-H192 PolarHBondContact O-N 3.13Å; Y188-H192 PolarHBondContact O-ND1 2.85Å; Y188-H192 VanDerWaalsContact O-ND1 3.12Å; Y188-L193 WeakPolarHBondContact CA-O 3.49Å; Y188-L193 PolarHBondContact N-O 3.01Å
189	R	91	Very high	88.6	Confident	92 Å²	92	56 Å²	56	35%	0.347	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-39.9	174.2	-178	179.5	180	-177.6	-2.1	112.4	D186 F266 P267	D186-R189 HydrophobicContact CB-CB 3.93Å; D186-R189 PolarHBondContact O-N 2.91Å; D186-R189 WeakPolarHBondContact OD1-CB 3.27Å; D186-R189 PolarHBondContact OD1-N 3.29Å; D186-R189 WeakPolarHBondContact OD2-CB 3.34Å; R189-F266 HydrophobicContact CG-CD1 4.48Å; R189-F266 HydrophobicContact CG-CE1 4.2Å; R189-F266 HydrophobicContact CG-CZ 4.49Å; R189-P267 PolarHBondContact NH2-O 2.9Å
190	A	91.1	Very high	86.9	Confident	22 Å²	22	59.5 Å²	59.5	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-78.3	-46.8	-175.6	0	0	0	0	0	113.5	S164 S184 D186 F266	S164-A190 WeakPolarHBondContact OG-CB 3.31Å; S184-A190 WeakPolarHBondContact OG-CB 3.36Å; D186-A190 WeakPolarHBondContact O-CB 3.37Å; D186-A190 PolarHBondContact O-N 2.77Å; A190-F266 HydrophobicContact CB-CE1 3.78Å; A190-F266 HydrophobicContact CB-CZ 4.09Å
191	F	93.6	Very high	85.5	Confident	33 Å²	33	60.5 Å²	60.5	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-131.9	2.1	-165.9	-55.9	-63.7	0	0	0	113.9	A166 Y182 C187 L193 M264	A166-F191 HydrophobicContact CB-CE1 4.05Å; A166-F191 HydrophobicContact CB-CZ 3.95Å; Y182-F191 AromaticContact CD1-CD1 3.65Å; Y182-F191 HydrophobicContact CD1-CD1 3.65Å; Y182-F191 AromaticContact CD1-CD2 3.88Å; Y182-F191 HydrophobicContact CD1-CD2 3.88Å; Y182-F191 AromaticContact CD1-CE1 3.49Å; Y182-F191 HydrophobicContact CD1-CE1 3.49Å; Y182-F191 VanDerWaalsContact CD1-CE1 3.49Å; Y182-F191 AromaticContact CD1-CE2 3.71Å; Y182-F191 HydrophobicContact CD1-CE2 3.71Å; Y182-F191 AromaticContact CD1-CG 3.85Å; Y182-F191 HydrophobicContact CD1-CG 3.85Å; Y182-F191 AromaticContact CD1-CZ 3.52Å; Y182-F191 HydrophobicContact CD1-CZ 3.52Å; Y182-F191 HydrophobicContact CD2-CB 4.39Å; Y182-F191 HydrophobicContact CD2-CD2 4.41Å; Y182-F191 HydrophobicContact CD2-CG 4.2Å; Y182-F191 AromaticContact CE1-CD1 3.62Å; Y182-F191 HydrophobicContact CE1-CD1 3.62Å; Y182-F191 AromaticContact CE1-CE1 3.58Å; Y182-F191 HydrophobicContact CE1-CE1 3.58Å; Y182-F191 HydrophobicContact CE1-CG 4.17Å; Y182-F191 HydrophobicContact CE1-CZ 4.1Å; Y182-F191 HydrophobicContact CE2-CG 4.49Å; Y182-F191 HydrophobicContact CG-CD1 4.14Å; Y182-F191 AromaticContact CG-CD2 3.74Å; Y182-F191 HydrophobicContact CG-CD2 3.74Å; Y182-F191 HydrophobicContact CG-CE1 4.31Å; Y182-F191 AromaticContact CG-CE2 3.92Å; Y182-F191 HydrophobicContact CG-CE2 3.92Å; Y182-F191 AromaticContact CG-CG 3.85Å; Y182-F191 HydrophobicContact CG-CG 3.85Å; Y182-F191 HydrophobicContact CG-CZ 4.21Å; C187-F191 PolarHBondContact O-N 2.85Å; F191-L193 HydrophobicContact CB-CD1 4.25Å; F191-L193 HydrophobicContact CB-CG 4.32Å; F191-L193 PolarHBondContact O-N 2.86Å; F191-M264 HydrophobicContact CE1-SD 4.18Å; F191-M264 HydrophobicContact CZ-SD 4.22Å
192	H	93.2	Very high	84.3	Confident	142 Å²	142	69.1 Å²	69.1	66%	0.657	35%	0.35	S	S	*	.	S	Bend	trans	54.8	32.8	-174.3	-54.5	-50.5	0	0	0	113.2	C187 Y188	C187-H192 PolarHBondContact O-N 2.84Å; Y188-H192 VanDerWaalsContact O-CA 3.27Å; Y188-H192 WeakPolarHBondContact O-CA 3.2Å; Y188-H192 PolarHBondContact O-N 3.13Å; Y188-H192 PolarHBondContact O-ND1 2.85Å; Y188-H192 VanDerWaalsContact O-ND1 3.12Å
193	L	89.6	Confident	83.5	Confident	52 Å²	52	68.2 Å²	68.2	27%	0.272	35%	0.347	S	S	.	.			trans	-113.3	144.5	176.2	-69	174.7	0	0	0	109.6	Y182 C187 Y188 F191 C213	Y182-L193 HydrophobicContact CD2-CD1 3.56Å; Y182-L193 HydrophobicContact CE2-CD1 3.83Å; C187-L193 CarbonylContact C-O 3.59Å; C187-L193 VanDerWaalsContact C-O 3.25Å; C187-L193 WeakPolarHBondContact CB-O 3.47Å; C187-L193 PolarHBondContact O-N 3.19Å; Y188-L193 WeakPolarHBondContact CA-O 3.49Å; Y188-L193 PolarHBondContact N-O 3.01Å; F191-L193 HydrophobicContact CB-CD1 4.25Å; F191-L193 HydrophobicContact CB-CG 4.32Å; F191-L193 PolarHBondContact O-N 2.86Å; L193-C213 HydrophobicContact CB-CB 3.92Å; L193-C213 HydrophobicContact CD1-CB 4.16Å
194	P	89.8	Confident	82.7	Confident	100 Å²	100	70.3 Å²	70.3	65%	0.649	36%	0.363	S	S	*	.			trans	-64.2	144.1	169.1	29.2	-33.6	0	0	0	109.6	S196	P194-S196 PolarHBondContact O-N 3.05Å
195	T	88.2	Confident	81.9	Confident	79 Å²	79	74.4 Å²	74.4	49%	0.485	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	125	167.9	-55.3	0	0	0	0	108.6	A215	T195-A215 HydrophobicContact CG2-CB 3.75Å
196	S	84.2	Confident	81.4	Confident	26 Å²	26	76.2 Å²	76.2	18%	0.182	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153	-177.6	61.9	0	0	0	0	110.5	P194 L212 C213	P194-S196 PolarHBondContact O-N 3.05Å; S196-L212 WeakPolarHBondContact OG-CB 3.37Å; S196-C213 PolarHBondContact N-O 3.26Å; S196-C213 PolarHBondContact OG-N 3.4Å; S196-C213 PolarHBondContact OG-O 2.98Å
197	N	74.3	Confident	81.1	Confident	78 Å²	78	75.3 Å²	75.3	42%	0.417	40%	0.401	S	S	.	.			trans	-102.4	128.5	168.7	178.2	-6.4	0	0	0	107.7	H199 N200 A201	N197-H199 PolarHBondContact O-N 2.61Å; N197-H199 PolarHBondContact OD1-N 3.27Å; N197-N200 HydrophobicContact CB-CB 4.2Å; N197-N200 PolarHBondContact O-N 3.43Å; N197-A201 PolarHBondContact O-N 3.43Å
198	E	64.5	Low	80.8	Confident	31 Å²	31	75.6 Å²	75.6	15%	0.145	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.1	179.6	-59.7	-169.3	162.7	0	0	112.8	V214 I238	E198-V214 HydrophobicContact CG-CG2 3.56Å; E198-I238 HydrophobicContact CB-CG2 4.29Å
199	H	64.8	Low	80.6	Confident	142 Å²	142	72 Å²	72	66%	0.657	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-23.6	178.3	-60.8	-63.6	0	0	0	114.3	N197	N197-H199 PolarHBondContact O-N 2.61Å; N197-H199 PolarHBondContact OD1-N 3.27Å
200	N	60.6	Low	80.5	Confident	124 Å²	124	71.8 Å²	71.8	66%	0.663	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-10.1	-173.5	-64.7	-4.8	0	0	0	113.4	N197 Q202	N197-N200 HydrophobicContact CB-CB 4.2Å; N197-N200 PolarHBondContact O-N 3.43Å; N200-Q202 PolarHBondContact O-N 2.82Å; N200-Q202 VanDerWaalsContact O-N 3.16Å
201	A	66.5	Low	80.5	Confident	21 Å²	21	72.1 Å²	72.1	17%	0.174	39%	0.394	C	S	.	.			trans	-62.6	116.9	173.3	0	0	0	0	0	109.3	N197 I203 L212	N197-A201 PolarHBondContact O-N 3.43Å; A201-I203 HydrophobicContact CB-CG1 4.35Å; A201-I203 PolarHBondContact O-N 3.32Å; A201-L212 HydrophobicContact CB-CD1 3.58Å; A201-L212 HydrophobicContact CB-CD2 3.97Å; A201-L212 HydrophobicContact CB-CG 4.45Å
202	Q	69.5	Low	80.5	Confident	183 Å²	183	71.3 Å²	71.3	86%	0.855	39%	0.391	S	S	*	.			trans	-74.1	75.2	178.2	-67.5	-175.6	-15.3	0	0	110.4	N200 S204	N200-Q202 PolarHBondContact O-N 2.82Å; N200-Q202 VanDerWaalsContact O-N 3.16Å; Q202-S204 PolarHBondContact O-N 2.98Å
203	I	78.5	Confident	80.5	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.051	36%	0.36	C	S	.	.			trans	-82.4	114.7	171.7	-54	175.1	0	0	0	108.3	A201 N207 L212 G239 R240 P241	A201-I203 HydrophobicContact CB-CG1 4.35Å; A201-I203 PolarHBondContact O-N 3.32Å; I203-N207 WeakPolarHBondContact CG2-O 3.45Å; I203-L212 HydrophobicContact CD1-CD1 4.07Å; I203-G239 WeakPolarHBondContact CB-O 3.38Å; I203-R240 HydrophobicContact CD1-CG 3.74Å; I203-R240 HydrophobicContact CG2-CG 4.15Å; I203-P241 WeakPolarHBondContact O-CD 3.46Å; I203-P241 VanDerWaalsContact O-CG 3.28Å; I203-P241 WeakPolarHBondContact O-CG 3.14Å
204	S	78.1	Confident	80.6	Confident	56 Å²	56	63.3 Å²	63.3	39%	0.392	35%	0.354	S	S	.	.			trans	-92.8	173.2	171.2	79	0	0	0	0	111.3	Q202 A206 N207 I208	Q202-S204 PolarHBondContact O-N 2.98Å; S204-A206 PolarHBondContact O-N 2.91Å; S204-A206 PolarHBondContact OG-N 2.88Å; S204-N207 VanDerWaalsContact CA-OD1 3.27Å; S204-N207 WeakPolarHBondContact CA-OD1 3.26Å; S204-N207 WeakPolarHBondContact CB-OD1 3.49Å; S204-N207 PolarHBondContact N-OD1 2.82Å; S204-N207 CarbonylContact O-C 3.48Å; S204-N207 PolarHBondContact O-N 3.49Å; S204-N207 PolarHBondContact O-OD1 2.72Å; S204-N207 PolarHBondContact OG-OD1 2.77Å; S204-I208 PolarHBondContact O-N 3.12Å; S204-I208 VanDerWaalsContact O-N 3.13Å
205	L	77.6	Confident	80.5	Confident	86 Å²	86	60.4 Å²	60.4	45%	0.45	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-59.9	-25.9	172.2	-68.9	172.5	0	0	0	113.1	I208 P241 M243	L205-I208 HydrophobicContact CD2-CD1 4.39Å; L205-P241 WeakPolarHBondContact CD2-O 3.47Å; L205-M243 HydrophobicContact CD1-CB 4.44Å; L205-M243 HydrophobicContact CD1-CE 3.92Å; L205-M243 HydrophobicContact CD1-CG 4.19Å
206	A	80	Confident	80.4	Confident	101 Å²	101	57.3 Å²	57.3	84%	0.835	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-76.1	-27.6	-178.4	0	0	0	0	0	113.3	S204	S204-A206 PolarHBondContact O-N 2.91Å; S204-A206 PolarHBondContact OG-N 2.88Å
207	N	84.7	Confident	79.8	Confident	47 Å²	47	64.8 Å²	64.8	25%	0.251	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-120.8	28.3	-178.7	60.4	-24.5	0	0	0	111.6	I203 S204 Q209 E210	I203-N207 WeakPolarHBondContact CG2-O 3.45Å; S204-N207 VanDerWaalsContact CA-OD1 3.27Å; S204-N207 WeakPolarHBondContact CA-OD1 3.26Å; S204-N207 WeakPolarHBondContact CB-OD1 3.49Å; S204-N207 PolarHBondContact N-OD1 2.82Å; S204-N207 CarbonylContact O-C 3.48Å; S204-N207 PolarHBondContact O-N 3.49Å; S204-N207 PolarHBondContact O-OD1 2.72Å; S204-N207 PolarHBondContact OG-OD1 2.77Å; N207-Q209 PolarHBondContact O-N 3.38Å; N207-E210 HydrophobicContact CB-CB 4.22Å; N207-E210 PolarHBondContact ND2-OE2 2.78Å; N207-E210 WeakPolarHBondContact O-CB 3.34Å; N207-E210 PolarHBondContact O-N 2.03Å
208	I	85	Confident	79.1	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-12	-177.9	-158.5	168	0	0	0	114.3	S204 L205 R240 A249 L250	S204-I208 PolarHBondContact O-N 3.12Å; S204-I208 VanDerWaalsContact O-N 3.13Å; L205-I208 HydrophobicContact CD2-CD1 4.39Å; I208-R240 VanDerWaalsContact C-NH1 3.34Å; I208-R240 HydrophobicContact CG1-CB 4.11Å; I208-R240 WeakPolarHBondContact O-CD 3.21Å; I208-R240 PolarHBondContact O-NH1 3.04Å; I208-A249 HydrophobicContact CG2-CB 3.63Å; I208-L250 HydrophobicContact CD1-CB 3.99Å; I208-L250 HydrophobicContact CD1-CD1 4.32Å; I208-L250 HydrophobicContact CG1-CD1 4.46Å
209	Q	87.4	Confident	78.5	Confident	80 Å²	80	66 Å²	66	37%	0.374	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	13.4	175.2	-57.4	-167.4	-30.5	0	0	113.1	N207 A249 D252 W253	N207-Q209 PolarHBondContact O-N 3.38Å; Q209-A249 PolarHBondContact NE2-O 3Å; Q209-D252 PolarHBondContact NE2-OD2 3.19Å; Q209-D252 VanDerWaalsContact NE2-OD2 3.12Å; Q209-W253 HydrophobicContact CB-CE3 3.82Å; Q209-W253 HydrophobicContact CB-CZ3 4.21Å; Q209-W253 HydrophobicContact CG-CB 4.27Å; Q209-W253 HydrophobicContact CG-CE3 4.2Å; Q209-W253 WeakPolarHBondContact O-CZ3 3.39Å
210	E	88.9	Confident	77.5	Confident	88 Å²	88	66.8 Å²	66.8	41%	0.411	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-64.9	137.8	177.9	-178.1	168.6	-167.5	0	0	111.3	N207 L212 R240	N207-E210 HydrophobicContact CB-CB 4.22Å; N207-E210 PolarHBondContact ND2-OE2 2.78Å; N207-E210 WeakPolarHBondContact O-CB 3.34Å; N207-E210 PolarHBondContact O-N 2.03Å; E210-L212 HydrophobicContact CG-CD2 4.49Å; E210-R240 VanDerWaalsContact O-CZ 3.3Å; E210-R240 PolarHBondContact O-NH1 3.36Å; E210-R240 PolarHBondContact O-NH2 2.89Å
211	V	92.5	Very high	76.5	Confident	29 Å²	29	66.6 Å²	66.6	18%	0.176	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-94	131.3	178.4	-178.6	0	0	0	0	108.7	P179 Y182 W253	P179-V211 HydrophobicContact CB-CG1 4.35Å; P179-V211 HydrophobicContact CB-CG2 4.18Å; P179-V211 HydrophobicContact CG-CG2 4.13Å; P179-V211 VanDerWaalsContact O-CG2 3.31Å; P179-V211 WeakPolarHBondContact O-CG2 3.14Å; Y182-V211 HydrophobicContact CD2-CG1 3.57Å; Y182-V211 HydrophobicContact CE2-CG1 3.58Å; V211-W253 HydrophobicContact CG2-CH2 4.07Å; V211-W253 HydrophobicContact CG2-CZ3 4.35Å
212	L	92.1	Very high	74.9	Confident	17 Å²	17	73.8 Å²	73.8	9%	0.089	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-103.8	158.6	-179.9	-63.9	-174.8	0	0	0	111.2	Q181 Y182 S196 A201 I203 E210	Q181-L212 PolarHBondContact NE2-O 3.38Å; Y182-L212 PolarHBondContact N-O 3.22Å; S196-L212 WeakPolarHBondContact OG-CB 3.37Å; A201-L212 HydrophobicContact CB-CD1 3.58Å; A201-L212 HydrophobicContact CB-CD2 3.97Å; A201-L212 HydrophobicContact CB-CG 4.45Å; I203-L212 HydrophobicContact CD1-CD1 4.07Å; E210-L212 HydrophobicContact CG-CD2 4.49Å
213	C	93.9	Very high	73.1	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.007	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.9	164.9	-170.3	0	0	0	0	109.7	Y182 C187 L193 S196	Y182-C213 WeakPolarHBondContact O-CA 2.99Å; C187-C213 VanDerWaalsContact CA-SG 3.51Å; C187-C213 HydrophobicContact CB-CB 3.71Å; C187-C213 WeakPolarHBondContact CB-SG 3.32Å; C187-C213 VanDerWaalsContact SG-C 3.52Å; C187-C213 WeakPolarHBondContact SG-CB 3.41Å; C187-C213 CovalentContact SG-SG 2.03Å; C187-C213 PolarHBondContact SG-SG 3.27Å; L193-C213 HydrophobicContact CB-CB 3.92Å; L193-C213 HydrophobicContact CD1-CB 4.16Å; S196-C213 PolarHBondContact N-O 3.26Å; S196-C213 PolarHBondContact OG-N 3.4Å; S196-C213 PolarHBondContact OG-O 2.98Å
214	V	90.9	Very high	70.9	Confident	24 Å²	24	76.1 Å²	76.1	15%	0.145	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	142	-177	175	0	0	0	0	109.1	Q181 Y182 F183 S184 E198 L216	Q181-V214 VanDerWaalsContact NE2-CG2 3.33Å; Y182-V214 PolarHBondContact O-N 3.43Å; F183-V214 VanDerWaalsContact CA-O 3.28Å; F183-V214 WeakPolarHBondContact CA-O 3.19Å; F183-V214 HydrophobicContact CD1-CB 3.89Å; F183-V214 HydrophobicContact CD1-CG1 4.22Å; F183-V214 HydrophobicContact CE1-CB 4.06Å; F183-V214 HydrophobicContact CE1-CG1 4.3Å; S184-V214 PolarHBondContact N-O 3.12Å; E198-V214 HydrophobicContact CG-CG2 3.56Å; V214-L216 PolarHBondContact O-N 3.4Å
215	A	89	Confident	68.6	Low	39 Å²	39	78.2 Å²	78.2	32%	0.322	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	126.2	177.7	0	0	0	0	0	110.8	S184 T195 K217	S184-A215 CarbonylContact O-C 3.43Å; S184-A215 WeakPolarHBondContact O-CA 3.3Å; T195-A215 HydrophobicContact CG2-CB 3.75Å; A215-K217 PolarHBondContact O-N 2.86Å
216	L	85.6	Confident	66.4	Low	14 Å²	14	78 Å²	78	7%	0.073	47%	0.472	C	S	.	.			trans	-82.2	103.5	170.8	-167.1	73.3	0	0	0	108.2	L161 P162 I165 F183 S184 T185 V214 S218 I232	L161-L216 HydrophobicContact CB-CD2 4.2Å; L161-L216 HydrophobicContact CD1-CD2 4.35Å; L161-L216 HydrophobicContact CD1-CG 4.28Å; P162-L216 WeakPolarHBondContact O-CD2 3.29Å; I165-L216 HydrophobicContact CD1-CD1 4.37Å; F183-L216 HydrophobicContact CB-CD1 4.06Å; S184-L216 PolarHBondContact O-N 3.13Å; T185-L216 HydrophobicContact CG2-CB 4.35Å; V214-L216 PolarHBondContact O-N 3.4Å; L216-S218 PolarHBondContact O-N 3.11Å; L216-I232 HydrophobicContact CD1-CD1 3.77Å; L216-I232 HydrophobicContact CD1-CG1 4.16Å
217	K	71.6	Confident	64.3	Low	183 Å²	183	81.6 Å²	81.6	80%	0.796	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-74.6	126.2	176.1	-65.5	-175.4	179.5	-176.4	0	109.4	A215	A215-K217 PolarHBondContact O-N 2.86Å
218	S	59.4	Low	62	Low	89 Å²	89	83.1 Å²	83.1	62%	0.622	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-63.5	145.8	166.7	-173.2	0	0	0	0	108.7	L216 D220	L216-S218 PolarHBondContact O-N 3.11Å; S218-D220 PolarHBondContact O-N 2.92Å; S218-D220 VanDerWaalsContact O-N 3.08Å
219	P	51.1	Low	60.4	Low	46 Å²	46	87.4 Å²	87.4	30%	0.299	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-55.6	118.9	170.1	-19.9	31.2	0	0	0	108.5	V221 N230	P219-V221 PolarHBondContact O-N 2.98Å; P219-V221 VanDerWaalsContact O-N 3.1Å; P219-N230 WeakPolarHBondContact CB-ND2 3.17Å
220	D	45.1	Very low	59.5	Low	158 Å²	158	86.4 Å²	86.4	85%	0.845	51%	0.514	S	S	*	.			trans	-65.1	113.9	165.4	-82.8	-34.9	0	0	0	107.2	S218 H222	S218-D220 PolarHBondContact O-N 2.92Å; S218-D220 VanDerWaalsContact O-N 3.08Å; D220-H222 PolarHBondContact O-N 3.48Å; D220-H222 VanDerWaalsContact O-N 3.12Å
221	V	38.7	Very low	59.4	Low	120 Å²	120	85.7 Å²	85.7	73%	0.727	52%	0.516	S	S	*	.	S	Bend	trans	-62.7	108.8	171.1	170.3	0	0	0	0	106.6	P219	P219-V221 PolarHBondContact O-N 2.98Å; P219-V221 VanDerWaalsContact O-N 3.1Å
222	H	34.2	Very low	59.3	Low	173 Å²	173	85.2 Å²	85.2	80%	0.801	51%	0.512	S	S	*	.			trans	115.5	87.1	163.6	-56.1	-10	0	0	0	117.3	D220	D220-H222 PolarHBondContact O-N 3.48Å; D220-H222 VanDerWaalsContact O-N 3.12Å
223	G	31.5	Very low	59.3	Low	57 Å²	57	86.9 Å²	86.9	59%	0.588	53%	0.528	S	S	*	.			trans	-114.5	128.7	139.8	0	0	0	0	0	108.7	S225 G226	G223-S225 PolarHBondContact O-N 3.29Å; G223-G226 PolarHBondContact O-N 2.69Å
224	N	31.4	Very low	59.3	Low	184 Å²	184	87 Å²	87	98%	0.984	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	15.6	-179.7	-89.9	-6.8	0	0	0	115.2
225	S	30.4	Very low	59.3	Low	101 Å²	101	86.8 Å²	86.8	71%	0.706	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	22.3	-177.3	67.7	0	0	0	0	114	G223 Q227	G223-S225 PolarHBondContact O-N 3.29Å; S225-Q227 PolarHBondContact O-N 3.19Å
226	G	31.3	Very low	59.4	Low	81 Å²	81	85 Å²	85	84%	0.835	51%	0.513	S	S	*	.	S	Bend	trans	60.2	-3.3	155.8	0	0	0	0	0	119.8	G223	G223-G226 PolarHBondContact O-N 2.69Å
227	Q	34.8	Very low	59.5	Low	176 Å²	176	86.8 Å²	86.8	82%	0.822	53%	0.525	S	S	*	.			trans	-125.4	80.1	-177.9	-80.6	180	-19.1	0	0	110	S225 S229	S225-Q227 PolarHBondContact O-N 3.19Å; Q227-S229 PolarHBondContact O-N 2.86Å
228	S	37.5	Very low	60	Low	79 Å²	79	81.6 Å²	81.6	55%	0.552	51%	0.505	S	S	*	.			trans	-85.8	99.2	160.2	60.6	0	0	0	0	108.1	N230	S228-N230 PolarHBondContact O-N 2.82Å; S228-N230 PolarHBondContact OG-ND2 2.83Å; S228-N230 VanDerWaalsContact OG-ND2 3.12Å
229	S	51.2	Low	60.7	Low	97 Å²	97	78.9 Å²	78.9	68%	0.678	49%	0.491	S	S	*	.			trans	-71	80.6	170.5	58.3	0	0	0	0	109.4	Q227 V231	Q227-S229 PolarHBondContact O-N 2.86Å; S229-V231 PolarHBondContact O-N 2.81Å
230	N	68.2	Low	62.3	Low	58 Å²	58	77.5 Å²	77.5	31%	0.31	48%	0.48	S	S	.	.			trans	-79.9	58.3	-178.4	-64.4	-38.1	0	0	0	111.3	P157 P219 S228 I232	P157-N230 WeakPolarHBondContact CD-O 3.49Å; P157-N230 WeakPolarHBondContact CG-O 3.5Å; P219-N230 WeakPolarHBondContact CB-ND2 3.17Å; S228-N230 PolarHBondContact O-N 2.82Å; S228-N230 PolarHBondContact OG-ND2 2.83Å; S228-N230 VanDerWaalsContact OG-ND2 3.12Å; N230-I232 PolarHBondContact O-N 2.9Å
231	V	86.2	Confident	63.5	Low	74 Å²	74	72.8 Å²	72.8	45%	0.448	46%	0.458	S	S	.	.			trans	-74.4	124.7	178.7	-176.4	0	0	0	0	109.1	S229 A233	S229-V231 PolarHBondContact O-N 2.81Å; V231-A233 HydrophobicContact CG1-CB 4.34Å
232	I	91.4	Very high	64.6	Low	19 Å²	19	69.7 Å²	69.7	10%	0.097	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	109.7	167.9	-58.4	166.9	0	0	0	106.9	S154 L155 P157 L161 I165 F183 L216 N230 F343	S154-I232 CarbonylContact C-O 3.51Å; S154-I232 VanDerWaalsContact CA-O 3.27Å; S154-I232 WeakPolarHBondContact CA-O 3.35Å; L155-I232 HydrophobicContact CB-CB 4.3Å; L155-I232 PolarHBondContact N-O 3.03Å; L155-I232 PolarHBondContact O-N 2.85Å; P157-I232 HydrophobicContact CG-CD1 4Å; P157-I232 HydrophobicContact CG-CG1 4.34Å; L161-I232 HydrophobicContact CD2-CD1 3.84Å; I165-I232 HydrophobicContact CD1-CD1 3.66Å; F183-I232 HydrophobicContact CD1-CG2 4.23Å; F183-I232 HydrophobicContact CD2-CG2 4.14Å; F183-I232 HydrophobicContact CE1-CG2 4.17Å; F183-I232 HydrophobicContact CE2-CG2 4.07Å; F183-I232 HydrophobicContact CG-CG2 4.21Å; F183-I232 HydrophobicContact CZ-CG2 4.09Å; L216-I232 HydrophobicContact CD1-CD1 3.77Å; L216-I232 HydrophobicContact CD1-CG1 4.16Å; N230-I232 PolarHBondContact O-N 2.9Å; I232-F343 HydrophobicContact CD1-CE1 4.44Å
233	A	91.8	Very high	65.4	Low	52 Å²	52	68.9 Å²	68.9	43%	0.43	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.3	-177.8	0	0	0	0	0	111.5	I153 V231	I153-A233 CarbonylContact O-C 3.52Å; I153-A233 WeakPolarHBondContact O-CA 3.31Å; V231-A233 HydrophobicContact CG1-CB 4.34Å
234	F	93.2	Very high	66.5	Low	3 Å²	3	72.4 Å²	72.4	1%	0.013	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.2	169.2	165.5	-123.5	0	0	0	108.5	Y152 I153 L167 W180 Q181 F183 T236 W253	Y152-F234 CarbonylContact C-O 3.43Å; Y152-F234 WeakPolarHBondContact CA-O 3.43Å; Y152-F234 WeakPolarHBondContact CB-O 3.31Å; I153-F234 HydrophobicContact CD1-CD1 4.34Å; I153-F234 PolarHBondContact N-O 3.11Å; I153-F234 PolarHBondContact O-N 3.08Å; L167-F234 HydrophobicContact CD1-CB 3.94Å; L167-F234 HydrophobicContact CD1-CD1 3.9Å; L167-F234 HydrophobicContact CD1-CG 4.15Å; W180-F234 AromaticContact CD1-CE1 3.97Å; W180-F234 AromaticContact CD1-CZ 3.85Å; W180-F234 AromaticContact CD2-CE1 3.56Å; W180-F234 HydrophobicContact CD2-CE1 3.56Å; W180-F234 HydrophobicContact CD2-CZ 4.22Å; W180-F234 AromaticContact CE2-CE1 3.65Å; W180-F234 HydrophobicContact CE3-CE1 4.04Å; W180-F234 AromaticContact CG-CE1 3.83Å; W180-F234 HydrophobicContact CG-CE1 3.83Å; W180-F234 HydrophobicContact CG-CZ 4.09Å; W180-F234 HydrophobicContact CZ2-CE1 4.24Å; W180-F234 AromaticContact NE1-CE1 3.84Å; W180-F234 AromaticContact NE1-CZ 3.84Å; Q181-F234 HydrophobicContact CB-CB 4.45Å; Q181-F234 HydrophobicContact CB-CD1 4.13Å; Q181-F234 HydrophobicContact CB-CD2 3.58Å; Q181-F234 HydrophobicContact CB-CE1 4.26Å; Q181-F234 HydrophobicContact CB-CE2 3.73Å; Q181-F234 HydrophobicContact CB-CG 3.78Å; Q181-F234 HydrophobicContact CB-CZ 4.06Å; Q181-F234 HydrophobicContact CG-CB 4.19Å; Q181-F234 HydrophobicContact CG-CD2 3.47Å; Q181-F234 VanDerWaalsContact CG-CD2 3.47Å; Q181-F234 HydrophobicContact CG-CE2 3.98Å; Q181-F234 HydrophobicContact CG-CG 3.87Å; F183-F234 HydrophobicContact CE2-CB 4.29Å; F183-F234 HydrophobicContact CZ-CB 3.98Å; F234-T236 HydrophobicContact CD1-CG2 4.46Å; F234-T236 HydrophobicContact CE1-CG2 3.72Å; F234-T236 HydrophobicContact CZ-CG2 4.04Å; F234-W253 HydrophobicContact CZ-CZ2 4.06Å
235	S	92.4	Very high	67.6	Low	20 Å²	20	68 Å²	68	14%	0.14	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.4	170.8	177.4	0	0	0	0	111.1	T237 I238	S235-T237 PolarHBondContact O-N 2.62Å; S235-T237 PolarHBondContact OG-N 2.7Å; S235-T237 PolarHBondContact OG-OG1 3.41Å; S235-I238 VanDerWaalsContact CB-CD1 3.44Å; S235-I238 WeakPolarHBondContact OG-CG1 3.31Å; S235-I238 PolarHBondContact OG-N 3.04Å
236	T	91.5	Very high	69.2	Low	0 Å²	0	67.4 Å²	67.4	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	-76.5	-11.1	179	61	0	0	0	0	113	V150 Y151 W180 F234 R240 W253	V150-T236 HydrophobicContact CG1-CG2 4.47Å; V150-T236 WeakPolarHBondContact O-CG2 3.48Å; V150-T236 PolarHBondContact O-OG1 2.82Å; Y151-T236 WeakPolarHBondContact CA-OG1 3.4Å; Y151-T236 PolarHBondContact O-N 2.77Å; Y151-T236 PolarHBondContact O-OG1 3.11Å; Y151-T236 VanDerWaalsContact O-OG1 3.14Å; W180-T236 HydrophobicContact CH2-CG2 4.05Å; W180-T236 HydrophobicContact CZ2-CG2 3.36Å; F234-T236 HydrophobicContact CD1-CG2 4.46Å; F234-T236 HydrophobicContact CE1-CG2 3.72Å; F234-T236 HydrophobicContact CZ-CG2 4.04Å; T236-R240 WeakPolarHBondContact O-CD 3.42Å; T236-W253 VanDerWaalsContact O-CD1 3.31Å; T236-W253 PolarHBondContact O-NE1 3.12Å
237	T	86.4	Confident	71.5	Confident	53 Å²	53	64.9 Å²	64.9	33%	0.325	37%	0.374	S	S	.	.	S	Bend	trans	-116.4	-24.4	-172.3	56.3	0	0	0	0	114	S235 G239 R240 M254	S235-T237 PolarHBondContact O-N 2.62Å; S235-T237 PolarHBondContact OG-N 2.7Å; S235-T237 PolarHBondContact OG-OG1 3.41Å; T237-G239 PolarHBondContact O-N 2.92Å; T237-R240 PolarHBondContact O-N 3.1Å; T237-M254 HydrophobicContact CG2-CE 3.86Å; T237-M254 HydrophobicContact CG2-SD 3.96Å
238	I	82.7	Confident	73.9	Confident	73 Å²	73	61.3 Å²	61.3	37%	0.374	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	136.5	177.9	-69	173.6	0	0	0	109.7	E198 S235 R240	E198-I238 HydrophobicContact CB-CG2 4.29Å; S235-I238 VanDerWaalsContact CB-CD1 3.44Å; S235-I238 WeakPolarHBondContact OG-CG1 3.31Å; S235-I238 PolarHBondContact OG-N 3.04Å; I238-R240 PolarHBondContact O-N 3.12Å
239	G	73.8	Confident	76.3	Confident	32 Å²	32	59.2 Å²	59.2	33%	0.33	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-4.2	-179.4	0	0	0	0	0	115.2	I203 T237 P241	I203-G239 WeakPolarHBondContact CB-O 3.38Å; T237-G239 PolarHBondContact O-N 2.92Å; G239-P241 WeakPolarHBondContact O-CD 3.48Å
240	R	83.7	Confident	78.1	Confident	17 Å²	17	54.9 Å²	54.9	6%	0.064	33%	0.325	C	S	.	.			trans	-108.8	101.2	-175.7	-59.7	-174.5	-167.5	-94.2	-9.5	110.7	I203 I208 E210 T236 T237 I238 S242 W253	I203-R240 HydrophobicContact CD1-CG 3.74Å; I203-R240 HydrophobicContact CG2-CG 4.15Å; I208-R240 VanDerWaalsContact C-NH1 3.34Å; I208-R240 HydrophobicContact CG1-CB 4.11Å; I208-R240 WeakPolarHBondContact O-CD 3.21Å; I208-R240 PolarHBondContact O-NH1 3.04Å; E210-R240 VanDerWaalsContact O-CZ 3.3Å; E210-R240 PolarHBondContact O-NH1 3.36Å; E210-R240 PolarHBondContact O-NH2 2.89Å; T236-R240 WeakPolarHBondContact O-CD 3.42Å; T237-R240 PolarHBondContact O-N 3.1Å; I238-R240 PolarHBondContact O-N 3.12Å; R240-S242 PolarHBondContact O-N 3.36Å; R240-W253 VanDerWaalsContact CZ-CZ2 3.4Å
241	P	70.3	Confident	79.2	Confident	59 Å²	59	53.1 Å²	53.1	38%	0.383	32%	0.315	S	S	.	.			trans	-65.4	127.3	-177.4	26.1	-32.9	0	0	0	110.7	I203 L205 G239	I203-P241 WeakPolarHBondContact O-CD 3.46Å; I203-P241 VanDerWaalsContact O-CG 3.28Å; I203-P241 WeakPolarHBondContact O-CG 3.14Å; L205-P241 WeakPolarHBondContact CD2-O 3.47Å; G239-P241 WeakPolarHBondContact O-CD 3.48Å
242	S	62.4	Low	79.5	Confident	55 Å²	55	52.8 Å²	52.8	39%	0.385	31%	0.311	S	S	.	.			trans	-109.2	97.4	171	-159.7	0	0	0	0	108.8	R240 Q244	R240-S242 PolarHBondContact O-N 3.36Å; S242-Q244 PolarHBondContact O-N 2.93Å; S242-Q244 PolarHBondContact OG-O 3.15Å
243	M	51.3	Low	79.6	Confident	156 Å²	156	52.4 Å²	52.4	77%	0.768	31%	0.308	S	S	*	.	S	Bend	trans	-72.1	-9.7	177.8	-71.3	-133.7	-68.2	0	0	113.8	L205	L205-M243 HydrophobicContact CD1-CB 4.44Å; L205-M243 HydrophobicContact CD1-CE 3.92Å; L205-M243 HydrophobicContact CD1-CG 4.19Å
244	Q	55.2	Low	79.7	Confident	132 Å²	132	50 Å²	50	62%	0.617	29%	0.289	S	S	*	.	S	Bend	trans	-132.2	150.1	171.7	-75.6	178.3	-24.1	0	0	107.8	S242 W246	S242-Q244 PolarHBondContact O-N 2.93Å; S242-Q244 PolarHBondContact OG-O 3.15Å; Q244-W246 VanDerWaalsContact C-N 3.31Å; Q244-W246 PolarHBondContact O-N 3.5Å
245	P	54.3	Low	79.8	Confident	90 Å²	90	50 Å²	50	58%	0.584	29%	0.289	S	S	*	.	S	Bend	trans	-60.3	103	165.4	25	-28.9	0	0	0	107
246	W	64.3	Low	80.1	Confident	90 Å²	90	49 Å²	49	34%	0.341	28%	0.282	S	S	.	.			trans	76.4	80	170.2	-37.2	99.5	0	0	0	116.9	Y151 Q244 I251 M254	Y151-W246 HydrophobicContact CE1-CH2 4.14Å; Y151-W246 WeakPolarHBondContact OH-CH2 3.34Å; Q244-W246 VanDerWaalsContact C-N 3.31Å; Q244-W246 PolarHBondContact O-N 3.5Å; W246-I251 HydrophobicContact CB-CD1 3.72Å; W246-I251 HydrophobicContact CB-CG1 3.99Å; W246-M254 HydrophobicContact CZ3-CE 4.34Å; W246-M254 HydrophobicContact CZ3-SD 4.24Å
247	S	78.4	Confident	80.4	Confident	28 Å²	28	49 Å²	49	20%	0.196	28%	0.282	C	S	.	.			trans	-63.6	143.2	162.4	75.7	0	0	0	0	110.7	A249 L250 I251	S247-A249 PolarHBondContact O-N 3.22Å; S247-L250 PolarHBondContact O-N 3.26Å; S247-L250 VanDerWaalsContact O-N 3.11Å; S247-L250 WeakPolarHBondContact OG-CB 3.16Å; S247-L250 PolarHBondContact OG-N 3.34Å; S247-L250 VanDerWaalsContact OG-N 3.12Å; S247-I251 WeakPolarHBondContact O-CG1 3.43Å; S247-I251 PolarHBondContact O-N 3.19Å
248	S	85.9	Confident	80.9	Confident	101 Å²	101	46.9 Å²	46.9	71%	0.706	27%	0.269	S	S	*	.	H	α-helix	trans	-58.2	-35	177.9	56.4	0	0	0	0	112.3	D252	S248-D252 WeakPolarHBondContact O-CB 3.24Å; S248-D252 PolarHBondContact O-N 3.08Å
249	A	87.7	Confident	81.7	Confident	34 Å²	34	43.5 Å²	43.5	28%	0.281	25%	0.251	S	S	.	.	H	α-helix	trans	-66.6	-39.6	176.6	0	0	0	0	0	112.7	I208 Q209 S247 W253	I208-A249 HydrophobicContact CG2-CB 3.63Å; Q209-A249 PolarHBondContact NE2-O 3Å; S247-A249 PolarHBondContact O-N 3.22Å; A249-W253 WeakPolarHBondContact O-CB 3.31Å; A249-W253 PolarHBondContact O-N 3.17Å
250	L	89.3	Confident	82.8	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-71	-41.4	175.7	-175.8	61.2	0	0	0	111.4	I208 S247 D252 W253 M254	I208-L250 HydrophobicContact CD1-CB 3.99Å; I208-L250 HydrophobicContact CD1-CD1 4.32Å; I208-L250 HydrophobicContact CG1-CD1 4.46Å; S247-L250 PolarHBondContact O-N 3.26Å; S247-L250 VanDerWaalsContact O-N 3.11Å; S247-L250 WeakPolarHBondContact OG-CB 3.16Å; S247-L250 PolarHBondContact OG-N 3.34Å; S247-L250 VanDerWaalsContact OG-N 3.12Å; L250-D252 VanDerWaalsContact C-N 3.31Å; L250-D252 PolarHBondContact O-N 3.28Å; L250-W253 CarbonylContact O-C 3.56Å; L250-W253 WeakPolarHBondContact O-CA 3.48Å; L250-W253 WeakPolarHBondContact O-CB 3.33Å; L250-W253 PolarHBondContact O-N 3.34Å; L250-W253 VanDerWaalsContact O-N 3.13Å; L250-M254 HydrophobicContact CD1-CG 4.29Å; L250-M254 HydrophobicContact CD1-SD 4.27Å; L250-M254 HydrophobicContact CG-CG 4.42Å; L250-M254 HydrophobicContact CG-SD 3.95Å; L250-M254 VanDerWaalsContact O-CG 3.28Å; L250-M254 WeakPolarHBondContact O-CG 3.41Å; L250-M254 PolarHBondContact O-N 3.29Å
251	I	90.8	Very high	83.5	Confident	21 Å²	21	45 Å²	45	11%	0.108	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-45.8	174	-66.2	161.4	0	0	0	110.2	W246 S247 W253 M254 T255 R413	W246-I251 HydrophobicContact CB-CD1 3.72Å; W246-I251 HydrophobicContact CB-CG1 3.99Å; S247-I251 WeakPolarHBondContact O-CG1 3.43Å; S247-I251 PolarHBondContact O-N 3.19Å; I251-W253 VanDerWaalsContact C-N 3.33Å; I251-W253 PolarHBondContact O-N 3.02Å; I251-M254 PolarHBondContact O-N 2.81Å; I251-T255 WeakPolarHBondContact O-CB 3.41Å; I251-T255 PolarHBondContact O-N 3.42Å; I251-T255 PolarHBondContact O-OG1 2.69Å; I251-R413 VanDerWaalsContact CD1-NH1 3.31Å
252	D	92.3	Very high	84.8	Confident	68 Å²	68	42.7 Å²	42.7	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-38	176.3	-174.2	65.8	0	0	0	112	K169 Q209 S248 L250 M254 T255	K169-D252 PolarHBondContact NZ-O 3.04Å; Q209-D252 PolarHBondContact NE2-OD2 3.19Å; Q209-D252 VanDerWaalsContact NE2-OD2 3.12Å; S248-D252 WeakPolarHBondContact O-CB 3.24Å; S248-D252 PolarHBondContact O-N 3.08Å; L250-D252 VanDerWaalsContact C-N 3.31Å; L250-D252 PolarHBondContact O-N 3.28Å; D252-M254 PolarHBondContact O-N 3.02Å; D252-T255 PolarHBondContact O-N 3.15Å
253	W	93.2	Very high	86.4	Confident	10 Å²	10	40 Å²	40	4%	0.038	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-38.5	173.2	176.5	-106.6	0	0	0	113.2	K169 W180 Q209 V211 F234 T236 R240 A249 L250 I251	K169-W253 VanDerWaalsContact NZ-C 3.26Å; K169-W253 PolarHBondContact NZ-O 3.36Å; W180-W253 AromaticContact CD1-CE2 3.63Å; W180-W253 AromaticContact CD1-CH2 3.4Å; W180-W253 VanDerWaalsContact CD1-CH2 3.4Å; W180-W253 AromaticContact CD1-CZ2 3.3Å; W180-W253 AromaticContact CD1-CZ3 3.74Å; W180-W253 HydrophobicContact CG-CZ2 4.5Å; W180-W253 AromaticContact NE1-CD2 3.74Å; W180-W253 AromaticContact NE1-CE2 3.42Å; W180-W253 AromaticContact NE1-CZ2 3.6Å; W180-W253 AromaticContact NE1-NE1 3.78Å; W180-W253 PolarHBondContact NE1-O 2.9Å; W180-W253 VanDerWaalsContact O-CH2 3.31Å; W180-W253 WeakPolarHBondContact O-CH2 3.19Å; Q209-W253 HydrophobicContact CB-CE3 3.82Å; Q209-W253 HydrophobicContact CB-CZ3 4.21Å; Q209-W253 HydrophobicContact CG-CB 4.27Å; Q209-W253 HydrophobicContact CG-CE3 4.2Å; Q209-W253 WeakPolarHBondContact O-CZ3 3.39Å; V211-W253 HydrophobicContact CG2-CH2 4.07Å; V211-W253 HydrophobicContact CG2-CZ3 4.35Å; F234-W253 HydrophobicContact CZ-CZ2 4.06Å; T236-W253 VanDerWaalsContact O-CD1 3.31Å; T236-W253 PolarHBondContact O-NE1 3.12Å; R240-W253 VanDerWaalsContact CZ-CZ2 3.4Å; A249-W253 WeakPolarHBondContact O-CB 3.31Å; A249-W253 PolarHBondContact O-N 3.17Å; L250-W253 CarbonylContact O-C 3.56Å; L250-W253 WeakPolarHBondContact O-CA 3.48Å; L250-W253 WeakPolarHBondContact O-CB 3.33Å; L250-W253 PolarHBondContact O-N 3.34Å; L250-W253 VanDerWaalsContact O-N 3.13Å; I251-W253 VanDerWaalsContact C-N 3.33Å; I251-W253 PolarHBondContact O-N 3.02Å
254	M	94.1	Very high	88.5	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-82.4	-17.3	178.3	-63.8	173.1	72	0	0	113.1	V150 Y151 T237 W246 L250 I251 D252	V150-M254 PolarHBondContact N-O 2.9Å; Y151-M254 HydrophobicContact CD1-CE 3.75Å; Y151-M254 HydrophobicContact CD2-CE 3.91Å; Y151-M254 HydrophobicContact CE1-CE 3.71Å; Y151-M254 HydrophobicContact CE2-CE 3.86Å; Y151-M254 HydrophobicContact CG-CE 3.86Å; T237-M254 HydrophobicContact CG2-CE 3.86Å; T237-M254 HydrophobicContact CG2-SD 3.96Å; W246-M254 HydrophobicContact CZ3-CE 4.34Å; W246-M254 HydrophobicContact CZ3-SD 4.24Å; L250-M254 HydrophobicContact CD1-CG 4.29Å; L250-M254 HydrophobicContact CD1-SD 4.27Å; L250-M254 HydrophobicContact CG-CG 4.42Å; L250-M254 HydrophobicContact CG-SD 3.95Å; L250-M254 VanDerWaalsContact O-CG 3.28Å; L250-M254 WeakPolarHBondContact O-CG 3.41Å; L250-M254 PolarHBondContact O-N 3.29Å; I251-M254 PolarHBondContact O-N 2.81Å; D252-M254 PolarHBondContact O-N 3.02Å
255	T	96.5	Very high	90.3	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.1	-176.1	-61	0	0	0	0	111.6	R147 F148 K169 S171 I251 D252 K353	R147-T255 HydrophobicContact CB-CG2 4.13Å; R147-T255 HydrophobicContact CG-CG2 4.32Å; F148-T255 WeakPolarHBondContact O-CA 3.4Å; K169-T255 PolarHBondContact NZ-O 3.28Å; S171-T255 PolarHBondContact OG-O 2.85Å; I251-T255 WeakPolarHBondContact O-CB 3.41Å; I251-T255 PolarHBondContact O-N 3.42Å; I251-T255 PolarHBondContact O-OG1 2.69Å; D252-T255 PolarHBondContact O-N 3.15Å; T255-K353 HydrophobicContact CG2-CD 3.99Å; T255-K353 PolarHBondContact OG1-NZ 2.86Å
256	M	97.4	Very high	92	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.2	178	-177	-177.6	81.1	0	0	111.8	L144 R147 F148 V150 K169 S170 W180 D258 L259 I348	L144-M256 HydrophobicContact CD1-CE 3.61Å; R147-M256 WeakPolarHBondContact CA-O 3.25Å; F148-M256 PolarHBondContact N-O 3.31Å; F148-M256 PolarHBondContact O-N 2.64Å; V150-M256 HydrophobicContact CG2-CB 3.98Å; V150-M256 HydrophobicContact CG2-CE 3.85Å; V150-M256 HydrophobicContact CG2-SD 4.46Å; K169-M256 HydrophobicContact CB-CG 4.11Å; K169-M256 HydrophobicContact CB-SD 4.34Å; S170-M256 CarbonylContact O-C 3.35Å; S170-M256 WeakPolarHBondContact O-CA 3.45Å; W180-M256 HydrophobicContact CE3-SD 4.38Å; W180-M256 HydrophobicContact CH2-CB 4.17Å; W180-M256 HydrophobicContact CH2-SD 3.95Å; W180-M256 HydrophobicContact CZ3-CB 4.48Å; W180-M256 HydrophobicContact CZ3-CG 4.43Å; W180-M256 HydrophobicContact CZ3-SD 3.43Å; W180-M256 WeakPolarHBondContact CZ3-SD 3.48Å; M256-D258 VanDerWaalsContact CG-O 3.24Å; M256-D258 WeakPolarHBondContact CG-O 3.39Å; M256-L259 HydrophobicContact CE-CB 4Å; M256-L259 HydrophobicContact SD-CB 3.71Å; M256-L259 HydrophobicContact SD-CD1 4.09Å; M256-L259 HydrophobicContact SD-CG 4.42Å; M256-I348 HydrophobicContact CE-CD1 4.24Å; M256-I348 HydrophobicContact CE-CG2 4.32Å
257	T	97.6	Very high	93.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-33	166.4	53.4	0	0	0	0	112.1	L144 R147 S170 D172 F173	L144-T257 VanDerWaalsContact CB-O 3.29Å; L144-T257 WeakPolarHBondContact CB-O 3.35Å; L144-T257 PolarHBondContact N-O 2.96Å; R147-T257 HydrophobicContact CB-CG2 4.34Å; R147-T257 HydrophobicContact CG-CG2 3.58Å; S170-T257 PolarHBondContact O-N 2.94Å; S170-T257 PolarHBondContact O-OG1 2.97Å; D172-T257 PolarHBondContact N-OG1 2.71Å; F173-T257 HydrophobicContact CD1-CG2 3.9Å; F173-T257 HydrophobicContact CD2-CG2 4.43Å; F173-T257 HydrophobicContact CE1-CG2 3.78Å; F173-T257 HydrophobicContact CE2-CG2 4.31Å; F173-T257 HydrophobicContact CG-CG2 4.24Å; F173-T257 HydrophobicContact CZ-CG2 4Å; F173-T257 PolarHBondContact N-OG1 3.02Å
258	D	98	Very high	93	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.043	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.3	-176.4	-46	-105.5	0	0	0	110	L142 S143 K169 S170 F173 G174 W177 M256	L142-D258 CarbonylContact O-C 3.59Å; L142-D258 VanDerWaalsContact O-CA 3.23Å; L142-D258 WeakPolarHBondContact O-CA 3.43Å; L142-D258 WeakPolarHBondContact O-CB 3.27Å; S143-D258 WeakPolarHBondContact CA-OD1 3.43Å; S143-D258 WeakPolarHBondContact CB-OD1 3.42Å; S143-D258 PolarHBondContact OG-OD1 3.12Å; K169-D258 WeakPolarHBondContact CA-O 3.45Å; S170-D258 PolarHBondContact N-O 2.87Å; S170-D258 PolarHBondContact O-N 2.84Å; F173-D258 VanDerWaalsContact C-OD2 3.29Å; F173-D258 WeakPolarHBondContact CA-OD2 3.26Å; G174-D258 PolarHBondContact N-OD2 3.46Å; W177-D258 HydrophobicContact CH2-CB 3.55Å; W177-D258 HydrophobicContact CZ2-CB 4.12Å; W177-D258 HydrophobicContact CZ3-CB 4.24Å; M256-D258 VanDerWaalsContact CG-O 3.24Å; M256-D258 WeakPolarHBondContact CG-O 3.39Å
259	L	98.3	Very high	92	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.3	176.4	-178.9	63.6	0	0	0	109.2	T141 L142 I153 W180 M256 I261 L346 I348	T141-L259 WeakPolarHBondContact CA-O 3.41Å; L142-L259 HydrophobicContact CB-CB 4.43Å; L142-L259 PolarHBondContact N-O 3.31Å; L142-L259 PolarHBondContact O-N 3.44Å; I153-L259 HydrophobicContact CD1-CD1 3.68Å; I153-L259 HydrophobicContact CD1-CD2 3.85Å; I153-L259 HydrophobicContact CD1-CG 4.44Å; I153-L259 HydrophobicContact CG2-CD2 4.32Å; W180-L259 HydrophobicContact CE3-CD1 4.28Å; W180-L259 HydrophobicContact CZ3-CD1 4.32Å; M256-L259 HydrophobicContact CE-CB 4Å; M256-L259 HydrophobicContact SD-CB 3.71Å; M256-L259 HydrophobicContact SD-CD1 4.09Å; M256-L259 HydrophobicContact SD-CG 4.42Å; L259-I261 HydrophobicContact CD2-CD1 3.96Å; L259-I261 HydrophobicContact CD2-CG1 4.01Å; L259-I261 HydrophobicContact CG-CD1 4.5Å; L259-I261 HydrophobicContact CG-CG1 4Å; L259-L346 HydrophobicContact CD2-CD1 4.48Å; L259-I348 HydrophobicContact CD2-CD1 3.57Å; L259-I348 HydrophobicContact CD2-CG1 4.34Å
260	R	98.1	Very high	90.4	Very high	80 Å²	80	41.5 Å²	41.5	30%	0.302	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.9	167.1	178.4	-175.5	-60.1	172.3	4.7	109.4	N139 L140 Y168 W177	N139-R260 HydrophobicContact CB-CG 4.48Å; L140-R260 CarbonylContact O-C 2.96Å; L140-R260 VanDerWaalsContact O-CA 3.25Å; L140-R260 WeakPolarHBondContact O-CA 3.03Å; Y168-R260 PolarHBondContact N-O 2.85Å; Y168-R260 PolarHBondContact O-N 2.84Å; W177-R260 HydrophobicContact CE3-CB 3.89Å; W177-R260 HydrophobicContact CH2-CB 3.79Å; W177-R260 HydrophobicContact CZ3-CB 3.4Å; W177-R260 VanDerWaalsContact CZ3-CB 3.4Å
261	I	98.1	Very high	88.2	Confident	2 Å²	2	48 Å²	48	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.6	178.1	-48.7	-179.8	0	0	0	106.8	N139 L140 L155 I165 A166 L167 L259 L263 L346	N139-I261 CarbonylContact C-O 3.59Å; N139-I261 WeakPolarHBondContact CA-O 3.13Å; L140-I261 HydrophobicContact CB-CB 4.22Å; L140-I261 PolarHBondContact N-O 3.39Å; L140-I261 PolarHBondContact O-N 3.25Å; L155-I261 HydrophobicContact CD1-CD1 4.26Å; L155-I261 HydrophobicContact CD1-CG2 4.13Å; L155-I261 HydrophobicContact CD2-CD1 3.97Å; L155-I261 HydrophobicContact CG-CD1 4.47Å; I165-I261 HydrophobicContact CG2-CG2 3.87Å; A166-I261 WeakPolarHBondContact O-CA 3.36Å; L167-I261 HydrophobicContact CD2-CB 4.23Å; L167-I261 HydrophobicContact CD2-CD1 4.42Å; L167-I261 HydrophobicContact CD2-CG1 3.87Å; L167-I261 HydrophobicContact CD2-CG2 3.87Å; L259-I261 HydrophobicContact CD2-CD1 3.96Å; L259-I261 HydrophobicContact CD2-CG1 4.01Å; L259-I261 HydrophobicContact CG-CD1 4.5Å; L259-I261 HydrophobicContact CG-CG1 4Å; I261-L263 HydrophobicContact CG2-CD2 3.82Å; I261-L346 HydrophobicContact CD1-CD1 3.78Å; I261-L346 HydrophobicContact CD1-CD2 3.84Å; I261-L346 HydrophobicContact CD1-CG 4.47Å
262	S	97.7	Very high	85.5	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.063	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.5	178	-62.1	0	0	0	0	109.7	N139 I165 A166	N139-S262 VanDerWaalsContact OD1-CB 3.29Å; N139-S262 WeakPolarHBondContact OD1-CB 3.2Å; N139-S262 PolarHBondContact OD1-OG 3Å; I165-S262 CarbonylContact C-O 3.5Å; I165-S262 WeakPolarHBondContact CA-O 3.27Å; A166-S262 PolarHBondContact N-O 2.93Å; A166-S262 PolarHBondContact O-N 3.14Å
263	L	96.8	Very high	82.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.2	179.6	-48.6	173.9	0	0	0	108.4	W127 T137 V138 L140 P162 I165 I261 F341 F343	W127-L263 HydrophobicContact CH2-CD1 4.02Å; W127-L263 HydrophobicContact CZ3-CD1 3.96Å; T137-L263 CarbonylContact C-O 3.46Å; T137-L263 VanDerWaalsContact CA-O 3.29Å; T137-L263 WeakPolarHBondContact CA-O 3.48Å; V138-L263 HydrophobicContact CB-CB 4.39Å; V138-L263 PolarHBondContact N-O 3.24Å; V138-L263 PolarHBondContact O-N 2.98Å; L140-L263 HydrophobicContact CD1-CD1 4.36Å; P162-L263 HydrophobicContact CB-CB 4.3Å; P162-L263 HydrophobicContact CG-CB 3.92Å; P162-L263 HydrophobicContact CG-CD2 3.99Å; P162-L263 HydrophobicContact CG-CG 4.41Å; I165-L263 HydrophobicContact CD1-CD2 4.44Å; I165-L263 HydrophobicContact CG1-CD2 4.06Å; I165-L263 HydrophobicContact CG2-CD2 4.17Å; I261-L263 HydrophobicContact CG2-CD2 3.82Å; L263-F341 HydrophobicContact CB-CD2 3.66Å; L263-F341 HydrophobicContact CB-CE2 3.83Å; L263-F341 HydrophobicContact CD1-CB 4.16Å; L263-F341 HydrophobicContact CD1-CD2 4.05Å; L263-F341 HydrophobicContact CD1-CG 4.46Å; L263-F343 HydrophobicContact CD1-CD2 4.43Å; L263-F343 HydrophobicContact CD1-CE2 3.76Å; L263-F343 HydrophobicContact CD2-CE2 3.97Å; L263-F343 HydrophobicContact CD2-CZ 4.06Å
264	M	94.7	Very high	79.8	Confident	56 Å²	56	65.1 Å²	65.1	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.9	-169.4	-56.7	175	66.4	0	0	111.4	T137 D163 S164 F191	T137-M264 HydrophobicContact CG2-CG 3.9Å; D163-M264 PolarHBondContact N-O 2.04Å; S164-M264 PolarHBondContact N-O 2.7Å; S164-M264 PolarHBondContact O-N 2.99Å; F191-M264 HydrophobicContact CE1-SD 4.18Å; F191-M264 HydrophobicContact CZ-SD 4.22Å
265	R	93.1	Very high	76.9	Confident	17 Å²	17	75.1 Å²	75.1	6%	0.064	35%	0.345	C	S	.	.			trans	-108.7	134.2	166.4	-166.3	173.6	177.9	-172.8	-0.8	109.1	V132 G135 D136 D163 S335 T337 F341	V132-R265 HydrophobicContact CG1-CB 4.26Å; V132-R265 PolarHBondContact O-NH1 3.05Å; G135-R265 VanDerWaalsContact CA-O 3.29Å; G135-R265 WeakPolarHBondContact CA-O 3.14Å; G135-R265 PolarHBondContact N-O 2.8Å; D136-R265 PolarHBondContact O-N 3.5Å; D163-R265 WeakPolarHBondContact OD2-CA 3.16Å; D163-R265 WeakPolarHBondContact OD2-CG 3.16Å; R265-S335 PolarHBondContact NH2-O 3.19Å; R265-T337 PolarHBondContact NH1-O 2.94Å; R265-T337 PolarHBondContact NH2-O 2.89Å; R265-F341 HydrophobicContact CB-CZ 4.26Å
266	F	90.8	Very high	73.8	Confident	24 Å²	24	81.1 Å²	81.1	11%	0.105	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-64.1	143.3	178.8	-72.2	-43.8	0	0	0	111.1	P134 G135 D163 S164 T185 D186 R189 A190	P134-F266 WeakPolarHBondContact CA-O 3.37Å; P134-F266 WeakPolarHBondContact CB-O 3.16Å; G135-F266 PolarHBondContact N-O 2.84Å; D163-F266 HydrophobicContact CB-CD1 4.46Å; D163-F266 HydrophobicContact CB-CD2 3.53Å; D163-F266 HydrophobicContact CB-CE2 3.76Å; D163-F266 HydrophobicContact CB-CG 3.91Å; D163-F266 HydrophobicContact CB-CZ 4.31Å; D163-F266 PolarHBondContact OD2-N 2.9Å; S164-F266 WeakPolarHBondContact OG-CZ 3.29Å; T185-F266 WeakPolarHBondContact OG1-CE2 3.47Å; D186-F266 HydrophobicContact CB-CE2 4.14Å; D186-F266 HydrophobicContact CB-CZ 4.05Å; R189-F266 HydrophobicContact CG-CD1 4.48Å; R189-F266 HydrophobicContact CG-CE1 4.2Å; R189-F266 HydrophobicContact CG-CZ 4.49Å; A190-F266 HydrophobicContact CB-CE1 3.78Å; A190-F266 HydrophobicContact CB-CZ 4.09Å
267	P	86.8	Confident	71.1	Confident	79 Å²	79	86.5 Å²	86.5	51%	0.513	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-58	149.2	167.6	-21.6	32	0	0	0	111.1	R189 Y269	R189-P267 PolarHBondContact NH2-O 2.9Å; P267-Y269 PolarHBondContact O-N 2.81Å
268	E	75.1	Confident	68.2	Low	112 Å²	112	92.4 Å²	92.4	52%	0.523	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-55.1	135.6	172.1	-163.2	172.6	-164.9	0	0	109.5	R270 K336	E268-R270 PolarHBondContact O-N 2.9Å; E268-R270 VanDerWaalsContact O-N 3.17Å; E268-K336 VanDerWaalsContact OE1-CE 3.22Å; E268-K336 WeakPolarHBondContact OE1-CE 3.26Å; E268-K336 WeakPolarHBondContact OE2-CE 3.49Å
269	Y	65.5	Low	65.2	Low	164 Å²	164	96.1 Å²	96.1	64%	0.643	49%	0.486	S	S	*	.			trans	-68.3	114.3	176.7	-165.9	-93.5	0	0	0	107.7	P267 D271	P267-Y269 PolarHBondContact O-N 2.81Å; Y269-D271 VanDerWaalsContact CD1-OD1 3.25Å; Y269-D271 WeakPolarHBondContact CD1-OD1 3.38Å; Y269-D271 VanDerWaalsContact CE1-OD1 3.25Å; Y269-D271 WeakPolarHBondContact CE1-OD1 3.4Å; Y269-D271 PolarHBondContact O-N 2.97Å
270	R	54.3	Low	62	Low	209 Å²	209	103.2 Å²	103.2	79%	0.789	52%	0.523	S	S	*	.			trans	-79.4	106.1	169.5	-72.8	-170.7	-178.4	-167.9	0.5	107.5	E268 E272	E268-R270 PolarHBondContact O-N 2.9Å; E268-R270 VanDerWaalsContact O-N 3.17Å; R270-E272 PolarHBondContact O-N 3.44Å
271	D	42.5	Very low	58.8	Low	144 Å²	144	108.4 Å²	108.4	77%	0.77	55%	0.549	S	S	*	.			trans	-65.6	73.7	164.3	-75	-36.8	0	0	0	109.4	Y269	Y269-D271 VanDerWaalsContact CD1-OD1 3.25Å; Y269-D271 WeakPolarHBondContact CD1-OD1 3.38Å; Y269-D271 VanDerWaalsContact CE1-OD1 3.25Å; Y269-D271 WeakPolarHBondContact CE1-OD1 3.4Å; Y269-D271 PolarHBondContact O-N 2.97Å
272	E	35.2	Very low	55.9	Low	158 Å²	158	114.7 Å²	114.7	74%	0.738	58%	0.581	S	S	*	*			trans	-122.5	67.5	167.3	-78.7	-174.1	169.2	0	0	108.8	R270	R270-E272 PolarHBondContact O-N 3.44Å
273	V	34	Very low	52.6	Low	109 Å²	109	118.8 Å²	118.8	66%	0.661	60%	0.603	S	S	*	*			trans	-122.1	95.6	155.3	-176.1	0	0	0	0	106.9	Y275	V273-Y275 PolarHBondContact O-N 3.15Å; V273-Y275 VanDerWaalsContact O-N 3.1Å
274	Q	31.1	Very low	49.7	Very low	191 Å²	191	124.7 Å²	124.7	89%	0.893	64%	0.641	S	S	*	*			trans	-66.8	102.4	171.2	-164.7	171.2	-6.8	0	0	107.6	D276	Q274-D276 PolarHBondContact O-N 3.13Å; Q274-D276 VanDerWaalsContact O-N 3.14Å
275	Y	32.4	Very low	47	Very low	212 Å²	212	126 Å²	126	83%	0.831	66%	0.656	S	S	*	*			trans	-67.3	106	171.5	-87.6	-95.2	0	0	0	108.4	V273	V273-Y275 PolarHBondContact O-N 3.15Å; V273-Y275 VanDerWaalsContact O-N 3.1Å
276	D	31.5	Very low	44.2	Very low	129 Å²	129	133.8 Å²	133.8	69%	0.69	69%	0.691	S	S	*	*			trans	-84.8	144.4	165	-161.5	2	0	0	0	109.8	Q274 N278	Q274-D276 PolarHBondContact O-N 3.13Å; Q274-D276 VanDerWaalsContact O-N 3.14Å; D276-N278 PolarHBondContact O-N 3.3Å
277	S	40.6	Very low	41.6	Very low	113 Å²	113	140 Å²	140	79%	0.79	72%	0.724	S	S	*	*	S	Bend	trans	-74.8	18.6	-160.3	-52.9	0	0	0	0	114.6
278	N	38.2	Very low	38.9	Very low	124 Å²	124	145.2 Å²	145.2	66%	0.663	74%	0.739	S	S	*	*	S	Bend	trans	-123.5	90.2	173.2	-69.6	-37.7	0	0	0	107.2	D276 L280	D276-N278 PolarHBondContact O-N 3.3Å; N278-L280 PolarHBondContact O-N 3.21Å
279	G	34.4	Very low	37.1	Very low	86 Å²	86	145 Å²	145	89%	0.887	75%	0.747	S	S	*	*			trans	-62.9	65.9	-173.6	0	0	0	0	0	115.1
280	L	30.2	Very low	35.4	Very low	149 Å²	149	143.4 Å²	143.4	78%	0.78	75%	0.754	S	S	*	*			trans	-159.5	76.2	-176.2	-102.9	158.6	0	0	0	110.7	N278	N278-L280 PolarHBondContact O-N 3.21Å
281	F	32.1	Very low	34.3	Very low	190 Å²	190	139.8 Å²	139.8	83%	0.833	75%	0.751	S	S	*	*			trans	-150.2	137.3	157.2	-79.9	-85.2	0	0	0	110.4
282	L	36.8	Very low	33.9	Very low	133 Å²	133	139 Å²	139	70%	0.696	75%	0.75	S	S	*	*			cis	-165.6	120.3	-24	-105.4	-175.7	0	0	0	104.8
283	N	29.1	Very low	33.5	Very low	95 Å²	95	139.9 Å²	139.9	51%	0.508	75%	0.753	S	S	.	*			trans	50.7	106.8	155	-90.9	-38.5	0	0	0	121.7	S285 F286	N283-S285 PolarHBondContact O-N 3.07Å; N283-S285 VanDerWaalsContact O-N 3.11Å; N283-S285 WeakPolarHBondContact OD1-CB 3.27Å; N283-S285 PolarHBondContact OD1-OG 3.4Å; N283-F286 HydrophobicContact CB-CD2 4.44Å
284	P	35.2	Very low	33.2	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-64.1	-3.7	152.8	-13.2	28.6	0	0	0	113.5	F286	P284-F286 VanDerWaalsContact C-N 3.33Å; P284-F286 PolarHBondContact O-N 3.2Å
285	S	37.1	Very low	33.1	Very low	85 Å²	85	142.9 Å²	142.9	59%	0.594	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-82.2	5.4	-166.4	-43.3	0	0	0	0	115.7	N283	N283-S285 PolarHBondContact O-N 3.07Å; N283-S285 VanDerWaalsContact O-N 3.11Å; N283-S285 WeakPolarHBondContact OD1-CB 3.27Å; N283-S285 PolarHBondContact OD1-OG 3.4Å
286	F	34.9	Very low	32.9	Very low	180 Å²	180	138 Å²	138	79%	0.789	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-109.4	0.8	177	-80.9	-76.1	0	0	0	115.4	N283 P284 K288	N283-F286 HydrophobicContact CB-CD2 4.44Å; P284-F286 VanDerWaalsContact C-N 3.33Å; P284-F286 PolarHBondContact O-N 3.2Å; F286-K288 VanDerWaalsContact C-N 3.3Å; F286-K288 PolarHBondContact O-N 3.42Å; F286-K288 VanDerWaalsContact O-N 3.07Å
287	L	37.3	Very low	32.8	Very low	153 Å²	153	135 Å²	135	80%	0.801	76%	0.755	S	S	*	*			trans	-83.1	83.3	164.2	-67.1	176	0	0	0	108.5	P289	L287-P289 WeakPolarHBondContact O-CD 3.27Å; L287-P289 VanDerWaalsContact O-N 3.17Å
288	K	29.8	Very low	32.4	Very low	190 Å²	190	134.8 Å²	134.8	83%	0.826	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-51.4	123.7	160.2	-82.1	-178.6	177.3	176.5	0	107	F286 T290	F286-K288 VanDerWaalsContact C-N 3.3Å; F286-K288 PolarHBondContact O-N 3.42Å; F286-K288 VanDerWaalsContact O-N 3.07Å; K288-T290 PolarHBondContact O-N 3.32Å
289	P	37	Very low	32.1	Very low	108 Å²	108	134.5 Å²	134.5	70%	0.701	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-59	116.1	171.4	24.7	-30.2	0	0	0	106.1	L287 N291	L287-P289 WeakPolarHBondContact O-CD 3.27Å; L287-P289 VanDerWaalsContact O-N 3.17Å; P289-N291 PolarHBondContact O-N 3.11Å; P289-N291 VanDerWaalsContact O-N 3.11Å
290	T	30.6	Very low	32.1	Very low	130 Å²	130	135.5 Å²	135.5	80%	0.798	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59.7	120.4	163.2	40.8	0	0	0	0	105.6	K288 V292	K288-T290 PolarHBondContact O-N 3.32Å; T290-V292 PolarHBondContact O-N 2.96Å
291	N	29.8	Very low	32.3	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	76%	0.757	S	S	*	*			trans	-53.4	94.1	-174.3	-65.5	-41.8	0	0	0	110.9	P289 F293	P289-N291 PolarHBondContact O-N 3.11Å; P289-N291 VanDerWaalsContact O-N 3.11Å; N291-F293 HydrophobicContact CB-CD2 4.34Å; N291-F293 HydrophobicContact CB-CE2 4.27Å; N291-F293 PolarHBondContact O-N 3.4Å
292	V	33.6	Very low	32.3	Very low	126 Å²	126	131.2 Å²	131.2	76%	0.764	76%	0.755	S	S	*	*			trans	-72.8	103.6	152.6	-179.7	0	0	0	0	104.4	T290 R294	T290-V292 PolarHBondContact O-N 2.96Å; V292-R294 VanDerWaalsContact C-N 3.28Å; V292-R294 PolarHBondContact O-N 3.36Å
293	F	26.9	Very low	32.1	Very low	178 Å²	178	128 Å²	128	78%	0.781	75%	0.754	S	S	*	*			trans	-60.1	93.5	174.2	-87	-92.2	0	0	0	108.8	N291 V295	N291-F293 HydrophobicContact CB-CD2 4.34Å; N291-F293 HydrophobicContact CB-CE2 4.27Å; N291-F293 PolarHBondContact O-N 3.4Å; F293-V295 PolarHBondContact O-N 3.33Å
294	R	29.1	Very low	32.4	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.857	78%	0.776	S	S	*	*			trans	-72	104.1	161.3	-80.2	-177.7	174.7	152.2	-1.6	107.2	V292 S296	V292-R294 VanDerWaalsContact C-N 3.28Å; V292-R294 PolarHBondContact O-N 3.36Å; R294-S296 VanDerWaalsContact C-N 3.26Å; R294-S296 PolarHBondContact O-N 3.21Å; R294-S296 VanDerWaalsContact O-N 3.12Å
295	V	28.7	Very low	32.3	Very low	135 Å²	135	131.5 Å²	131.5	82%	0.818	77%	0.771	S	S	*	*			trans	-80.2	85.6	163.3	-178	0	0	0	0	106.8	F293 G297	F293-V295 PolarHBondContact O-N 3.33Å; V295-G297 PolarHBondContact O-N 3.02Å
296	S	28.1	Very low	32.3	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	78%	0.78	S	S	*	*			trans	-75.2	97	161.9	51.6	0	0	0	0	107.9	R294	R294-S296 VanDerWaalsContact C-N 3.26Å; R294-S296 PolarHBondContact O-N 3.21Å; R294-S296 VanDerWaalsContact O-N 3.12Å
297	G	30.2	Very low	32.3	Very low	66 Å²	66	132.5 Å²	132.5	68%	0.68	78%	0.783	S	S	*	*			trans	-86.3	110.1	167.2	0	0	0	0	0	109.4	V295	V295-G297 PolarHBondContact O-N 3.02Å
298	S	30.3	Very low	32.1	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	78%	0.78	S	S	*	*			trans	-55.8	140.6	177.9	-59.5	0	0	0	0	113.3
299	P	32.2	Very low	32.3	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	78%	0.783	S	S	*	*			trans	-91.5	138.4	164.6	33.6	-26.8	0	0	0	110.7
300	S	35	Very low	31.9	Very low	108 Å²	108	130.8 Å²	130.8	76%	0.755	79%	0.788	S	S	*	*			trans	-152	90.9	167.7	-46.3	0	0	0	0	106.8
301	I	34.3	Very low	31.9	Very low	173 Å²	173	129.4 Å²	129.4	89%	0.887	78%	0.784	S	S	*	*				71.6	120.3	89.3	-66.8	171.1	0	0	0	113.1
302	G	31.7	Very low	31.9	Very low	76 Å²	76	131.6 Å²	131.6	78%	0.784	79%	0.79	S	S	*	*			trans	151.5	87.4	136.6	0	0	0	0	0	119.4
303	G	33.7	Very low	31.6	Very low	66 Å²	66	130.8 Å²	130.8	68%	0.68	80%	0.796	S	S	*	*			trans	104.1	138.5	140.8	0	0	0	0	0	117.7
304	F	35.8	Very low	31.7	Very low	224 Å²	224	124.9 Å²	124.9	98%	0.982	79%	0.786	S	S	*	*			cis	-165.5	142	-0.9	-105.6	-86.6	0	0	0	106.9
305	G	33	Very low	31.6	Very low	67 Å²	67	121.3 Å²	121.3	69%	0.691	79%	0.789	S	S	*	*			trans	164	64.2	172.5	0	0	0	0	0	117.7
306	T	37.3	Very low	31.7	Very low	128 Å²	128	122 Å²	122	79%	0.785	79%	0.788	S	S	*	*			trans	42.1	102.3	145.7	62.3	0	0	0	0	121.3
307	N	34.8	Very low	31.6	Very low	158 Å²	158	122.6 Å²	122.6	85%	0.845	78%	0.782	S	S	*	*				172.1	141.6	107.9	-89.8	-27	0	0	0	111.1
308	P	32.2	Very low	31.7	Very low	116 Å²	116	128.5 Å²	128.5	75%	0.753	79%	0.794	S	S	*	*			trans	-101.9	136	-157.6	36.2	-26.8	0	0	0	113.3
309	V	34.2	Very low	31.6	Very low	145 Å²	145	126.4 Å²	126.4	88%	0.879	78%	0.78	S	S	*	*			trans	-135.9	108.5	152.1	-179.8	0	0	0	0	107.5
310	L	28	Very low	31.6	Very low	155 Å²	155	129.6 Å²	129.6	81%	0.812	79%	0.785	S	S	*	*			trans	-7.1	134.9	146.7	-99.2	69.2	0	0	0	114.5
311	S	31.8	Very low	31.3	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	78%	0.78	S	S	*	*				-166.1	124.4	50.3	49.7	0	0	0	0	108.6
312	E	28.4	Very low	31.2	Very low	179 Å²	179	130.4 Å²	130.4	84%	0.836	78%	0.777	S	S	*	*				63	124	92	-86.9	-172.5	159.7	0	0	116.4
313	A	28.2	Very low	31.3	Very low	109 Å²	109	137.5 Å²	137.5	90%	0.901	78%	0.781	S	S	*	*			trans	64.5	138.4	151.7	0	0	0	0	0	117.8
314	G	29.2	Very low	31	Very low	54 Å²	54	141.6 Å²	141.6	56%	0.557	78%	0.783	S	S	*	*			cis	-178.8	159.9	8.2	0	0	0	0	0	108.6	L316	G314-L316 PolarHBondContact O-N 3.28Å
315	T	26.4	Very low	30.8	Very low	151 Å²	151	135.2 Å²	135.2	93%	0.926	77%	0.766	S	S	*	*			trans	-45.6	104	153	35.2	0	0	0	0	109.6
316	L	30.5	Very low	31.1	Very low	151 Å²	151	137.8 Å²	137.8	79%	0.791	76%	0.764	S	S	*	*			trans	-127.1	100.2	167.7	-84.1	164.4	0	0	0	107.3	G314 M318	G314-L316 PolarHBondContact O-N 3.28Å; L316-M318 PolarHBondContact O-N 3.16Å
317	D	25.7	Very low	30.8	Very low	121 Å²	121	140.7 Å²	140.7	65%	0.647	77%	0.771	S	S	*	*				17.8	101	129	-166	35	0	0	0	113.7	S319	D317-S319 PolarHBondContact O-N 2.68Å; D317-S319 WeakPolarHBondContact OD2-CB 3.44Å; D317-S319 PolarHBondContact OD2-OG 3.3Å
318	M	32.1	Very low	30.7	Very low	189 Å²	189	142.3 Å²	142.3	93%	0.931	77%	0.773	S	S	*	*			trans	-70.9	70.1	156	-80.9	-167.8	69.3	0	0	107.4	L316	L316-M318 PolarHBondContact O-N 3.16Å
319	S	28.7	Very low	30.8	Very low	66 Å²	66	143.3 Å²	143.3	46%	0.462	76%	0.762	S	S	.	*			trans	-49.7	144.5	163	-110.5	0	0	0	0	108.4	D317 H321	D317-S319 PolarHBondContact O-N 2.68Å; D317-S319 WeakPolarHBondContact OD2-CB 3.44Å; D317-S319 PolarHBondContact OD2-OG 3.3Å; S319-H321 PolarHBondContact O-N 2.73Å
320	Q	33	Very low	30.7	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	75%	0.749	S	S	*	*	S	Bend	trans	-61.8	37	-173.5	-68.4	162.8	-47.2	0	0	114.9
321	H	29.3	Very low	30.9	Very low	141 Å²	141	142.8 Å²	142.8	65%	0.653	75%	0.753	S	S	*	*			trans	-124.5	19.1	-165.7	-83.3	-67.5	0	0	0	116.2	S319	S319-H321 PolarHBondContact O-N 2.73Å
322	L	31.5	Very low	31	Very low	157 Å²	157	142 Å²	142	82%	0.822	74%	0.743	S	S	*	*			trans	-129.7	49.9	162.7	-92.6	143.6	0	0	0	110.7
323	Y	33.3	Very low	31.5	Very low	225 Å²	225	139.5 Å²	139.5	88%	0.882	74%	0.743	S	S	*	*			trans	-107	31.7	158.8	-110.3	-86.8	0	0	0	109.5
324	Q	28.2	Very low	32.6	Very low	152 Å²	152	138.4 Å²	138.4	71%	0.71	72%	0.718	S	S	*	*			trans	-129.5	64.1	-174.2	-96.7	174.3	-30.3	0	0	110.7
325	S	31.8	Very low	33.8	Very low	90 Å²	90	138.8 Å²	138.8	63%	0.629	71%	0.711	S	S	*	*	S	Bend	trans	-168.9	98.3	158.9	56.4	0	0	0	0	104.6
326	D	37.8	Very low	35.5	Very low	120 Å²	120	138.7 Å²	138.7	64%	0.642	70%	0.698	S	S	*	*	S	Bend	cis	-149.4	65.9	43	-65.2	-45.3	0	0	0	111.2	H328	D326-H328 PolarHBondContact O-N 2.83Å
327	M	30.9	Very low	37.6	Very low	190 Å²	190	135.1 Å²	135.1	94%	0.936	68%	0.683	S	S	*	*			trans	-76.8	19	174.6	-118.4	-134.7	175.4	0	0	114.2	Y329	M327-Y329 VanDerWaalsContact C-N 3.33Å
328	H	33.2	Very low	40.3	Very low	192 Å²	192	132.4 Å²	132.4	89%	0.889	67%	0.672	S	S	*	*			trans	-98.9	49.9	160.9	-108.4	-74.3	0	0	0	110.1	D326 S330	D326-H328 PolarHBondContact O-N 2.83Å; H328-S330 PolarHBondContact O-N 3.07Å
329	Y	34.5	Very low	42.9	Very low	137 Å²	137	124.1 Å²	124.1	54%	0.537	63%	0.632	S	S	.	*			trans	-70.2	100.5	160.8	-167.4	-93.6	0	0	0	106.8	M327 K331	M327-Y329 VanDerWaalsContact C-N 3.33Å; Y329-K331 PolarHBondContact O-N 3.41Å
330	S	32.3	Very low	45.8	Very low	85 Å²	85	122.6 Å²	122.6	59%	0.594	62%	0.618	S	S	*	*			trans	-49.2	116.3	172.2	-162.1	0	0	0	0	108.3	H328 T332	H328-S330 PolarHBondContact O-N 3.07Å; S330-T332 PolarHBondContact O-N 2.86Å
331	K	31.1	Very low	48.6	Very low	204 Å²	204	114 Å²	114	89%	0.887	58%	0.577	S	S	*	*			trans	-63	76	170	-78.3	-179.7	174.4	178.7	0	108.6	Y329	Y329-K331 PolarHBondContact O-N 3.41Å
332	T	35.5	Very low	51.6	Low	84 Å²	84	107.5 Å²	107.5	52%	0.515	55%	0.548	S	S	.	.			trans	-113.7	115.3	156.2	53	0	0	0	0	105.8	S330 K334	S330-T332 PolarHBondContact O-N 2.86Å; T332-K334 PolarHBondContact O-N 3.11Å
333	P	38.9	Very low	54.5	Low	126 Å²	126	100.1 Å²	100.1	82%	0.818	51%	0.509	S	S	*	.			trans	-56.5	112.5	169.8	23.6	-28.9	0	0	0	106.1	S335	P333-S335 PolarHBondContact O-N 3.31Å
334	K	50.4	Low	57.3	Low	87 Å²	87	89.4 Å²	89.4	38%	0.378	47%	0.467	S	S	.	.			trans	-61.6	101.3	170.1	-82.9	-177.3	175.2	169	0	105	D163 T332	D163-K334 IonicContact OD1-NZ 2.59Å; D163-K334 PolarHBondContact OD1-NZ 3.02Å; T332-K334 PolarHBondContact O-N 3.11Å
335	S	54	Low	60.4	Low	61 Å²	61	82.9 Å²	82.9	43%	0.427	44%	0.437	S	S	.	.			trans	-39.8	144.3	178.7	165.7	0	0	0	0	111.2	R265 P333 T337	R265-S335 PolarHBondContact NH2-O 3.19Å; P333-S335 PolarHBondContact O-N 3.31Å; S335-T337 VanDerWaalsContact CB-OG1 3.3Å; S335-T337 WeakPolarHBondContact CB-OG1 3.17Å; S335-T337 PolarHBondContact O-N 3.32Å; S335-T337 WeakPolarHBondContact OG-CB 3.29Å; S335-T337 WeakPolarHBondContact OG-CG2 3.01Å; S335-T337 PolarHBondContact OG-N 3.04Å; S335-T337 VanDerWaalsContact OG-N 3.16Å; S335-T337 PolarHBondContact OG-OG1 3.26Å
336	K	62.5	Low	63.5	Low	149 Å²	149	78.7 Å²	78.7	65%	0.648	41%	0.407	S	S	*	.	S	Bend	trans	-55.8	-3.9	170.6	-71.5	-177.8	176.7	177.3	0	113.6	E268	E268-K336 VanDerWaalsContact OE1-CE 3.22Å; E268-K336 WeakPolarHBondContact OE1-CE 3.26Å; E268-K336 WeakPolarHBondContact OE2-CE 3.49Å
337	T	75	Confident	66.2	Low	77 Å²	77	73.8 Å²	73.8	47%	0.472	38%	0.383	S	S	.	.			trans	-59.1	133.7	177.7	47.7	0	0	0	0	111.1	R265 S335	R265-T337 PolarHBondContact NH1-O 2.94Å; R265-T337 PolarHBondContact NH2-O 2.89Å; S335-T337 VanDerWaalsContact CB-OG1 3.3Å; S335-T337 WeakPolarHBondContact CB-OG1 3.17Å; S335-T337 PolarHBondContact O-N 3.32Å; S335-T337 WeakPolarHBondContact OG-CB 3.29Å; S335-T337 WeakPolarHBondContact OG-CG2 3.01Å; S335-T337 PolarHBondContact OG-N 3.04Å; S335-T337 VanDerWaalsContact OG-N 3.16Å; S335-T337 PolarHBondContact OG-OG1 3.26Å
338	P	82.9	Confident	69.4	Low	63 Å²	63	64.8 Å²	64.8	41%	0.409	34%	0.338	S	S	.	.			trans	-59.1	151.6	169.3	27	-33.5	0	0	0	109.9	L133	L133-P338 HydrophobicContact CD2-CB 4.12Å
339	V	87.1	Confident	72.4	Confident	16 Å²	16	55.6 Å²	55.6	10%	0.097	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-125.5	158.1	174.3	-60.6	0	0	0	0	109.2	V132 F341	V132-V339 HydrophobicContact CB-CG2 4.28Å; V132-V339 WeakPolarHBondContact CB-O 3.37Å; V132-V339 PolarHBondContact N-O 2.89Å; V132-V339 PolarHBondContact O-N 2.81Å; V132-V339 VanDerWaalsContact O-N 3.15Å; V339-F341 HydrophobicContact CG2-CE1 3.99Å; V339-F341 HydrophobicContact CG2-CZ 4.49Å
340	H	89.6	Confident	75.3	Confident	34 Å²	34	49.1 Å²	49.1	16%	0.157	27%	0.27	C	S	.	.			trans	-114.6	130.6	174.4	-62	-86.8	0	0	0	109.4	E89 V128 S129 G130 S131	E89-H340 IonicContact OE2-CE1 2.7Å; E89-H340 PolarHBondContact OE2-CE1 2.93Å; E89-H340 IonicContact OE2-ND1 3.38Å; V128-H340 HydrophobicContact CG1-CB 3.77Å; S129-H340 PolarHBondContact O-ND1 2.93Å; G130-H340 PolarHBondContact O-ND1 2.9Å; S131-H340 PolarHBondContact N-CE1 2.84Å
341	F	91.6	Very high	78.3	Confident	3 Å²	3	48 Å²	48	1%	0.013	25%	0.253	C	S	.	.			trans	-86.2	140.5	169.3	-57.1	-37.4	0	0	0	109.2	V128 S129 V132 V138 P162 L263 R265 V339 F343	V128-F341 WeakPolarHBondContact CA-O 3.47Å; S129-F341 PolarHBondContact N-O 2.81Å; S129-F341 PolarHBondContact OG-N 2.72Å; V132-F341 HydrophobicContact CB-CE2 4.28Å; V132-F341 HydrophobicContact CB-CZ 4.45Å; V132-F341 HydrophobicContact CG1-CE2 3.8Å; V132-F341 HydrophobicContact CG1-CZ 4.01Å; V132-F341 HydrophobicContact CG2-CD2 4Å; V132-F341 HydrophobicContact CG2-CE2 4Å; V138-F341 HydrophobicContact CB-CD2 4.49Å; V138-F341 HydrophobicContact CG2-CD2 4.28Å; P162-F341 VanDerWaalsContact CA-CE1 3.48Å; P162-F341 HydrophobicContact CB-CD1 4.25Å; P162-F341 HydrophobicContact CB-CE1 3.85Å; P162-F341 HydrophobicContact CB-CE2 4.2Å; P162-F341 HydrophobicContact CB-CZ 3.81Å; P162-F341 HydrophobicContact CG-CD1 3.81Å; P162-F341 HydrophobicContact CG-CD2 4.18Å; P162-F341 HydrophobicContact CG-CE1 3.95Å; P162-F341 HydrophobicContact CG-CE2 4.27Å; P162-F341 HydrophobicContact CG-CG 3.94Å; P162-F341 HydrophobicContact CG-CZ 4.16Å; L263-F341 HydrophobicContact CB-CD2 3.66Å; L263-F341 HydrophobicContact CB-CE2 3.83Å; L263-F341 HydrophobicContact CD1-CB 4.16Å; L263-F341 HydrophobicContact CD1-CD2 4.05Å; L263-F341 HydrophobicContact CD1-CG 4.46Å; R265-F341 HydrophobicContact CB-CZ 4.26Å; V339-F341 HydrophobicContact CG2-CE1 3.99Å; V339-F341 HydrophobicContact CG2-CZ 4.49Å; F341-F343 HydrophobicContact CB-CE2 4.41Å
342	S	91.3	Very high	81.4	Confident	6 Å²	6	38.4 Å²	38.4	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	135.5	-178.7	-172.3	0	0	0	0	111.9	R93 C126 W127 C158	R93-S342 PolarHBondContact NH2-OG 3.26Å; C126-S342 WeakPolarHBondContact CB-OG 3.01Å; W127-S342 WeakPolarHBondContact O-CA 3.46Å; W127-S342 WeakPolarHBondContact O-CB 3.23Å; W127-S342 PolarHBondContact O-OG 3.47Å; C158-S342 WeakPolarHBondContact CB-OG 3.16Å; C158-S342 PolarHBondContact N-O 3.27Å
343	F	92.9	Very high	84.4	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	142.2	-179.2	-65.9	-92.6	0	0	0	109.8	L115 C126 W127 L155 Q156 P157 P162 I165 I232 L263 F341	L115-F343 HydrophobicContact CD2-CB 3.67Å; C126-F343 WeakPolarHBondContact CA-O 3.5Å; W127-F343 HydrophobicContact CE3-CD2 4.24Å; W127-F343 AromaticContact CZ3-CD2 3.99Å; W127-F343 HydrophobicContact CZ3-CD2 3.99Å; W127-F343 PolarHBondContact N-O 3.45Å; W127-F343 PolarHBondContact O-N 3.06Å; L155-F343 HydrophobicContact CB-CD1 3.98Å; L155-F343 HydrophobicContact CB-CE1 4Å; L155-F343 HydrophobicContact CD1-CE1 4.46Å; L155-F343 HydrophobicContact CD2-CD1 4.22Å; Q156-F343 CarbonylContact O-C 3.21Å; Q156-F343 WeakPolarHBondContact O-CA 3.46Å; Q156-F343 WeakPolarHBondContact O-CB 3.16Å; P157-F343 HydrophobicContact CB-CD1 4.33Å; P157-F343 HydrophobicContact CB-CE1 4.27Å; P157-F343 HydrophobicContact CG-CD1 4.4Å; P157-F343 HydrophobicContact CG-CE1 4.15Å; P162-F343 HydrophobicContact CG-CZ 4.31Å; I165-F343 HydrophobicContact CD1-CZ 4.42Å; I232-F343 HydrophobicContact CD1-CE1 4.44Å; L263-F343 HydrophobicContact CD1-CD2 4.43Å; L263-F343 HydrophobicContact CD1-CE2 3.76Å; L263-F343 HydrophobicContact CD2-CE2 3.97Å; L263-F343 HydrophobicContact CD2-CZ 4.06Å; F341-F343 HydrophobicContact CB-CE2 4.41Å
344	S	92.1	Very high	87.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-22.1	179.4	38.5	0	0	0	0	114.5	T125 Q156 C158	T125-S344 WeakPolarHBondContact O-CA 3.36Å; T125-S344 WeakPolarHBondContact O-CB 3.35Å; Q156-S344 WeakPolarHBondContact CB-OG 3.45Å; Q156-S344 WeakPolarHBondContact CG-OG 3.49Å; Q156-S344 PolarHBondContact O-N 3.19Å; Q156-S344 PolarHBondContact O-OG 2.63Å; C158-S344 VanDerWaalsContact SG-CA 3.56Å; C158-S344 WeakPolarHBondContact SG-CB 3.4Å; C158-S344 PolarHBondContact SG-N 3.01Å; C158-S344 PolarHBondContact SG-OG 2.98Å
345	D	93.8	Very high	89.3	Confident	15 Å²	15	26.3 Å²	26.3	8%	0.08	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	136.6	-177.6	-174.7	64.8	0	0	0	110.8	H119 L155 Q156 S347	H119-D345 HydrophobicContact CB-CB 4.14Å; L155-D345 WeakPolarHBondContact CA-O 3.36Å; Q156-D345 HydrophobicContact CB-CB 4.01Å; Q156-D345 PolarHBondContact N-O 2.65Å; D345-S347 VanDerWaalsContact OD2-CB 3.29Å; D345-S347 WeakPolarHBondContact OD2-CB 3.49Å; D345-S347 PolarHBondContact OD2-N 3.27Å; D345-S347 PolarHBondContact OD2-OG 2.84Å
346	L	95.6	Very high	91.2	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	102.6	163	171.5	59.5	0	0	0	108.1	I76 L115 L142 I153 L155 L259 I261 I348	I76-L346 HydrophobicContact CD1-CD2 3.66Å; L115-L346 HydrophobicContact CB-CB 4.33Å; L115-L346 PolarHBondContact O-N 3.36Å; L142-L346 HydrophobicContact CD1-CD2 4.29Å; I153-L346 HydrophobicContact CG2-CD1 3.86Å; L155-L346 HydrophobicContact CD2-CB 4.18Å; L155-L346 HydrophobicContact CD2-CD1 3.67Å; L155-L346 HydrophobicContact CD2-CG 4.42Å; L155-L346 HydrophobicContact CG-CD1 4.19Å; L259-L346 HydrophobicContact CD2-CD1 4.48Å; I261-L346 HydrophobicContact CD1-CD1 3.78Å; I261-L346 HydrophobicContact CD1-CD2 3.84Å; I261-L346 HydrophobicContact CD1-CG 4.47Å; L346-I348 HydrophobicContact CD1-CG1 4.26Å; L346-I348 HydrophobicContact CG-CG1 4.42Å
347	S	95.8	Very high	92.9	Very high	18 Å²	18	16.3 Å²	16.3	13%	0.126	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.8	176.3	-81.2	0	0	0	0	111	N69 I153 S154 D345	N69-S347 PolarHBondContact ND2-OG 3.36Å; I153-S347 WeakPolarHBondContact CA-O 3.37Å; S154-S347 PolarHBondContact N-O 3.03Å; S154-S347 PolarHBondContact O-N 3.34Å; S154-S347 VanDerWaalsContact OG-CB 3.31Å; S154-S347 WeakPolarHBondContact OG-CB 3.14Å; D345-S347 VanDerWaalsContact OD2-CB 3.29Å; D345-S347 WeakPolarHBondContact OD2-CB 3.49Å; D345-S347 PolarHBondContact OD2-N 3.27Å; D345-S347 PolarHBondContact OD2-OG 2.84Å
348	I	97.4	Very high	93.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	102	175.8	-55.2	178.7	0	0	0	108.1	N69 I70 A71 L142 V150 I153 M256 L259 L346 G350	N69-I348 CarbonylContact C-O 3.54Å; N69-I348 WeakPolarHBondContact CA-O 3.37Å; N69-I348 PolarHBondContact OD1-N 2.83Å; N69-I348 PolarHBondContact OD1-O 2.92Å; I70-I348 HydrophobicContact CD1-CB 4.45Å; I70-I348 HydrophobicContact CD1-CG2 3.68Å; I70-I348 HydrophobicContact CG1-CB 3.8Å; I70-I348 HydrophobicContact CG1-CG2 3.58Å; I70-I348 WeakPolarHBondContact CG1-O 3.46Å; I70-I348 PolarHBondContact N-O 2.98Å; A71-I348 HydrophobicContact CB-CB 4.1Å; A71-I348 HydrophobicContact CB-CD1 3.92Å; A71-I348 HydrophobicContact CB-CG1 3.83Å; L142-I348 HydrophobicContact CD1-CD1 4.02Å; L142-I348 HydrophobicContact CD2-CD1 4.42Å; V150-I348 HydrophobicContact CG1-CG2 3.7Å; V150-I348 HydrophobicContact CG2-CG2 4.1Å; I153-I348 HydrophobicContact CG1-CG1 4.33Å; I153-I348 HydrophobicContact CG1-CG2 4.23Å; M256-I348 HydrophobicContact CE-CD1 4.24Å; M256-I348 HydrophobicContact CE-CG2 4.32Å; L259-I348 HydrophobicContact CD2-CD1 3.57Å; L259-I348 HydrophobicContact CD2-CG1 4.34Å; L346-I348 HydrophobicContact CD1-CG1 4.26Å; L346-I348 HydrophobicContact CG-CG1 4.42Å; I348-G350 PolarHBondContact O-N 3.18Å
349	G	96.4	Very high	94.5	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	116.1	177.9	0	0	0	0	0	111.2	F67 Y151 Y152	F67-G349 VanDerWaalsContact CZ-C 3.48Å; Y151-G349 PolarHBondContact N-O 3.02Å; Y152-G349 PolarHBondContact N-O 3.09Å; Y152-G349 PolarHBondContact O-N 2.76Å
350	G	96	Very high	94.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-173.2	-178.4	0	0	0	0	0	114	F67 T68 E149 I348	F67-G350 WeakPolarHBondContact CA-O 3.27Å; T68-G350 PolarHBondContact N-O 3.17Å; T68-G350 PolarHBondContact O-N 2.82Å; E149-G350 CarbonylContact O-C 3.55Å; E149-G350 WeakPolarHBondContact O-CA 3.44Å; I348-G350 PolarHBondContact O-N 3.18Å
351	R	95.3	Very high	95.2	Very high	62 Å²	62	11 Å²	11	23%	0.234	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.6	172.9	69	-174.2	76.4	-161.3	7.1	111.4	P66 F148 E149 K353	P66-R351 VanDerWaalsContact O-CB 3.31Å; P66-R351 WeakPolarHBondContact O-CB 3.28Å; F148-R351 WeakPolarHBondContact CA-O 3.03Å; F148-R351 VanDerWaalsContact CD1-C 3.45Å; F148-R351 WeakPolarHBondContact CD1-O 3.24Å; E149-R351 HydrophobicContact CB-CG 4.32Å; E149-R351 PolarHBondContact N-O 2.8Å; E149-R351 PolarHBondContact O-N 3.21Å; R351-K353 PolarHBondContact O-N 3.17Å
352	C	96.3	Very high	95.3	Very high	2 Å²	2	11 Å²	11	1%	0.014	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	126.7	176.4	-173	0	0	0	0	109.9	Y47 P65 F148 C354 C361	Y47-C352 HydrophobicContact CD2-CB 4.28Å; P65-C352 HydrophobicContact CB-CB 4.16Å; P65-C352 HydrophobicContact CG-CB 4.03Å; F148-C352 HydrophobicContact CD1-CB 4.24Å; F148-C352 HydrophobicContact CE1-CB 3.89Å; F148-C352 HydrophobicContact CZ-CB 4.48Å; C352-C354 PolarHBondContact O-N 2.87Å; C352-C361 HydrophobicContact CB-CB 3.89Å; C352-C361 WeakPolarHBondContact CB-SG 3.38Å; C352-C361 WeakPolarHBondContact SG-CB 3.32Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 2.76Å
353	K	96.8	Very high	95.3	Very high	26 Å²	26	14 Å²	14	11%	0.113	6%	0.062	C	C	.	.			trans	-74.7	108.5	-175.3	-175.5	175.9	-176	175.6	0	110.7	K146 R147 E149 T255 R351 C388 D398	K146-K353 PolarHBondContact NZ-O 2.96Å; R147-K353 HydrophobicContact CB-CB 4.15Å; R147-K353 HydrophobicContact CB-CD 4.17Å; R147-K353 VanDerWaalsContact O-CB 3.26Å; R147-K353 WeakPolarHBondContact O-CB 3.09Å; R147-K353 PolarHBondContact O-N 3.33Å; E149-K353 HydrophobicContact CG-CB 3.95Å; E149-K353 HydrophobicContact CG-CD 4.23Å; E149-K353 HydrophobicContact CG-CG 3.9Å; T255-K353 HydrophobicContact CG2-CD 3.99Å; T255-K353 PolarHBondContact OG1-NZ 2.86Å; R351-K353 PolarHBondContact O-N 3.17Å; K353-C388 PolarHBondContact O-SG 2.82Å; K353-D398 WeakPolarHBondContact O-CA 3.03Å
354	C	97.1	Very high	95	Very high	3 Å²	3	17 Å²	17	2%	0.02	8%	0.078	C	C	.	.			trans	-127.4	14	178.3	-56.6	0	0	0	0	113.9	P65 C352 G356 H357 A358 C361 C388 D398	P65-C354 HydrophobicContact CG-CB 4.36Å; P65-C354 VanDerWaalsContact CG-SG 3.59Å; C352-C354 PolarHBondContact O-N 2.87Å; C354-G356 PolarHBondContact O-N 2.03Å; C354-H357 PolarHBondContact O-N 3.36Å; C354-A358 HydrophobicContact CB-CB 3.68Å; C354-C361 PolarHBondContact SG-SG 3.4Å; C354-C388 WeakPolarHBondContact CA-SG 3.47Å; C354-C388 HydrophobicContact CB-CB 3.81Å; C354-C388 WeakPolarHBondContact CB-SG 3.46Å; C354-C388 WeakPolarHBondContact SG-CB 3.36Å; C354-C388 CovalentContact SG-SG 2.03Å; C354-C388 PolarHBondContact SG-SG 3.16Å; C354-D398 CarbonylContact C-O 3.57Å; C354-D398 VanDerWaalsContact C-O 3.3Å; C354-D398 WeakPolarHBondContact CA-O 3.45Å
355	N	95.9	Very high	94.6	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.08	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	30.1	176.3	-64.5	-64	0	0	0	114.8	H357 D398 W411 R413 G414	N355-H357 VanDerWaalsContact C-N 3.33Å; N355-H357 PolarHBondContact O-CD2 3.41Å; N355-H357 PolarHBondContact O-NE2 2.92Å; N355-D398 PolarHBondContact ND2-O 3.05Å; N355-W411 HydrophobicContact CB-CH2 4.03Å; N355-W411 HydrophobicContact CB-CZ2 3.65Å; N355-R413 HydrophobicContact CB-CB 4.44Å; N355-R413 HydrophobicContact CB-CG 3.95Å; N355-R413 CarbonylContact O-C 3.52Å; N355-R413 WeakPolarHBondContact O-CA 3.43Å; N355-R413 WeakPolarHBondContact O-CG 3.28Å; N355-G414 PolarHBondContact O-N 2.73Å
356	G	94.8	Very high	93.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	12.4	-179.3	0	0	0	0	0	115.1	C63 C354 H392	C63-G356 PolarHBondContact N-O 3.12Å; C63-G356 VanDerWaalsContact N-O 3.07Å; C63-G356 CarbonylContact O-C 3.29Å; C63-G356 WeakPolarHBondContact O-CA 3.36Å; C354-G356 PolarHBondContact O-N 2.03Å; G356-H392 PolarHBondContact O-CE1 2.92Å; G356-H392 PolarHBondContact O-ND1 3.01Å
357	H	97.2	Very high	92.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-119.6	17.1	-178	-49.4	-76.7	0	0	0	114.8	C63 C354 N355 Q391 H392 T394 C399 W411 A412 G414 A419	C63-H357 PolarHBondContact O-N 3.46Å; C354-H357 PolarHBondContact O-N 3.36Å; N355-H357 VanDerWaalsContact C-N 3.33Å; N355-H357 PolarHBondContact O-CD2 3.41Å; N355-H357 PolarHBondContact O-NE2 2.92Å; H357-Q391 WeakPolarHBondContact O-CA 3.47Å; H357-Q391 WeakPolarHBondContact O-CB 3Å; H357-Q391 PolarHBondContact O-N 2.92Å; H357-H392 WeakPolarHBondContact CA-ND1 3.39Å; H357-H392 HydrophobicContact CB-CB 4.24Å; H357-H392 AromaticContact CG-ND1 3.68Å; H357-H392 WeakPolarHBondContact ND1-CB 3.07Å; H357-H392 AromaticContact ND1-CG 3.59Å; H357-H392 AromaticContact ND1-ND1 3.04Å; H357-H392 PolarHBondContact ND1-ND1 2.84Å; H357-T394 HydrophobicContact CB-CG2 4.17Å; H357-T394 WeakPolarHBondContact CB-OG1 3.38Å; H357-C399 HydrophobicContact CB-CB 3.87Å; H357-W411 AromaticContact NE2-NE1 3.82Å; H357-A412 PolarHBondContact CE1-O 3.04Å; H357-A412 VanDerWaalsContact CE1-O 3.24Å; H357-A412 PolarHBondContact NE2-O 2.84Å; H357-G414 PolarHBondContact NE2-N 2.03Å; H357-A419 PolarHBondContact CE1-O 3.16Å; H357-A419 PolarHBondContact ND1-O 2.97Å
358	A	96.8	Very high	90.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.			trans	-152.2	141.6	170.1	0	0	0	0	0	110.9	C63 S64 P65 C354 C388 D389	C63-A358 CarbonylContact C-O 3.56Å; C63-A358 PolarHBondContact O-N 3.12Å; C63-A358 VanDerWaalsContact O-O 3.07Å; C63-A358 PolarHBondContact SG-N 2.9Å; S64-A358 CarbonylContact C-O 3.59Å; S64-A358 VanDerWaalsContact C-O 3.24Å; S64-A358 WeakPolarHBondContact CA-O 3.18Å; S64-A358 PolarHBondContact N-O 2.87Å; P65-A358 WeakPolarHBondContact CD-O 3.22Å; C354-A358 HydrophobicContact CB-CB 3.68Å; A358-C388 HydrophobicContact CB-CB 3.89Å; A358-D389 VanDerWaalsContact CB-O 3.28Å; A358-D389 WeakPolarHBondContact CB-O 3.15Å
359	N	95.1	Very high	88.5	Confident	31 Å²	31	38.8 Å²	38.8	17%	0.166	21%	0.205	C	C	.	.	S	Bend	trans	-89.9	-8.7	173.9	65.5	-20.4	0	0	0	113.4	A49 S52 C63 P65	A49-N359 PolarHBondContact N-O 2.99Å; S52-N359 VanDerWaalsContact O-CB 3.24Å; S52-N359 WeakPolarHBondContact O-CB 3.46Å; S52-N359 PolarHBondContact O-ND2 3.04Å; S52-N359 WeakPolarHBondContact OG-CB 3.45Å; C63-N359 HydrophobicContact CB-CB 4.35Å; P65-N359 WeakPolarHBondContact CA-O 3.23Å
360	R	94.9	Very high	86.2	Confident	48 Å²	48	41.5 Å²	41.5	18%	0.181	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.5	-177.3	67.1	-173.8	-175.8	168.4	7.2	114	V45 Y47 E48 I362 D389	V45-R360 HydrophobicContact CG1-CB 4.45Å; Y47-R360 CarbonylContact O-C 3.52Å; Y47-R360 WeakPolarHBondContact O-CA 3.28Å; Y47-R360 WeakPolarHBondContact O-CB 3.43Å; E48-R360 HydrophobicContact CB-CB 4.19Å; E48-R360 HydrophobicContact CG-CB 4.28Å; E48-R360 WeakPolarHBondContact OE1-CD 3.25Å; E48-R360 IonicContact OE1-NH1 2.68Å; E48-R360 PolarHBondContact OE1-NH1 3.42Å; R360-I362 HydrophobicContact CG-CG2 4.22Å; R360-D389 HydrophobicContact CG-CB 3.75Å; R360-D389 IonicContact CZ-OD2 3.25Å; R360-D389 VanDerWaalsContact CZ-OD2 3.25Å; R360-D389 IonicContact NE-OD2 2.71Å; R360-D389 PolarHBondContact NE-OD2 3.37Å; R360-D389 IonicContact NH2-OD2 2.96Å; R360-D389 PolarHBondContact NH2-OD2 2.83Å; R360-D389 PolarHBondContact O-N 3.45Å; R360-D389 VanDerWaalsContact O-N 3.1Å
361	C	95.3	Very high	84.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.8	170.8	-76.8	0	0	0	0	110.9	I46 Y47 C352 C354 L386 R387	I46-C361 PolarHBondContact N-O 3.04Å; Y47-C361 HydrophobicContact CD2-CB 4.13Å; Y47-C361 PolarHBondContact N-O 2.73Å; Y47-C361 PolarHBondContact O-N 3.42Å; C352-C361 HydrophobicContact CB-CB 3.89Å; C352-C361 WeakPolarHBondContact CB-SG 3.38Å; C352-C361 WeakPolarHBondContact SG-CB 3.32Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 2.76Å; C354-C361 PolarHBondContact SG-SG 3.4Å; C361-L386 HydrophobicContact CB-CD1 3.89Å; C361-L386 HydrophobicContact CB-CG 4.33Å; C361-R387 CarbonylContact C-O 3.58Å; C361-R387 VanDerWaalsContact CA-O 3.23Å; C361-R387 WeakPolarHBondContact CA-O 3.04Å; C361-R387 WeakPolarHBondContact CB-O 3.07Å
362	I	94.4	Very high	82	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158.9	-168	63.8	171.1	0	0	0	111.9	I43 K44 V45 R360 R387 D389	I43-I362 HydrophobicContact CD1-CD1 4.47Å; I43-I362 HydrophobicContact CG2-CB 3.66Å; I43-I362 HydrophobicContact CG2-CD1 3.78Å; I43-I362 HydrophobicContact CG2-CG1 4.25Å; I43-I362 HydrophobicContact CG2-CG2 3.89Å; K44-I362 CarbonylContact O-C 3.57Å; K44-I362 WeakPolarHBondContact O-CA 3.25Å; V45-I362 HydrophobicContact CB-CG2 4.45Å; V45-I362 HydrophobicContact CG1-CG2 4.49Å; V45-I362 HydrophobicContact CG2-CG2 4.03Å; R360-I362 HydrophobicContact CG-CG2 4.22Å; I362-R387 HydrophobicContact CG1-CG 4.4Å; I362-R387 PolarHBondContact N-O 2.92Å; I362-R387 PolarHBondContact O-N 2.04Å; I362-D389 HydrophobicContact CD1-CB 4.03Å; I362-D389 HydrophobicContact CG1-CB 4.29Å; I362-D389 HydrophobicContact CG2-CB 4.31Å
363	R	91.9	Very high	79.9	Confident	71 Å²	71	53 Å²	53	27%	0.268	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.3	166.8	-67.3	-176.4	171.5	105	-2.4	109.1	K44 I46 W383 G384 L386	K44-R363 HydrophobicContact CB-CB 4.45Å; K44-R363 PolarHBondContact N-O 3.4Å; K44-R363 PolarHBondContact O-N 2.97Å; I46-R363 HydrophobicContact CG1-CG 4.26Å; I46-R363 VanDerWaalsContact CG1-NH1 3.3Å; R363-W383 HydrophobicContact CB-CB 4.21Å; R363-W383 HydrophobicContact CB-CE3 4.09Å; R363-W383 VanDerWaalsContact O-CE3 3.31Å; R363-W383 WeakPolarHBondContact O-CZ3 3.22Å; R363-G384 WeakPolarHBondContact CD-O 3.41Å; R363-G384 WeakPolarHBondContact CG-O 3.02Å; R363-L386 HydrophobicContact CG-CB 4.2Å; R363-L386 HydrophobicContact CG-CD1 4.01Å
364	D	86.9	Confident	78	Confident	63 Å²	63	53.7 Å²	53.7	34%	0.337	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	146.9	171.8	-63.6	-20.8	0	0	0	110.2	I366 G384 R387	D364-I366 PolarHBondContact O-N 3.1Å; D364-G384 PolarHBondContact O-N 2.69Å; D364-R387 VanDerWaalsContact CG-CZ 3.45Å; D364-R387 IonicContact OD1-CZ 3.41Å; D364-R387 IonicContact OD1-NH1 3.8Å; D364-R387 PolarHBondContact OD1-NH1 2.8Å; D364-R387 IonicContact OD1-NH2 2.84Å; D364-R387 PolarHBondContact OD1-NH2 3.29Å; D364-R387 IonicContact OD2-CZ 2.72Å; D364-R387 IonicContact OD2-NH1 2.63Å; D364-R387 PolarHBondContact OD2-NH1 3.45Å; D364-R387 IonicContact OD2-NH2 3.04Å; D364-R387 PolarHBondContact OD2-NH2 2.76Å
365	R	83.7	Confident	76.2	Confident	88 Å²	88	61.8 Å²	61.8	33%	0.332	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-71	124.4	168.8	-169.6	177.2	-175.7	-163.8	0.5	109.1	N42 V367 S381 W383	N42-R365 WeakPolarHBondContact O-CB 3.28Å; N42-R365 PolarHBondContact O-N 3.42Å; R365-V367 PolarHBondContact O-N 3.21Å; R365-V367 VanDerWaalsContact O-N 3.15Å; R365-S381 PolarHBondContact NE-OG 3.12Å; R365-S381 VanDerWaalsContact NE-OG 3.15Å; R365-S381 PolarHBondContact NH2-OG 3.45Å; R365-W383 HydrophobicContact CB-CE3 4.25Å; R365-W383 HydrophobicContact CB-CH2 4.35Å; R365-W383 HydrophobicContact CB-CZ3 3.9Å
366	I	77.3	Confident	74.4	Confident	80 Å²	80	67.7 Å²	67.7	41%	0.41	38%	0.384	S	S	.	.			trans	-77.9	101.2	170.4	-55.9	177.7	0	0	0	106.7	D364 G368 Q382	D364-I366 PolarHBondContact O-N 3.1Å; I366-G368 PolarHBondContact O-N 2.97Å; I366-Q382 WeakPolarHBondContact CB-O 2.95Å; I366-Q382 HydrophobicContact CD1-CG 4.16Å; I366-Q382 PolarHBondContact N-O 3.23Å
367	V	66.6	Low	72.5	Confident	121 Å²	121	70.4 Å²	70.4	73%	0.733	41%	0.412	S	S	*	.			trans	-77.9	78.8	168.2	-171.8	0	0	0	0	107.2	R365	R365-V367 PolarHBondContact O-N 3.21Å; R365-V367 VanDerWaalsContact O-N 3.15Å
368	G	57.5	Low	70.5	Confident	39 Å²	39	76.7 Å²	76.7	40%	0.402	44%	0.441	S	S	.	.			trans	-72.9	140.3	171.5	0	0	0	0	0	109.8	I366 G370	I366-G368 PolarHBondContact O-N 2.97Å; G368-G370 PolarHBondContact O-N 3.16Å
369	T	52.7	Low	68.4	Low	164 Å²	164	80.2 Å²	80.2	100%	1.006	46%	0.463	S	S	*	.	S	Bend	trans	-64.9	16.5	170.3	49.8	0	0	0	0	113.7
370	G	48.7	Very low	66.6	Low	57 Å²	57	85.8 Å²	85.8	59%	0.588	49%	0.486	S	S	*	.			trans	-135.5	90.1	175.6	0	0	0	0	0	109.2	G368 T372	G368-G370 PolarHBondContact O-N 3.16Å; G370-T372 PolarHBondContact O-N 3Å
371	I	53.2	Low	64.9	Low	123 Å²	123	85.7 Å²	85.7	63%	0.631	49%	0.493	S	S	*	.			trans	-64.2	104.5	167.1	-63.1	172.5	0	0	0	106.3	T373 T379	I371-T373 HydrophobicContact CG2-CG2 4.12Å; I371-T373 PolarHBondContact O-N 3.41Å; I371-T379 HydrophobicContact CG2-CG2 3.31Å
372	T	50	Low	63.8	Low	94 Å²	94	92.1 Å²	92.1	58%	0.577	52%	0.523	S	S	*	.			trans	-79.2	101.8	164.8	51.2	0	0	0	0	107	G370 K380	G370-T372 PolarHBondContact O-N 3Å; T372-K380 PolarHBondContact O-N 2.63Å
373	T	51.1	Low	63.2	Low	89 Å²	89	96.3 Å²	96.3	55%	0.546	54%	0.538	S	S	.	.	B	Isolated β-bridge	trans	-69.4	130.2	163.2	46.1	0	0	0	0	107.6	I371 Q378	I371-T373 HydrophobicContact CG2-CG2 4.12Å; I371-T373 PolarHBondContact O-N 3.41Å; T373-Q378 WeakPolarHBondContact CA-O 3.45Å
374	D	56.6	Low	62.8	Low	41 Å²	41	93.4 Å²	93.4	22%	0.219	53%	0.53	C	S	.	.			trans	-66.7	172.5	160.6	65.2	14.6	0	0	0	110.4	N376 G377 Q378	D374-N376 PolarHBondContact O-N 2.94Å; D374-N376 VanDerWaalsContact OD1-C 3.3Å; D374-N376 WeakPolarHBondContact OD1-CA 3.35Å; D374-N376 WeakPolarHBondContact OD1-CB 3.03Å; D374-N376 PolarHBondContact OD1-N 3.24Å; D374-G377 PolarHBondContact O-N 2.03Å; D374-G377 PolarHBondContact OD1-N 3.15Å; D374-G377 VanDerWaalsContact OD1-N 3.11Å; D374-Q378 PolarHBondContact N-O 3.29Å; D374-Q378 PolarHBondContact OD1-N 3.49Å
375	N	58.9	Low	63	Low	172 Å²	172	95.5 Å²	95.5	92%	0.92	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-6.3	179	-65.4	-20.1	0	0	0	113.4
376	N	59	Low	63.5	Low	140 Å²	140	91.8 Å²	91.8	75%	0.749	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	8.3	178.8	-63.9	-9.7	0	0	0	112.6	D374 Q378	D374-N376 PolarHBondContact O-N 2.94Å; D374-N376 VanDerWaalsContact OD1-C 3.3Å; D374-N376 WeakPolarHBondContact OD1-CA 3.35Å; D374-N376 WeakPolarHBondContact OD1-CB 3.03Å; D374-N376 PolarHBondContact OD1-N 3.24Å; N376-Q378 VanDerWaalsContact C-N 3.29Å; N376-Q378 PolarHBondContact O-N 2.05Å
377	G	55	Low	64.3	Low	56 Å²	56	91.3 Å²	91.3	58%	0.577	53%	0.527	S	S	*	.	S	Bend	trans	75	10.7	179.4	0	0	0	0	0	114.8	D374	D374-G377 PolarHBondContact O-N 2.03Å; D374-G377 PolarHBondContact OD1-N 3.15Å; D374-G377 VanDerWaalsContact OD1-N 3.11Å
378	Q	54.2	Low	65.8	Low	132 Å²	132	85.6 Å²	85.6	62%	0.617	49%	0.493	S	S	*	.			trans	-85.3	130.2	175.8	-62.7	-172.2	-7.5	0	0	110.9	T373 D374 N376 K380	T373-Q378 WeakPolarHBondContact CA-O 3.45Å; D374-Q378 PolarHBondContact N-O 3.29Å; D374-Q378 PolarHBondContact OD1-N 3.49Å; N376-Q378 VanDerWaalsContact C-N 3.29Å; N376-Q378 PolarHBondContact O-N 2.05Å; Q378-K380 PolarHBondContact O-N 2.81Å
379	T	54.3	Low	67.6	Low	75 Å²	75	85.5 Å²	85.5	46%	0.46	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-73.1	109.2	176.1	59.2	0	0	0	0	109.9	I371 S381	I371-T379 HydrophobicContact CG2-CG2 3.31Å; T379-S381 PolarHBondContact O-N 3.41Å
380	K	55.9	Low	69.7	Low	147 Å²	147	79 Å²	79	64%	0.639	44%	0.444	S	S	*	.			trans	-71.1	97.4	173.6	-81.5	-174	176.8	178.4	0	109.3	T372 Q378 Q382	T372-K380 PolarHBondContact O-N 2.63Å; Q378-K380 PolarHBondContact O-N 2.81Å; K380-Q382 PolarHBondContact O-N 3.38Å; K380-Q382 VanDerWaalsContact O-N 3.08Å
381	S	59.8	Low	71.9	Confident	47 Å²	47	79.1 Å²	79.1	33%	0.329	43%	0.429	S	S	.	.			trans	-68.1	106.5	174	-65.9	0	0	0	0	109.3	R365 T379	R365-S381 PolarHBondContact NE-OG 3.12Å; R365-S381 VanDerWaalsContact NE-OG 3.15Å; R365-S381 PolarHBondContact NH2-OG 3.45Å; T379-S381 PolarHBondContact O-N 3.41Å
382	Q	72.8	Confident	74	Confident	135 Å²	135	73.2 Å²	73.2	63%	0.631	40%	0.399	S	S	*	.			trans	-78.2	123.7	174.9	-167.5	177	1.7	0	0	109.3	I366 K380	I366-Q382 WeakPolarHBondContact CB-O 2.95Å; I366-Q382 HydrophobicContact CD1-CG 4.16Å; I366-Q382 PolarHBondContact N-O 3.23Å; K380-Q382 PolarHBondContact O-N 3.38Å; K380-Q382 VanDerWaalsContact O-N 3.08Å
383	W	80.9	Confident	76.3	Confident	89 Å²	89	71.2 Å²	71.2	34%	0.337	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-89.6	143.1	176.1	-67.1	94.8	0	0	0	110.8	K44 R363 R365	K44-W383 HydrophobicContact CB-CD2 3.84Å; K44-W383 HydrophobicContact CB-CE3 3.54Å; K44-W383 HydrophobicContact CB-CH2 3.51Å; K44-W383 HydrophobicContact CB-CZ2 3.78Å; K44-W383 HydrophobicContact CB-CZ3 3.39Å; K44-W383 HydrophobicContact CD-CD2 4.2Å; K44-W383 HydrophobicContact CD-CZ2 4.34Å; R363-W383 HydrophobicContact CB-CB 4.21Å; R363-W383 HydrophobicContact CB-CE3 4.09Å; R363-W383 VanDerWaalsContact O-CE3 3.31Å; R363-W383 WeakPolarHBondContact O-CZ3 3.22Å; R365-W383 HydrophobicContact CB-CE3 4.25Å; R365-W383 HydrophobicContact CB-CH2 4.35Å; R365-W383 HydrophobicContact CB-CZ3 3.9Å
384	G	84.7	Confident	78.5	Confident	9 Å²	9	67.3 Å²	67.3	9%	0.093	36%	0.36	C	S	.	.			trans	-74.6	179.2	176.9	0	0	0	0	0	113.7	R363 D364	R363-G384 WeakPolarHBondContact CD-O 3.41Å; R363-G384 WeakPolarHBondContact CG-O 3.02Å; D364-G384 PolarHBondContact O-N 2.69Å
385	P	90.4	Very high	80.4	Confident	108 Å²	108	67.9 Å²	67.9	70%	0.701	36%	0.362	S	S	*	.			trans	-61.8	145.5	177.1	27.4	-34.1	0	0	0	111	R387	P385-R387 PolarHBondContact O-N 3.46Å
386	L	93.2	Very high	82.2	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.047	33%	0.328	C	S	.	.			trans	-67.3	131.4	175.2	-178.3	65	0	0	0	109.5	I46 Y47 K146 F148 C361 R363	I46-L386 HydrophobicContact CB-CD1 3.95Å; I46-L386 HydrophobicContact CG1-CD1 3.68Å; Y47-L386 HydrophobicContact CD2-CD2 4.47Å; Y47-L386 HydrophobicContact CE2-CD2 4.02Å; K146-L386 HydrophobicContact CB-CB 4.08Å; K146-L386 HydrophobicContact CB-CD2 3.97Å; K146-L386 HydrophobicContact CB-CG 4.18Å; K146-L386 WeakPolarHBondContact CD-O 3.41Å; K146-L386 HydrophobicContact CG-CB 4.49Å; K146-L386 HydrophobicContact CG-CD2 4.17Å; K146-L386 HydrophobicContact CG-CG 4.19Å; F148-L386 HydrophobicContact CE2-CD2 4.37Å; F148-L386 HydrophobicContact CZ-CD2 3.91Å; C361-L386 HydrophobicContact CB-CD1 3.89Å; C361-L386 HydrophobicContact CB-CG 4.33Å; R363-L386 HydrophobicContact CG-CB 4.2Å; R363-L386 HydrophobicContact CG-CD1 4.01Å
387	R	95.1	Very high	83.9	Confident	71 Å²	71	56.1 Å²	56.1	27%	0.268	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	168.5	174	71.4	177.4	-168.4	-61.5	3.5	111.5	C361 I362 D364 P385 A397	C361-R387 CarbonylContact C-O 3.58Å; C361-R387 VanDerWaalsContact CA-O 3.23Å; C361-R387 WeakPolarHBondContact CA-O 3.04Å; C361-R387 WeakPolarHBondContact CB-O 3.07Å; I362-R387 HydrophobicContact CG1-CG 4.4Å; I362-R387 PolarHBondContact N-O 2.92Å; I362-R387 PolarHBondContact O-N 2.04Å; D364-R387 VanDerWaalsContact CG-CZ 3.45Å; D364-R387 IonicContact OD1-CZ 3.41Å; D364-R387 IonicContact OD1-NH1 3.8Å; D364-R387 PolarHBondContact OD1-NH1 2.8Å; D364-R387 IonicContact OD1-NH2 2.84Å; D364-R387 PolarHBondContact OD1-NH2 3.29Å; D364-R387 IonicContact OD2-CZ 2.72Å; D364-R387 IonicContact OD2-NH1 2.63Å; D364-R387 PolarHBondContact OD2-NH1 3.45Å; D364-R387 IonicContact OD2-NH2 3.04Å; D364-R387 PolarHBondContact OD2-NH2 2.76Å; P385-R387 PolarHBondContact O-N 3.46Å; R387-A397 HydrophobicContact CB-CB 4.5Å
388	C	97	Very high	85.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	144	169.3	-60	0	0	0	0	111.6	K146 K353 C354 A358 C390 A397 C399	K146-C388 PolarHBondContact NZ-SG 2.78Å; K353-C388 PolarHBondContact O-SG 2.82Å; C354-C388 WeakPolarHBondContact CA-SG 3.47Å; C354-C388 HydrophobicContact CB-CB 3.81Å; C354-C388 WeakPolarHBondContact CB-SG 3.46Å; C354-C388 WeakPolarHBondContact SG-CB 3.36Å; C354-C388 CovalentContact SG-SG 2.03Å; C354-C388 PolarHBondContact SG-SG 3.16Å; A358-C388 HydrophobicContact CB-CB 3.89Å; C388-C390 VanDerWaalsContact C-N 3.33Å; C388-C390 PolarHBondContact O-N 3.01Å; C388-A397 PolarHBondContact N-O 2.7Å; C388-A397 PolarHBondContact SG-O 3.46Å; C388-C399 WeakPolarHBondContact CB-SG 3.01Å
389	D	95.5	Very high	88	Confident	36 Å²	36	47.5 Å²	47.5	19%	0.193	26%	0.255	C	S	.	.			trans	-83.5	80.7	166.4	-173.2	12.2	0	0	0	109.2	A358 R360 I362 Q391	A358-D389 VanDerWaalsContact CB-O 3.28Å; A358-D389 WeakPolarHBondContact CB-O 3.15Å; R360-D389 HydrophobicContact CG-CB 3.75Å; R360-D389 IonicContact CZ-OD2 3.25Å; R360-D389 VanDerWaalsContact CZ-OD2 3.25Å; R360-D389 IonicContact NE-OD2 2.71Å; R360-D389 PolarHBondContact NE-OD2 3.37Å; R360-D389 IonicContact NH2-OD2 2.96Å; R360-D389 PolarHBondContact NH2-OD2 2.83Å; R360-D389 PolarHBondContact O-N 3.45Å; R360-D389 VanDerWaalsContact O-N 3.1Å; I362-D389 HydrophobicContact CD1-CB 4.03Å; I362-D389 HydrophobicContact CG1-CB 4.29Å; I362-D389 HydrophobicContact CG2-CB 4.31Å; D389-Q391 PolarHBondContact O-N 2.92Å
390	C	96.8	Very high	90	Very high	29 Å²	29	47.5 Å²	47.5	20%	0.196	25%	0.249	C	C	.	.			trans	-65.1	132.3	-166.1	-65	0	0	0	0	113.7	C388 T394 G396 C399	C388-C390 VanDerWaalsContact C-N 3.33Å; C388-C390 PolarHBondContact O-N 3.01Å; C390-T394 VanDerWaalsContact CB-O 3.25Å; C390-T394 WeakPolarHBondContact CB-O 3.34Å; C390-G396 PolarHBondContact SG-O 3.39Å; C390-G396 VanDerWaalsContact SG-O 3.42Å; C390-C399 WeakPolarHBondContact CA-SG 3.17Å; C390-C399 HydrophobicContact CB-CB 3.97Å; C390-C399 WeakPolarHBondContact CB-SG 3.27Å; C390-C399 WeakPolarHBondContact SG-CA 3.45Å; C390-C399 WeakPolarHBondContact SG-CB 3.5Å; C390-C399 CovalentContact SG-SG 2.05Å; C390-C399 PolarHBondContact SG-SG 2.61Å
391	Q	96.1	Very high	92	Very high	58 Å²	58	46.9 Å²	46.9	27%	0.271	24%	0.243	S	C	.	.			trans	-111.4	-167.6	174.9	-60.5	-59.8	-35.7	0	0	109.9	C54 Y55 H357 D389 N393 T394	C54-Q391 HydrophobicContact CB-CB 4.01Å; C54-Q391 HydrophobicContact CB-CG 4.05Å; Y55-Q391 HydrophobicContact CE2-CB 4.39Å; H357-Q391 WeakPolarHBondContact O-CA 3.47Å; H357-Q391 WeakPolarHBondContact O-CB 3Å; H357-Q391 PolarHBondContact O-N 2.92Å; D389-Q391 PolarHBondContact O-N 2.92Å; Q391-N393 PolarHBondContact O-N 3.49Å; Q391-T394 WeakPolarHBondContact O-CB 3.26Å; Q391-T394 PolarHBondContact O-N 3.5Å; Q391-T394 PolarHBondContact O-OG1 3.02Å
392	H	97.2	Very high	93.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	27.1	174.5	-56	153.1	0	0	0	114.3	C54 Y55 I61 G356 H357 T394 D421 C422	C54-H392 PolarHBondContact O-NE2 2.91Å; C54-H392 VanDerWaalsContact O-NE2 3.12Å; Y55-H392 AromaticContact CZ-CD2 3.98Å; Y55-H392 PolarHBondContact OH-N 2.83Å; I61-H392 PolarHBondContact O-CE1 3.35Å; I61-H392 PolarHBondContact O-NE2 3.44Å; I61-H392 VanDerWaalsContact O-NE2 3.11Å; G356-H392 PolarHBondContact O-CE1 2.92Å; G356-H392 PolarHBondContact O-ND1 3.01Å; H357-H392 WeakPolarHBondContact CA-ND1 3.39Å; H357-H392 HydrophobicContact CB-CB 4.24Å; H357-H392 AromaticContact CG-ND1 3.68Å; H357-H392 WeakPolarHBondContact ND1-CB 3.07Å; H357-H392 AromaticContact ND1-CG 3.59Å; H357-H392 AromaticContact ND1-ND1 3.04Å; H357-H392 PolarHBondContact ND1-ND1 2.84Å; H392-T394 HydrophobicContact CB-CG2 4.32Å; H392-T394 PolarHBondContact O-N 2.8Å; H392-D421 HydrophobicContact CB-CB 3.86Å; H392-C422 PolarHBondContact O-N 2.64Å
393	N	96.7	Very high	94.9	Very high	52 Å²	52	40 Å²	40	28%	0.278	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.8	-173.5	-46.1	-57.5	0	0	0	113.1	Q391 S403 Y406 C422	Q391-N393 PolarHBondContact O-N 3.49Å; N393-S403 VanDerWaalsContact C-OG 3.32Å; N393-S403 PolarHBondContact O-N 3.4Å; N393-S403 PolarHBondContact O-OG 2.98Å; N393-Y406 HydrophobicContact CB-CD1 3.35Å; N393-Y406 HydrophobicContact CB-CD2 4.03Å; N393-Y406 HydrophobicContact CB-CE1 3.72Å; N393-Y406 HydrophobicContact CB-CE2 4.34Å; N393-Y406 HydrophobicContact CB-CG 3.53Å; N393-Y406 WeakPolarHBondContact ND2-CD1 3.19Å; N393-Y406 WeakPolarHBondContact ND2-CE1 3.38Å; N393-Y406 WeakPolarHBondContact OD1-CE1 3.24Å; N393-C422 HydrophobicContact CB-CB 4.02Å; N393-C422 PolarHBondContact ND2-O 2.8Å; N393-C422 VanDerWaalsContact O-CB 3.27Å; N393-C422 WeakPolarHBondContact O-CB 3.25Å
394	T	98.1	Very high	95.5	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	159.5	174.2	63	0	0	0	0	110.7	H357 C390 Q391 H392 C399 R401 S403	H357-T394 HydrophobicContact CB-CG2 4.17Å; H357-T394 WeakPolarHBondContact CB-OG1 3.38Å; C390-T394 VanDerWaalsContact CB-O 3.25Å; C390-T394 WeakPolarHBondContact CB-O 3.34Å; Q391-T394 WeakPolarHBondContact O-CB 3.26Å; Q391-T394 PolarHBondContact O-N 3.5Å; Q391-T394 PolarHBondContact O-OG1 3.02Å; H392-T394 HydrophobicContact CB-CG2 4.32Å; H392-T394 PolarHBondContact O-N 2.8Å; T394-C399 WeakPolarHBondContact OG1-CB 3.48Å; T394-R401 CarbonylContact C-O 3.59Å; T394-R401 VanDerWaalsContact CA-O 3.24Å; T394-R401 WeakPolarHBondContact CA-O 3.33Å; T394-R401 WeakPolarHBondContact CB-O 3.34Å; T394-S403 PolarHBondContact O-OG 2.83Å
395	E	96.2	Very high	96	Very high	54 Å²	54	40.2 Å²	40.2	25%	0.252	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	177.3	174.6	66.8	169.2	-144.8	0	0	110.1	C399 E400 R401 P404	E395-C399 CarbonylContact O-C 3.52Å; E395-C399 WeakPolarHBondContact O-CA 3.38Å; E395-E400 PolarHBondContact O-N 2.96Å; E395-R401 HydrophobicContact CG-CG 3.6Å; E395-R401 PolarHBondContact N-O 2.78Å; E395-R401 WeakPolarHBondContact O-CG 3.41Å; E395-R401 PolarHBondContact O-N 2.84Å; E395-R401 IonicContact OE1-CZ 2.78Å; E395-R401 IonicContact OE1-NE 2.83Å; E395-R401 PolarHBondContact OE1-NE 2.98Å; E395-R401 IonicContact OE1-NH2 3.25Å; E395-R401 PolarHBondContact OE1-NH2 3.47Å; E395-P404 WeakPolarHBondContact OE2-CD 3.4Å
396	G	96.2	Very high	96.3	Very high	21 Å²	21	38.3 Å²	38.3	22%	0.216	20%	0.202	C	C	.	.	S	Bend	trans	104.4	172.2	-174.1	0	0	0	0	0	111.8	C390 D398 E400	C390-G396 PolarHBondContact SG-O 3.39Å; C390-G396 VanDerWaalsContact SG-O 3.42Å; G396-D398 VanDerWaalsContact C-N 3.3Å; G396-D398 PolarHBondContact O-N 2.82Å; G396-E400 WeakPolarHBondContact CA-OE2 3.25Å
397	A	95.9	Very high	96.4	Very high	43 Å²	43	40.4 Å²	40.4	36%	0.355	21%	0.212	S	C	.	.	S	Bend	trans	-69.2	-34.2	-177.5	0	0	0	0	0	111.5	K146 R387 C388 E400	K146-A397 WeakPolarHBondContact CE-O 3.47Å; K146-A397 PolarHBondContact NZ-O 3.03Å; R387-A397 HydrophobicContact CB-CB 4.5Å; C388-A397 PolarHBondContact N-O 2.7Å; C388-A397 PolarHBondContact SG-O 3.46Å; A397-E400 PolarHBondContact N-OE2 3.17Å
398	D	97.3	Very high	96.5	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.043	21%	0.206	C	C	.	.	S	Bend	trans	-109.9	11.7	-177.6	-53.8	-43.1	0	0	0	111.7	K146 R147 K353 C354 N355 G396 E400	K146-D398 WeakPolarHBondContact CE-OD1 3.37Å; K146-D398 IonicContact NZ-OD1 3.18Å; K146-D398 PolarHBondContact NZ-OD1 3.26Å; R147-D398 WeakPolarHBondContact CD-OD2 3.47Å; R147-D398 IonicContact CZ-OD2 3.29Å; R147-D398 IonicContact NE-OD2 3.79Å; R147-D398 PolarHBondContact NE-OD2 3.24Å; K353-D398 WeakPolarHBondContact O-CA 3.03Å; C354-D398 CarbonylContact C-O 3.57Å; C354-D398 VanDerWaalsContact C-O 3.3Å; C354-D398 WeakPolarHBondContact CA-O 3.45Å; N355-D398 PolarHBondContact ND2-O 3.05Å; G396-D398 VanDerWaalsContact C-N 3.3Å; G396-D398 PolarHBondContact O-N 2.82Å; D398-E400 VanDerWaalsContact C-N 3.28Å; D398-E400 WeakPolarHBondContact CA-OE2 3.39Å; D398-E400 PolarHBondContact N-OE2 2.98Å; D398-E400 PolarHBondContact O-N 3.47Å
399	C	98	Very high	96.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	58.2	38	-170.8	-48.7	0	0	0	0	113.1	H357 C388 C390 T394 E395 W411	H357-C399 HydrophobicContact CB-CB 3.87Å; C388-C399 WeakPolarHBondContact CB-SG 3.01Å; C390-C399 WeakPolarHBondContact CA-SG 3.17Å; C390-C399 HydrophobicContact CB-CB 3.97Å; C390-C399 WeakPolarHBondContact CB-SG 3.27Å; C390-C399 WeakPolarHBondContact SG-CA 3.45Å; C390-C399 WeakPolarHBondContact SG-CB 3.5Å; C390-C399 CovalentContact SG-SG 2.05Å; C390-C399 PolarHBondContact SG-SG 2.61Å; T394-C399 WeakPolarHBondContact OG1-CB 3.48Å; E395-C399 CarbonylContact O-C 3.52Å; E395-C399 WeakPolarHBondContact O-CA 3.38Å; C399-W411 WeakPolarHBondContact O-CZ2 3.32Å; C399-W411 PolarHBondContact O-NE1 2.99Å
400	E	96.1	Very high	96.5	Very high	74 Å²	74	41.8 Å²	41.8	35%	0.346	22%	0.224	S	C	.	.			trans	-86.2	1.9	-169.9	72.6	-80	-175.2	0	0	115.3	E395 G396 A397 D398	E395-E400 PolarHBondContact O-N 2.96Å; G396-E400 WeakPolarHBondContact CA-OE2 3.25Å; A397-E400 PolarHBondContact N-OE2 3.17Å; D398-E400 VanDerWaalsContact C-N 3.28Å; D398-E400 WeakPolarHBondContact CA-OE2 3.39Å; D398-E400 PolarHBondContact N-OE2 2.98Å; D398-E400 PolarHBondContact O-N 3.47Å
401	R	97.2	Very high	96.5	Very high	135 Å²	135	43.9 Å²	43.9	51%	0.509	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	161.6	178.7	68	-166.8	-165	-155.3	0.9	111.5	T394 E395	T394-R401 CarbonylContact C-O 3.59Å; T394-R401 VanDerWaalsContact CA-O 3.24Å; T394-R401 WeakPolarHBondContact CA-O 3.33Å; T394-R401 WeakPolarHBondContact CB-O 3.34Å; E395-R401 HydrophobicContact CG-CG 3.6Å; E395-R401 PolarHBondContact N-O 2.78Å; E395-R401 WeakPolarHBondContact O-CG 3.41Å; E395-R401 PolarHBondContact O-N 2.84Å; E395-R401 IonicContact OE1-CZ 2.78Å; E395-R401 IonicContact OE1-NE 2.83Å; E395-R401 PolarHBondContact OE1-NE 2.98Å; E395-R401 IonicContact OE1-NH2 3.25Å; E395-R401 PolarHBondContact OE1-NH2 3.47Å
402	C	97.9	Very high	96.4	Very high	11 Å²	11	43 Å²	43	7%	0.074	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	145.4	173.6	-63	0	0	0	0	111.5	Y406 L407 C422	C402-Y406 WeakPolarHBondContact CB-O 3.24Å; C402-L407 HydrophobicContact CB-CD2 3.93Å; C402-C422 WeakPolarHBondContact CA-SG 3.06Å; C402-C422 HydrophobicContact CB-CB 3.54Å; C402-C422 WeakPolarHBondContact CB-SG 3.09Å; C402-C422 WeakPolarHBondContact SG-CB 3.41Å; C402-C422 CovalentContact SG-SG 2.03Å; C402-C422 PolarHBondContact SG-SG 3.03Å
403	S	96.3	Very high	96.3	Very high	26 Å²	26	44.5 Å²	44.5	18%	0.182	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-63.2	151.5	171.6	-53.9	0	0	0	0	111.3	N393 T394 G405 Y406	N393-S403 VanDerWaalsContact C-OG 3.32Å; N393-S403 PolarHBondContact O-N 3.4Å; N393-S403 PolarHBondContact O-OG 2.98Å; T394-S403 PolarHBondContact O-OG 2.83Å; S403-G405 PolarHBondContact O-N 2.86Å; S403-Y406 WeakPolarHBondContact O-CB 3.31Å; S403-Y406 PolarHBondContact O-N 3.29Å
404	P	94.3	Very high	96.2	Very high	96 Å²	96	42.1 Å²	42.1	62%	0.623	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	133.7	174	-29.1	33.6	0	0	0	112.4	E395 Y406	E395-P404 WeakPolarHBondContact OE2-CD 3.4Å; P404-Y406 VanDerWaalsContact C-N 3.3Å; P404-Y406 PolarHBondContact O-N 3.26Å
405	G	93.9	Very high	95.8	Very high	7 Å²	7	43.7 Å²	43.7	7%	0.072	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-10.3	-176.3	0	0	0	0	0	115.2	S403 R424 C425	S403-G405 PolarHBondContact O-N 2.86Å; G405-R424 WeakPolarHBondContact O-CA 3.38Å; G405-C425 PolarHBondContact O-N 2.82Å
406	Y	96.8	Very high	95.4	Very high	68 Å²	68	46.1 Å²	46.1	27%	0.267	26%	0.256	S	S	.	.			trans	-104.8	42.7	178.4	-65.6	-98.4	0	0	0	113.4	N393 C402 S403 P404 K423 R424	N393-Y406 HydrophobicContact CB-CD1 3.35Å; N393-Y406 HydrophobicContact CB-CD2 4.03Å; N393-Y406 HydrophobicContact CB-CE1 3.72Å; N393-Y406 HydrophobicContact CB-CE2 4.34Å; N393-Y406 HydrophobicContact CB-CG 3.53Å; N393-Y406 WeakPolarHBondContact ND2-CD1 3.19Å; N393-Y406 WeakPolarHBondContact ND2-CE1 3.38Å; N393-Y406 WeakPolarHBondContact OD1-CE1 3.24Å; C402-Y406 WeakPolarHBondContact CB-O 3.24Å; S403-Y406 WeakPolarHBondContact O-CB 3.31Å; S403-Y406 PolarHBondContact O-N 3.29Å; P404-Y406 VanDerWaalsContact C-N 3.3Å; P404-Y406 PolarHBondContact O-N 3.26Å; Y406-K423 CarbonylContact C-O 3.57Å; Y406-K423 WeakPolarHBondContact CA-O 3.32Å; Y406-R424 HydrophobicContact CD1-CB 3.71Å; Y406-R424 HydrophobicContact CD1-CG 4.35Å; Y406-R424 VanDerWaalsContact CD1-N 3.34Å; Y406-R424 HydrophobicContact CE1-CB 3.66Å; Y406-R424 HydrophobicContact CE1-CG 4.16Å; Y406-R424 HydrophobicContact CG-CB 4.44Å
407	L	96.6	Very high	95	Very high	52 Å²	52	53.5 Å²	53.5	27%	0.272	29%	0.285	S	S	.	.			trans	-109.5	30.9	-171.8	-64.1	163.8	0	0	0	112.5	C402 R409 K423 C425 C434 F436	C402-L407 HydrophobicContact CB-CD2 3.93Å; L407-R409 VanDerWaalsContact C-N 3.35Å; L407-K423 PolarHBondContact N-O 2.8Å; L407-C425 VanDerWaalsContact C-SG 3.59Å; L407-C434 VanDerWaalsContact CD1-O 3.29Å; L407-C434 WeakPolarHBondContact CD1-O 3.45Å; L407-F436 HydrophobicContact CB-CB 4.26Å; L407-F436 WeakPolarHBondContact O-CB 3.39Å; L407-F436 WeakPolarHBondContact O-CD2 3.35Å
408	D	96.7	Very high	94.9	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.123	28%	0.283	C	S	.	.	S	Bend	trans	-77.4	-22.6	178.4	-163.8	45.5	0	0	0	113	K423 S448 G449 G450	D408-K423 HydrophobicContact CB-CB 4.1Å; D408-K423 WeakPolarHBondContact CB-O 3.35Å; D408-K423 PolarHBondContact N-O 3.49Å; D408-S448 WeakPolarHBondContact OD1-CB 3.39Å; D408-S448 PolarHBondContact OD1-OG 2.69Å; D408-S448 WeakPolarHBondContact OD2-CB 3.3Å; D408-S448 PolarHBondContact OD2-OG 2.72Å; D408-G449 PolarHBondContact O-N 3.16Å; D408-G450 WeakPolarHBondContact OD1-CA 2.99Å; D408-G450 PolarHBondContact OD1-N 2.87Å
409	R	95.6	Very high	94.7	Very high	60 Å²	60	53.5 Å²	53.5	23%	0.226	28%	0.283	C	S	.	.	S	Bend	trans	-139.5	159.3	174.6	73.6	177	-179.1	179.8	-1.8	110.1	L407 D421 K423 Y441	L407-R409 VanDerWaalsContact C-N 3.35Å; R409-D421 VanDerWaalsContact CZ-O 3.23Å; R409-D421 PolarHBondContact NE-O 2.82Å; R409-D421 PolarHBondContact NH2-O 3.42Å; R409-D421 IonicContact NH2-OD1 2.71Å; R409-D421 PolarHBondContact NH2-OD1 3.46Å; R409-K423 HydrophobicContact CG-CB 4.22Å; R409-K423 HydrophobicContact CG-CG 4.05Å; R409-Y441 HydrophobicContact CB-CD2 4.46Å; R409-Y441 HydrophobicContact CB-CE2 3.74Å
410	P	95.9	Very high	94.6	Very high	54 Å²	54	55.2 Å²	55.2	35%	0.351	29%	0.292	S	S	.	.			trans	-67.3	149.3	179.6	28.8	-32.9	0	0	0	111.1	F436 Y441	P410-F436 HydrophobicContact CB-CE1 4.43Å; P410-F436 HydrophobicContact CB-CZ 4.23Å; P410-F436 HydrophobicContact CG-CZ 4.23Å; P410-Y441 VanDerWaalsContact CD-CZ 3.44Å; P410-Y441 HydrophobicContact CG-CD1 4.4Å; P410-Y441 HydrophobicContact CG-CE1 3.84Å
411	W	97.2	Very high	94.6	Very high	73 Å²	73	53.1 Å²	53.1	28%	0.277	28%	0.284	S	S	.	.			trans	-62.5	143	172	177.3	92.7	0	0	0	110.9	N355 H357 C399 R413	N355-W411 HydrophobicContact CB-CH2 4.03Å; N355-W411 HydrophobicContact CB-CZ2 3.65Å; H357-W411 AromaticContact NE2-NE1 3.82Å; C399-W411 WeakPolarHBondContact O-CZ2 3.32Å; C399-W411 PolarHBondContact O-NE1 2.99Å; W411-R413 HydrophobicContact CH2-CB 4.35Å
412	A	94.9	Very high	94.6	Very high	40 Å²	40	46.8 Å²	46.8	33%	0.331	26%	0.26	S	S	.	.			trans	-150.4	148.7	170.8	0	0	0	0	0	110.1	H357 N420	H357-A412 PolarHBondContact CE1-O 3.04Å; H357-A412 VanDerWaalsContact CE1-O 3.24Å; H357-A412 PolarHBondContact NE2-O 2.84Å; A412-N420 HydrophobicContact CB-CB 4.01Å; A412-N420 VanDerWaalsContact O-CB 3.28Å; A412-N420 WeakPolarHBondContact O-CB 3.43Å
413	R	94.9	Very high	94.5	Very high	32 Å²	32	50.2 Å²	50.2	12%	0.121	27%	0.274	C	S	.	.			trans	-57.3	138.5	176.1	-172.4	-173.8	179.6	123.8	1.6	110.8	E149 I251 N355 W411 N420	E149-R413 IonicContact OE1-CZ 2.81Å; E149-R413 IonicContact OE1-NH1 3.96Å; E149-R413 PolarHBondContact OE1-NH1 3.49Å; E149-R413 IonicContact OE1-NH2 2.9Å; E149-R413 PolarHBondContact OE1-NH2 3.5Å; E149-R413 IonicContact OE2-CZ 3.17Å; E149-R413 IonicContact OE2-NH2 3.91Å; E149-R413 PolarHBondContact OE2-NH2 2.92Å; I251-R413 VanDerWaalsContact CD1-NH1 3.31Å; N355-R413 HydrophobicContact CB-CB 4.44Å; N355-R413 HydrophobicContact CB-CG 3.95Å; N355-R413 CarbonylContact O-C 3.52Å; N355-R413 WeakPolarHBondContact O-CA 3.43Å; N355-R413 WeakPolarHBondContact O-CG 3.28Å; W411-R413 HydrophobicContact CH2-CB 4.35Å; R413-N420 PolarHBondContact O-ND2 3.43Å
414	G	93.6	Very high	94.5	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.01	29%	0.288	C	S	.	.			trans	-59.8	139.9	169.5	0	0	0	0	0	112.1	N355 H357	N355-G414 PolarHBondContact O-N 2.73Å; H357-G414 PolarHBondContact NE2-N 2.03Å
415	T	91.2	Very high	94.6	Very high	40 Å²	40	51 Å²	51	25%	0.245	26%	0.262	C	S	.	.			trans	-130.5	166.3	176	69.4	0	0	0	0	110.4	E62 E417 S418	E62-T415 WeakPolarHBondContact CB-O 3.35Å; E62-T415 WeakPolarHBondContact OE2-CA 3.48Å; T415-E417 PolarHBondContact O-N 2.71Å; T415-E417 VanDerWaalsContact O-N 3.1Å; T415-E417 PolarHBondContact OG1-N 2.89Å; T415-S418 PolarHBondContact N-O 3.43Å; T415-S418 CarbonylContact O-C 3.55Å; T415-S418 PolarHBondContact O-N 3.29Å; T415-S418 VanDerWaalsContact O-N 3.12Å; T415-S418 VanDerWaalsContact O-O 3.1Å; T415-S418 PolarHBondContact OG1-N 3.37Å; T415-S418 PolarHBondContact OG1-O 3.2Å
416	S	87.2	Confident	94.7	Very high	105 Å²	105	54 Å²	54	73%	0.734	28%	0.276	S	S	*	.	S	Bend	trans	-57.1	-25.6	174.6	54.8	0	0	0	0	113.5	E62	E62-S416 PolarHBondContact OE2-N 3.03Å
417	E	88.2	Confident	94.8	Very high	176 Å²	176	51.1 Å²	51.1	82%	0.822	27%	0.266	S	S	*	.	S	Bend	trans	-87.9	-32.4	179.1	-63.8	173.3	-175.9	0	0	112.7	T415	T415-E417 PolarHBondContact O-N 2.71Å; T415-E417 VanDerWaalsContact O-N 3.1Å; T415-E417 PolarHBondContact OG1-N 2.89Å
418	S	92	Very high	94.8	Very high	44 Å²	44	50 Å²	50	31%	0.308	26%	0.26	S	S	.	.			trans	-153.5	127.9	-175.4	173.3	0	0	0	0	111.2	T415 N420	T415-S418 PolarHBondContact N-O 3.43Å; T415-S418 CarbonylContact O-C 3.55Å; T415-S418 PolarHBondContact O-N 3.29Å; T415-S418 VanDerWaalsContact O-N 3.12Å; T415-S418 VanDerWaalsContact O-O 3.1Å; T415-S418 PolarHBondContact OG1-N 3.37Å; T415-S418 PolarHBondContact OG1-O 3.2Å; S418-N420 WeakPolarHBondContact CB-OD1 3.43Å; S418-N420 PolarHBondContact O-N 2.99Å; S418-N420 PolarHBondContact O-ND2 3.25Å; S418-N420 PolarHBondContact OG-N 3.4Å; S418-N420 VanDerWaalsContact OG-N 3.16Å; S418-N420 PolarHBondContact OG-OD1 2.99Å
419	A	94.5	Very high	94.8	Very high	6 Å²	6	54.1 Å²	54.1	5%	0.05	28%	0.281	C	S	.	.			trans	-61.5	-16.6	172.3	0	0	0	0	0	113.8	A60 H357 D421	A60-A419 VanDerWaalsContact C-CB 3.43Å; A60-A419 HydrophobicContact CB-CB 3.66Å; A60-A419 WeakPolarHBondContact O-CB 3.36Å; H357-A419 PolarHBondContact CE1-O 3.16Å; H357-A419 PolarHBondContact ND1-O 2.97Å; A419-D421 PolarHBondContact O-N 2.9Å
420	N	95.5	Very high	94.9	Very high	37 Å²	37	51.3 Å²	51.3	20%	0.198	27%	0.271	C	S	.	.			trans	51.5	41.6	179.7	-67	-36.9	0	0	0	113.1	A412 R413 S418	A412-N420 HydrophobicContact CB-CB 4.01Å; A412-N420 VanDerWaalsContact O-CB 3.28Å; A412-N420 WeakPolarHBondContact O-CB 3.43Å; R413-N420 PolarHBondContact O-ND2 3.43Å; S418-N420 WeakPolarHBondContact CB-OD1 3.43Å; S418-N420 PolarHBondContact O-N 2.99Å; S418-N420 PolarHBondContact O-ND2 3.25Å; S418-N420 PolarHBondContact OG-N 3.4Å; S418-N420 VanDerWaalsContact OG-N 3.16Å; S418-N420 PolarHBondContact OG-OD1 2.99Å
421	D	95.9	Very high	94.9	Very high	30 Å²	30	49.2 Å²	49.2	16%	0.16	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-63	140.3	-179.1	68.7	-55	0	0	0	112.9	A60 H392 R409 A419 K423	A60-D421 HydrophobicContact CB-CB 4.29Å; H392-D421 HydrophobicContact CB-CB 3.86Å; R409-D421 VanDerWaalsContact CZ-O 3.23Å; R409-D421 PolarHBondContact NE-O 2.82Å; R409-D421 PolarHBondContact NH2-O 3.42Å; R409-D421 IonicContact NH2-OD1 2.71Å; R409-D421 PolarHBondContact NH2-OD1 3.46Å; A419-D421 PolarHBondContact O-N 2.9Å; D421-K423 VanDerWaalsContact CG-NZ 3.27Å; D421-K423 PolarHBondContact O-N 3.29Å; D421-K423 WeakPolarHBondContact OD1-CE 3.34Å; D421-K423 IonicContact OD1-NZ 2.93Å; D421-K423 PolarHBondContact OD1-NZ 2.88Å; D421-K423 WeakPolarHBondContact OD2-CE 3.46Å; D421-K423 IonicContact OD2-NZ 2.69Å; D421-K423 PolarHBondContact OD2-NZ 3.41Å
422	C	97.6	Very high	94.6	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.014	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-69.1	133.7	176.7	-70.2	0	0	0	0	110	H392 N393 C402	H392-C422 PolarHBondContact O-N 2.64Å; N393-C422 HydrophobicContact CB-CB 4.02Å; N393-C422 PolarHBondContact ND2-O 2.8Å; N393-C422 VanDerWaalsContact O-CB 3.27Å; N393-C422 WeakPolarHBondContact O-CB 3.25Å; C402-C422 WeakPolarHBondContact CA-SG 3.06Å; C402-C422 HydrophobicContact CB-CB 3.54Å; C402-C422 WeakPolarHBondContact CB-SG 3.09Å; C402-C422 WeakPolarHBondContact SG-CB 3.41Å; C402-C422 CovalentContact SG-SG 2.03Å; C402-C422 PolarHBondContact SG-SG 3.03Å
423	K	96	Very high	94.6	Very high	83 Å²	83	52.2 Å²	52.2	36%	0.361	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-101.2	131.3	-172.8	-66	-63.2	-175.4	-163.7	0	111.2	Y406 L407 D408 R409 D421	Y406-K423 CarbonylContact C-O 3.57Å; Y406-K423 WeakPolarHBondContact CA-O 3.32Å; L407-K423 PolarHBondContact N-O 2.8Å; D408-K423 HydrophobicContact CB-CB 4.1Å; D408-K423 WeakPolarHBondContact CB-O 3.35Å; D408-K423 PolarHBondContact N-O 3.49Å; R409-K423 HydrophobicContact CG-CB 4.22Å; R409-K423 HydrophobicContact CG-CG 4.05Å; D421-K423 VanDerWaalsContact CG-NZ 3.27Å; D421-K423 PolarHBondContact O-N 3.29Å; D421-K423 WeakPolarHBondContact OD1-CE 3.34Å; D421-K423 IonicContact OD1-NZ 2.93Å; D421-K423 PolarHBondContact OD1-NZ 2.88Å; D421-K423 WeakPolarHBondContact OD2-CE 3.46Å; D421-K423 IonicContact OD2-NZ 2.69Å; D421-K423 PolarHBondContact OD2-NZ 3.41Å
424	R	96.1	Very high	94.6	Very high	128 Å²	128	50.9 Å²	50.9	48%	0.483	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-61.1	135.3	177.2	-163	176.4	-178.6	-165	-0.1	110.3	G405 Y406	G405-R424 WeakPolarHBondContact O-CA 3.38Å; Y406-R424 HydrophobicContact CD1-CB 3.71Å; Y406-R424 HydrophobicContact CD1-CG 4.35Å; Y406-R424 VanDerWaalsContact CD1-N 3.34Å; Y406-R424 HydrophobicContact CE1-CB 3.66Å; Y406-R424 HydrophobicContact CE1-CG 4.16Å; Y406-R424 HydrophobicContact CG-CB 4.44Å
425	C	96.5	Very high	94.8	Very high	11 Å²	11	53.6 Å²	53.6	7%	0.074	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-64.4	136.3	171.5	-68	0	0	0	0	111.1	G405 L407 C427 C434	G405-C425 PolarHBondContact O-N 2.82Å; L407-C425 VanDerWaalsContact C-SG 3.59Å; C425-C427 PolarHBondContact O-N 2.79Å; C425-C434 HydrophobicContact CB-CB 3.45Å; C425-C434 VanDerWaalsContact CB-CB 3.45Å; C425-C434 WeakPolarHBondContact CB-SG 3.49Å; C425-C434 WeakPolarHBondContact SG-CB 3.35Å; C425-C434 CovalentContact SG-SG 2.02Å; C425-C434 PolarHBondContact SG-SG 3Å
426	D	96.6	Very high	95.1	Very high	69 Å²	69	54.8 Å²	54.8	37%	0.369	29%	0.291	S	S	.	.			trans	-85.1	97.8	174.1	175.1	19.3	0	0	0	110.6	N428 C452 K463	D426-N428 PolarHBondContact OD1-N 3.46Å; D426-C452 PolarHBondContact O-SG 3.19Å; D426-K463 HydrophobicContact CB-CD 4.41Å; D426-K463 VanDerWaalsContact O-CB 3.31Å; D426-K463 WeakPolarHBondContact O-CB 3.46Å; D426-K463 VanDerWaalsContact O-CG 3.29Å; D426-K463 WeakPolarHBondContact O-CG 3.44Å; D426-K463 WeakPolarHBondContact OD2-CD 3.38Å; D426-K463 WeakPolarHBondContact OD2-CE 3.38Å; D426-K463 IonicContact OD2-NZ 3.74Å; D426-K463 PolarHBondContact OD2-NZ 2.95Å
427	C	97.6	Very high	95.5	Very high	7 Å²	7	51.3 Å²	51.3	5%	0.047	27%	0.266	C	S	.	.			trans	-112.8	17.2	179.7	-58.5	0	0	0	0	113.6	C425 L429 H430 C452 K463	C425-C427 PolarHBondContact O-N 2.79Å; C427-L429 PolarHBondContact O-N 2.92Å; C427-L429 VanDerWaalsContact O-N 3.09Å; C427-H430 PolarHBondContact O-N 3.05Å; C427-C452 WeakPolarHBondContact CA-SG 3.43Å; C427-C452 HydrophobicContact CB-CB 3.85Å; C427-C452 WeakPolarHBondContact CB-SG 3.39Å; C427-C452 WeakPolarHBondContact SG-CB 3.38Å; C427-C452 CovalentContact SG-SG 2.02Å; C427-C452 PolarHBondContact SG-SG 2.87Å; C427-K463 CarbonylContact C-O 3.59Å; C427-K463 VanDerWaalsContact C-O 3.29Å
428	N	96.8	Very high	95.9	Very high	30 Å²	30	47.1 Å²	47.1	16%	0.16	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	34.9	-175.6	-62.9	-70.5	0	0	0	113.7	D426 H430 K463 V479 S480	D426-N428 PolarHBondContact OD1-N 3.46Å; N428-H430 PolarHBondContact O-CE1 2.87Å; N428-H430 PolarHBondContact O-N 2.79Å; N428-H430 VanDerWaalsContact O-N 3.15Å; N428-H430 PolarHBondContact O-ND1 3.16Å; N428-K463 PolarHBondContact ND2-O 3.17Å; N428-V479 HydrophobicContact CB-CG1 4.35Å; N428-V479 HydrophobicContact CB-CG2 4.4Å; N428-V479 VanDerWaalsContact OD1-CG1 3.23Å; N428-V479 WeakPolarHBondContact OD1-CG1 3.41Å; N428-S480 VanDerWaalsContact O-CA 3.22Å; N428-S480 WeakPolarHBondContact O-CA 3.42Å
429	L	96.2	Very high	96.1	Very high	108 Å²	108	51.2 Å²	51.2	57%	0.565	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	24.1	-175.7	-54	178.3	0	0	0	114.7	C427	C427-L429 PolarHBondContact O-N 2.92Å; C427-L429 VanDerWaalsContact O-N 3.09Å
430	H	97.5	Very high	96.1	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.275	C	S	.	.	S	Bend	trans	-110.2	5.5	177	-58.4	-24	0	0	0	112.6	C427 N428 C455 Q456 H457 T459 C464 V479 S480 H481	C427-H430 PolarHBondContact O-N 3.05Å; N428-H430 PolarHBondContact O-CE1 2.87Å; N428-H430 PolarHBondContact O-N 2.79Å; N428-H430 VanDerWaalsContact O-N 3.15Å; N428-H430 PolarHBondContact O-ND1 3.16Å; H430-C455 CarbonylContact O-C 3.45Å; H430-C455 WeakPolarHBondContact O-CA 3.07Å; H430-Q456 PolarHBondContact O-N 3.46Å; H430-H457 AromaticContact CE1-ND1 3.58Å; H430-H457 AromaticContact CG-ND1 3.81Å; H430-H457 AromaticContact ND1-CE1 3.97Å; H430-H457 AromaticContact ND1-CG 3.84Å; H430-H457 AromaticContact ND1-ND1 2.96Å; H430-H457 PolarHBondContact ND1-ND1 3.28Å; H430-T459 WeakPolarHBondContact CB-OG1 3.19Å; H430-T459 WeakPolarHBondContact CD2-CG2 3.48Å; H430-C464 HydrophobicContact CB-CB 3.65Å; H430-C464 PolarHBondContact CD2-O 2.86Å; H430-V479 PolarHBondContact NE2-O 3.22Å; H430-S480 VanDerWaalsContact CE1-C 3.41Å; H430-S480 PolarHBondContact CE1-O 3.3Å; H430-H481 PolarHBondContact CE1-O 3.07Å
431	S	96.2	Very high	96.2	Very high	11 Å²	11	53.3 Å²	53.3	8%	0.077	27%	0.272	C	S	.	.			trans	-157	146.6	167.6	179.6	0	0	0	0	110.6	S433 Q453	S431-S433 PolarHBondContact OG-N 2.95Å; S431-S433 PolarHBondContact OG-O 2.79Å; S431-Q453 WeakPolarHBondContact CB-O 3.38Å; S431-Q453 PolarHBondContact OG-O 2.75Å
432	N	92.3	Very high	96.2	Very high	126 Å²	126	56 Å²	56	67%	0.674	29%	0.286	S	S	*	.	S	Bend	trans	-102.3	-1.6	170.6	-69.3	-31.2	0	0	0	112.8
433	S	94.1	Very high	96.1	Very high	49 Å²	49	62.2 Å²	62.2	34%	0.343	32%	0.316	S	S	.	.			trans	-120.7	141.1	-178.9	-175.4	0	0	0	0	111	S431 Q453	S431-S433 PolarHBondContact OG-N 2.95Å; S431-S433 PolarHBondContact OG-O 2.79Å; S433-Q453 PolarHBondContact O-N 2.74Å; S433-Q453 PolarHBondContact OG-OE1 3.18Å
434	C	96.1	Very high	96	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.027	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	163.4	175.4	64.9	0	0	0	0	111.2	L407 C425 V451	L407-C434 VanDerWaalsContact CD1-O 3.29Å; L407-C434 WeakPolarHBondContact CD1-O 3.45Å; C425-C434 HydrophobicContact CB-CB 3.45Å; C425-C434 VanDerWaalsContact CB-CB 3.45Å; C425-C434 WeakPolarHBondContact CB-SG 3.49Å; C425-C434 WeakPolarHBondContact SG-CB 3.35Å; C425-C434 CovalentContact SG-SG 2.02Å; C425-C434 PolarHBondContact SG-SG 3Å; C434-V451 CarbonylContact C-O 3.57Å; C434-V451 WeakPolarHBondContact CA-O 3.15Å; C434-V451 WeakPolarHBondContact CB-O 2.97Å
435	V	96.6	Very high	96	Very high	59 Å²	59	61.8 Å²	61.8	36%	0.358	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149.6	171.7	-70.9	0	0	0	0	110.4	V451 Q453	V435-V451 HydrophobicContact CG2-CB 4.1Å; V435-V451 PolarHBondContact N-O 2.89Å; V435-V451 PolarHBondContact O-N 3.45Å; V435-Q453 HydrophobicContact CG1-CG 4.34Å; V435-Q453 HydrophobicContact CG2-CG 4.34Å
436	F	96.7	Very high	95.8	Very high	65 Å²	65	66.3 Å²	66.3	29%	0.285	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	132.8	174.9	179.2	-107.2	0	0	0	111.1	L407 P410 N438 Y441	L407-F436 HydrophobicContact CB-CB 4.26Å; L407-F436 WeakPolarHBondContact O-CB 3.39Å; L407-F436 WeakPolarHBondContact O-CD2 3.35Å; P410-F436 HydrophobicContact CB-CE1 4.43Å; P410-F436 HydrophobicContact CB-CZ 4.23Å; P410-F436 HydrophobicContact CG-CZ 4.23Å; F436-N438 HydrophobicContact CE1-CB 3.89Å; F436-Y441 HydrophobicContact CE2-CD1 4.39Å; F436-Y441 AromaticContact CE2-CD2 3.93Å; F436-Y441 HydrophobicContact CE2-CD2 3.93Å; F436-Y441 AromaticContact CE2-CG 3.74Å; F436-Y441 HydrophobicContact CE2-CG 3.74Å; F436-Y441 AromaticContact CZ-CD1 3.91Å; F436-Y441 HydrophobicContact CZ-CD1 3.91Å; F436-Y441 HydrophobicContact CZ-CD2 4.28Å; F436-Y441 AromaticContact CZ-CG 3.66Å; F436-Y441 HydrophobicContact CZ-CG 3.66Å
437	S	97.1	Very high	95.7	Very high	31 Å²	31	67.9 Å²	67.9	22%	0.217	36%	0.357	C	S	.	.			trans	-113.8	107.4	170.7	176.8	0	0	0	0	110.3	Q439 L440 Y441 G449	S437-Q439 PolarHBondContact O-N 2.73Å; S437-L440 PolarHBondContact O-N 2.85Å; S437-L440 VanDerWaalsContact O-N 3.16Å; S437-L440 PolarHBondContact OG-N 2.88Å; S437-Y441 PolarHBondContact O-N 3.36Å; S437-G449 WeakPolarHBondContact CB-O 3.15Å; S437-G449 PolarHBondContact N-O 3.08Å
438	N	95.9	Very high	95.6	Very high	89 Å²	89	68.1 Å²	68.1	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-58.6	-35.3	177.4	-171.5	56	0	0	0	112.2	F436 Y441 L442	F436-N438 HydrophobicContact CE1-CB 3.89Å; N438-Y441 PolarHBondContact O-N 3.3Å; N438-L442 WeakPolarHBondContact O-CG 3.39Å; N438-L442 PolarHBondContact O-N 2.94Å
439	Q	95.8	Very high	95.6	Very high	129 Å²	129	66.7 Å²	66.7	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-63	-45.8	177.7	-176.2	177.3	5.7	0	0	111.7	S437 Y441 L442 M443	S437-Q439 PolarHBondContact O-N 2.73Å; Q439-Y441 VanDerWaalsContact C-N 3.34Å; Q439-L442 PolarHBondContact O-N 2.02Å; Q439-M443 HydrophobicContact CG-CE 3.89Å; Q439-M443 HydrophobicContact CG-SD 4.02Å; Q439-M443 WeakPolarHBondContact O-CB 3.05Å; Q439-M443 VanDerWaalsContact O-CG 3.25Å; Q439-M443 WeakPolarHBondContact O-CG 3.5Å; Q439-M443 PolarHBondContact O-N 3.37Å
440	L	95.8	Very high	95.6	Very high	54 Å²	54	61.7 Å²	61.7	28%	0.283	33%	0.326	S	S	.	.	H	α-helix	trans	-69.6	-35.2	179	-67.8	177.5	0	0	0	112	S437 M443 S444 S448 V451 R462	S437-L440 PolarHBondContact O-N 2.85Å; S437-L440 VanDerWaalsContact O-N 3.16Å; S437-L440 PolarHBondContact OG-N 2.88Å; L440-M443 PolarHBondContact O-N 3.07Å; L440-S444 WeakPolarHBondContact O-CB 3.29Å; L440-S444 PolarHBondContact O-N 2.81Å; L440-S444 PolarHBondContact O-OG 2.81Å; L440-S448 CarbonylContact C-O 3.32Å; L440-V451 HydrophobicContact CD1-CG2 3.53Å; L440-R462 VanDerWaalsContact CD1-CD 3.45Å
441	Y	97	Very high	95.6	Very high	33 Å²	33	63.4 Å²	63.4	13%	0.129	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-46.2	174.2	-173.1	-113.1	0	0	0	111.9	R409 P410 F436 S437 N438 Q439 S444 K446 S448	R409-Y441 HydrophobicContact CB-CD2 4.46Å; R409-Y441 HydrophobicContact CB-CE2 3.74Å; P410-Y441 VanDerWaalsContact CD-CZ 3.44Å; P410-Y441 HydrophobicContact CG-CD1 4.4Å; P410-Y441 HydrophobicContact CG-CE1 3.84Å; F436-Y441 HydrophobicContact CE2-CD1 4.39Å; F436-Y441 AromaticContact CE2-CD2 3.93Å; F436-Y441 HydrophobicContact CE2-CD2 3.93Å; F436-Y441 AromaticContact CE2-CG 3.74Å; F436-Y441 HydrophobicContact CE2-CG 3.74Å; F436-Y441 AromaticContact CZ-CD1 3.91Å; F436-Y441 HydrophobicContact CZ-CD1 3.91Å; F436-Y441 HydrophobicContact CZ-CD2 4.28Å; F436-Y441 AromaticContact CZ-CG 3.66Å; F436-Y441 HydrophobicContact CZ-CG 3.66Å; S437-Y441 PolarHBondContact O-N 3.36Å; N438-Y441 PolarHBondContact O-N 3.3Å; Q439-Y441 VanDerWaalsContact C-N 3.34Å; Y441-S444 PolarHBondContact O-N 2.62Å; Y441-S444 PolarHBondContact O-OG 3.46Å; Y441-K446 HydrophobicContact CD1-CB 4.42Å; Y441-K446 HydrophobicContact CD1-CG 4.39Å; Y441-K446 HydrophobicContact CE1-CB 3.72Å; Y441-K446 HydrophobicContact CE1-CG 3.88Å; Y441-K446 HydrophobicContact CE2-CB 4.27Å; Y441-K446 WeakPolarHBondContact CE2-O 3.33Å; Y441-K446 VanDerWaalsContact CZ-C 3.49Å; Y441-K446 VanDerWaalsContact CZ-CA 3.49Å; Y441-K446 VanDerWaalsContact O-CA 3.24Å; Y441-K446 WeakPolarHBondContact O-CA 3.48Å; Y441-K446 PolarHBondContact O-N 3.3Å; Y441-K446 PolarHBondContact OH-O 3Å; Y441-S448 WeakPolarHBondContact CA-O 3.4Å
442	L	96	Very high	95.7	Very high	86 Å²	86	63.5 Å²	63.5	45%	0.45	34%	0.337	S	S	.	.	H	α-helix	trans	-67	-41	176.1	-66.7	175.3	0	0	0	111.9	N438 Q439 S444 M445	N438-L442 WeakPolarHBondContact O-CG 3.39Å; N438-L442 PolarHBondContact O-N 2.94Å; Q439-L442 PolarHBondContact O-N 2.02Å; L442-S444 VanDerWaalsContact C-N 3.26Å; L442-S444 PolarHBondContact O-N 2.99Å; L442-M445 PolarHBondContact O-N 2.99Å; L442-M445 VanDerWaalsContact O-N 3.16Å
443	M	95.7	Very high	95.9	Very high	133 Å²	133	61.2 Å²	61.2	66%	0.655	32%	0.322	S	S	*	.	H	α-helix	trans	-65.9	-26.4	176.9	-74	177.1	170.2	0	0	113.4	Q439 L440 M445	Q439-M443 HydrophobicContact CG-CE 3.89Å; Q439-M443 HydrophobicContact CG-SD 4.02Å; Q439-M443 WeakPolarHBondContact O-CB 3.05Å; Q439-M443 VanDerWaalsContact O-CG 3.25Å; Q439-M443 WeakPolarHBondContact O-CG 3.5Å; Q439-M443 PolarHBondContact O-N 3.37Å; L440-M443 PolarHBondContact O-N 3.07Å; M443-M445 VanDerWaalsContact C-N 3.26Å; M443-M445 PolarHBondContact O-N 3.31Å
444	S	94.6	Very high	96	Very high	35 Å²	35	65.2 Å²	65.2	25%	0.245	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	19.4	174.9	67.3	0	0	0	0	113.1	L440 Y441 L442 K446 V447 S448	L440-S444 WeakPolarHBondContact O-CB 3.29Å; L440-S444 PolarHBondContact O-N 2.81Å; L440-S444 PolarHBondContact O-OG 2.81Å; Y441-S444 PolarHBondContact O-N 2.62Å; Y441-S444 PolarHBondContact O-OG 3.46Å; L442-S444 VanDerWaalsContact C-N 3.26Å; L442-S444 PolarHBondContact O-N 2.99Å; S444-K446 VanDerWaalsContact C-N 3.3Å; S444-K446 PolarHBondContact O-N 2.72Å; S444-V447 VanDerWaalsContact O-CB 3.26Å; S444-V447 WeakPolarHBondContact O-CB 3.28Å; S444-V447 WeakPolarHBondContact O-CG2 3.45Å; S444-V447 PolarHBondContact O-N 2.87Å; S444-V447 PolarHBondContact OG-N 2.86Å; S444-S448 PolarHBondContact OG-N 3.45Å; S444-S448 PolarHBondContact OG-O 2.84Å
445	M	95	Very high	96	Very high	167 Å²	167	66.8 Å²	66.8	82%	0.823	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	41.7	-177.4	-57	178.4	-70.9	0	0	112.8	L442 M443 V447	L442-M445 PolarHBondContact O-N 2.99Å; L442-M445 VanDerWaalsContact O-N 3.16Å; M443-M445 VanDerWaalsContact C-N 3.26Å; M443-M445 PolarHBondContact O-N 3.31Å; M445-V447 VanDerWaalsContact C-N 3.31Å; M445-V447 PolarHBondContact O-N 3.17Å
446	K	93.1	Very high	96	Very high	107 Å²	107	69.4 Å²	69.4	47%	0.465	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	29.8	-179	-57.4	-178.7	178.5	-178.5	0	114.1	Y441 S444	Y441-K446 HydrophobicContact CD1-CB 4.42Å; Y441-K446 HydrophobicContact CD1-CG 4.39Å; Y441-K446 HydrophobicContact CE1-CB 3.72Å; Y441-K446 HydrophobicContact CE1-CG 3.88Å; Y441-K446 HydrophobicContact CE2-CB 4.27Å; Y441-K446 WeakPolarHBondContact CE2-O 3.33Å; Y441-K446 VanDerWaalsContact CZ-C 3.49Å; Y441-K446 VanDerWaalsContact CZ-CA 3.49Å; Y441-K446 VanDerWaalsContact O-CA 3.24Å; Y441-K446 WeakPolarHBondContact O-CA 3.48Å; Y441-K446 PolarHBondContact O-N 3.3Å; Y441-K446 PolarHBondContact OH-O 3Å; S444-K446 VanDerWaalsContact C-N 3.3Å; S444-K446 PolarHBondContact O-N 2.72Å
447	V	93.9	Very high	96.1	Very high	101 Å²	101	68.5 Å²	68.5	61%	0.612	36%	0.355	S	S	*	.	S	Bend	trans	-95	-56.7	178.7	178.3	0	0	0	0	112.2	S444 M445	S444-V447 VanDerWaalsContact O-CB 3.26Å; S444-V447 WeakPolarHBondContact O-CB 3.28Å; S444-V447 WeakPolarHBondContact O-CG2 3.45Å; S444-V447 PolarHBondContact O-N 2.87Å; S444-V447 PolarHBondContact OG-N 2.86Å; M445-V447 VanDerWaalsContact C-N 3.31Å; M445-V447 PolarHBondContact O-N 3.17Å
448	S	96	Very high	96.1	Very high	13 Å²	13	70.1 Å²	70.1	9%	0.091	36%	0.362	C	S	.	.			trans	-144.8	129.3	-173.7	166.3	0	0	0	0	112.1	D408 L440 Y441 S444 R462	D408-S448 WeakPolarHBondContact OD1-CB 3.39Å; D408-S448 PolarHBondContact OD1-OG 2.69Å; D408-S448 WeakPolarHBondContact OD2-CB 3.3Å; D408-S448 PolarHBondContact OD2-OG 2.72Å; L440-S448 CarbonylContact C-O 3.32Å; Y441-S448 WeakPolarHBondContact CA-O 3.4Å; S444-S448 PolarHBondContact OG-N 3.45Å; S444-S448 PolarHBondContact OG-O 2.84Å; S448-R462 PolarHBondContact OG-NH1 3.09Å
449	G	96.2	Very high	96.2	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.341	C	S	.	.			trans	-123.3	-1.4	177.4	0	0	0	0	0	113.7	D408 S437	D408-G449 PolarHBondContact O-N 3.16Å; S437-G449 WeakPolarHBondContact CB-O 3.15Å; S437-G449 PolarHBondContact N-O 3.08Å
450	G	96.5	Very high	96.2	Very high	3 Å²	3	62.7 Å²	62.7	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	137.1	-177.4	0	0	0	0	0	113.2	D408 R462	D408-G450 WeakPolarHBondContact OD1-CA 2.99Å; D408-G450 PolarHBondContact OD1-N 2.87Å; G450-R462 PolarHBondContact O-NH1 3.07Å
451	V	97.4	Very high	96.2	Very high	37 Å²	37	61.7 Å²	61.7	22%	0.224	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.7	173.6	-176.9	0	0	0	0	108.6	C434 V435 L440 R462	C434-V451 CarbonylContact C-O 3.57Å; C434-V451 WeakPolarHBondContact CA-O 3.15Å; C434-V451 WeakPolarHBondContact CB-O 2.97Å; V435-V451 HydrophobicContact CG2-CB 4.1Å; V435-V451 PolarHBondContact N-O 2.89Å; V435-V451 PolarHBondContact O-N 3.45Å; L440-V451 HydrophobicContact CD1-CG2 3.53Å; V451-R462 HydrophobicContact CB-CG 4.27Å; V451-R462 HydrophobicContact CG1-CG 4.17Å; V451-R462 HydrophobicContact CG2-CG 4.05Å
452	C	97.9	Very high	96.2	Very high	13 Å²	13	64.3 Å²	64.3	9%	0.088	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	143.6	-179.5	-53.9	0	0	0	0	111.3	D426 C427 R462 C464	D426-C452 PolarHBondContact O-SG 3.19Å; C427-C452 WeakPolarHBondContact CA-SG 3.43Å; C427-C452 HydrophobicContact CB-CB 3.85Å; C427-C452 WeakPolarHBondContact CB-SG 3.39Å; C427-C452 WeakPolarHBondContact SG-CB 3.38Å; C427-C452 CovalentContact SG-SG 2.02Å; C427-C452 PolarHBondContact SG-SG 2.87Å; C452-R462 VanDerWaalsContact CB-O 3.3Å; C452-R462 WeakPolarHBondContact CB-O 3.42Å; C452-R462 PolarHBondContact N-O 2.05Å; C452-R462 PolarHBondContact SG-O 3.02Å; C452-C464 VanDerWaalsContact CB-SG 3.54Å
453	Q	96.7	Very high	96.2	Very high	77 Å²	77	62.9 Å²	62.9	36%	0.36	33%	0.33	S	S	.	.			trans	-109.4	154.4	173.7	-64.6	-168.6	-36.9	0	0	110	S431 S433 V435 C455	S431-Q453 WeakPolarHBondContact CB-O 3.38Å; S431-Q453 PolarHBondContact OG-O 2.75Å; S433-Q453 PolarHBondContact O-N 2.74Å; S433-Q453 PolarHBondContact OG-OE1 3.18Å; V435-Q453 HydrophobicContact CG1-CG 4.34Å; V435-Q453 HydrophobicContact CG2-CG 4.34Å; Q453-C455 PolarHBondContact O-N 2.99Å
454	D	95.6	Very high	96.3	Very high	133 Å²	133	56.5 Å²	56.5	71%	0.711	30%	0.299	S	S	*	.	S	Bend	trans	48.3	51.5	172.2	-51.6	-35.7	0	0	0	114.2	Q456	D454-Q456 WeakPolarHBondContact O-CG 3.33Å; D454-Q456 PolarHBondContact O-N 3.47Å; D454-Q456 VanDerWaalsContact O-N 3.14Å
455	C	97.5	Very high	96.3	Very high	38 Å²	38	59 Å²	59	26%	0.257	31%	0.306	S	S	.	.			trans	-54.8	119.4	177.5	-67.6	0	0	0	0	110.8	H430 Q453 T459 C464	H430-C455 CarbonylContact O-C 3.45Å; H430-C455 WeakPolarHBondContact O-CA 3.07Å; Q453-C455 PolarHBondContact O-N 2.99Å; C455-T459 WeakPolarHBondContact CB-O 3.39Å; C455-C464 VanDerWaalsContact CA-SG 3.58Å; C455-C464 HydrophobicContact CB-CB 3.76Å; C455-C464 WeakPolarHBondContact CB-SG 3.31Å; C455-C464 WeakPolarHBondContact SG-CA 3.38Å; C455-C464 WeakPolarHBondContact SG-CB 3.42Å; C455-C464 CovalentContact SG-SG 2.05Å; C455-C464 PolarHBondContact SG-SG 3.5Å
456	Q	96.9	Very high	96.4	Very high	114 Å²	114	54.4 Å²	54.4	53%	0.533	29%	0.286	S	S	.	.			trans	-87.3	-175.1	177.9	-57	-174	8.9	0	0	110.5	H430 D454 N458 T459	H430-Q456 PolarHBondContact O-N 3.46Å; D454-Q456 WeakPolarHBondContact O-CG 3.33Å; D454-Q456 PolarHBondContact O-N 3.47Å; D454-Q456 VanDerWaalsContact O-N 3.14Å; Q456-N458 PolarHBondContact O-N 3.35Å; Q456-N458 VanDerWaalsContact O-N 3.15Å; Q456-T459 WeakPolarHBondContact O-CB 3.24Å; Q456-T459 PolarHBondContact O-N 2.96Å; Q456-T459 PolarHBondContact O-OG1 3.11Å
457	H	97.6	Very high	96.6	Very high	45 Å²	45	49.6 Å²	49.6	21%	0.208	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	31.9	172.9	-53.2	147.9	0	0	0	114.3	H430 T459 D482	H430-H457 AromaticContact CE1-ND1 3.58Å; H430-H457 AromaticContact CG-ND1 3.81Å; H430-H457 AromaticContact ND1-CE1 3.97Å; H430-H457 AromaticContact ND1-CG 3.84Å; H430-H457 AromaticContact ND1-ND1 2.96Å; H430-H457 PolarHBondContact ND1-ND1 3.28Å; H457-T459 HydrophobicContact CB-CG2 4.27Å; H457-T459 WeakPolarHBondContact O-CG2 3.25Å; H457-T459 PolarHBondContact O-N 3.47Å; H457-T459 VanDerWaalsContact O-N 3.16Å; H457-D482 VanDerWaalsContact CB-O 3.26Å; H457-D482 WeakPolarHBondContact CB-O 3.45Å; H457-D482 IonicContact CE1-OD1 2.64Å; H457-D482 PolarHBondContact CE1-OD1 2.02Å; H457-D482 IonicContact CE1-OD2 3.85Å; H457-D482 IonicContact ND1-OD1 3.76Å; H457-D482 PolarHBondContact ND1-OD1 3.17Å; H457-D482 IonicContact NE2-OD1 2.9Å; H457-D482 IonicContact NE2-OD2 3.87Å
458	N	97	Very high	96.7	Very high	66 Å²	66	46.7 Å²	46.7	35%	0.353	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	31.3	-177.1	-59.9	-53.8	0	0	0	113.1	Q456 C467 V468 Y471 C485	Q456-N458 PolarHBondContact O-N 3.35Å; Q456-N458 VanDerWaalsContact O-N 3.15Å; N458-C467 WeakPolarHBondContact O-CA 2.97Å; N458-V468 HydrophobicContact CB-CG2 3.92Å; N458-V468 WeakPolarHBondContact O-CG2 3.36Å; N458-V468 PolarHBondContact O-N 3.48Å; N458-Y471 HydrophobicContact CB-CD1 3.71Å; N458-Y471 HydrophobicContact CB-CD2 4.18Å; N458-Y471 HydrophobicContact CB-CE1 3.79Å; N458-Y471 HydrophobicContact CB-CE2 4.25Å; N458-Y471 HydrophobicContact CB-CG 3.93Å; N458-Y471 VanDerWaalsContact CG-CE1 3.44Å; N458-Y471 VanDerWaalsContact CG-CZ 3.43Å; N458-Y471 WeakPolarHBondContact ND2-CE1 3.48Å; N458-C485 HydrophobicContact CB-CB 4.05Å
459	T	97.7	Very high	96.6	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	161	178.7	68.2	0	0	0	0	112.2	H430 C455 Q456 H457 C464 N466 V468 V484	H430-T459 WeakPolarHBondContact CB-OG1 3.19Å; H430-T459 WeakPolarHBondContact CD2-CG2 3.48Å; C455-T459 WeakPolarHBondContact CB-O 3.39Å; Q456-T459 WeakPolarHBondContact O-CB 3.24Å; Q456-T459 PolarHBondContact O-N 2.96Å; Q456-T459 PolarHBondContact O-OG1 3.11Å; H457-T459 HydrophobicContact CB-CG2 4.27Å; H457-T459 WeakPolarHBondContact O-CG2 3.25Å; H457-T459 PolarHBondContact O-N 3.47Å; H457-T459 VanDerWaalsContact O-N 3.16Å; T459-C464 WeakPolarHBondContact CB-O 3.29Å; T459-C464 WeakPolarHBondContact OG1-CB 3.43Å; T459-N466 CarbonylContact C-O 3.24Å; T459-N466 WeakPolarHBondContact CA-O 2.94Å; T459-V468 WeakPolarHBondContact O-CG1 2.91Å; T459-V484 HydrophobicContact CG2-CG1 3.85Å
460	V	96.8	Very high	96.6	Very high	57 Å²	57	50.3 Å²	50.3	35%	0.345	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	164.8	-175.7	74.1	0	0	0	0	110.9	C464 H465 N466 C467 V468	V460-C464 CarbonylContact O-C 3.49Å; V460-H465 PolarHBondContact O-N 2.83Å; V460-N466 HydrophobicContact CG1-CB 3.97Å; V460-N466 PolarHBondContact N-O 2.68Å; V460-N466 PolarHBondContact O-N 2.91Å; V460-C467 WeakPolarHBondContact CG1-O 3.21Å; V460-V468 HydrophobicContact CB-CG1 3.86Å; V460-V468 HydrophobicContact CG1-CG1 4.41Å
461	G	95.4	Very high	96.6	Very high	32 Å²	32	52.7 Å²	52.7	33%	0.33	28%	0.28	S	S	.	.	S	Bend	trans	99.6	171.9	-179.8	0	0	0	0	0	111.7	K463 C464	G461-K463 PolarHBondContact O-N 3.37Å; G461-C464 PolarHBondContact O-N 2.97Å
462	R	95.9	Very high	96.6	Very high	89 Å²	89	53.2 Å²	53.2	34%	0.336	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-37	-171.9	-179.2	176.1	73.8	97.2	-10.6	114.4	L440 S448 G450 V451 C452	L440-R462 VanDerWaalsContact CD1-CD 3.45Å; S448-R462 PolarHBondContact OG-NH1 3.09Å; G450-R462 PolarHBondContact O-NH1 3.07Å; V451-R462 HydrophobicContact CB-CG 4.27Å; V451-R462 HydrophobicContact CG1-CG 4.17Å; V451-R462 HydrophobicContact CG2-CG 4.05Å; C452-R462 VanDerWaalsContact CB-O 3.3Å; C452-R462 WeakPolarHBondContact CB-O 3.42Å; C452-R462 PolarHBondContact N-O 2.05Å; C452-R462 PolarHBondContact SG-O 3.02Å
463	K	96.6	Very high	96.5	Very high	55 Å²	55	54.2 Å²	54.2	24%	0.239	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	12.3	-178.8	-62.5	-167.9	162.8	-163.7	0	112.7	D426 C427 N428 G461 H465	D426-K463 HydrophobicContact CB-CD 4.41Å; D426-K463 VanDerWaalsContact O-CB 3.31Å; D426-K463 WeakPolarHBondContact O-CB 3.46Å; D426-K463 VanDerWaalsContact O-CG 3.29Å; D426-K463 WeakPolarHBondContact O-CG 3.44Å; D426-K463 WeakPolarHBondContact OD2-CD 3.38Å; D426-K463 WeakPolarHBondContact OD2-CE 3.38Å; D426-K463 IonicContact OD2-NZ 3.74Å; D426-K463 PolarHBondContact OD2-NZ 2.95Å; C427-K463 CarbonylContact C-O 3.59Å; C427-K463 VanDerWaalsContact C-O 3.29Å; N428-K463 PolarHBondContact ND2-O 3.17Å; G461-K463 PolarHBondContact O-N 3.37Å; K463-H465 VanDerWaalsContact C-N 3.25Å; K463-H465 PolarHBondContact O-N 3.2Å
464	C	97.6	Very high	96.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	56.2	37.8	-172.7	-49.4	0	0	0	0	113.1	H430 C452 C455 T459 V460 G461	H430-C464 HydrophobicContact CB-CB 3.65Å; H430-C464 PolarHBondContact CD2-O 2.86Å; C452-C464 VanDerWaalsContact CB-SG 3.54Å; C455-C464 VanDerWaalsContact CA-SG 3.58Å; C455-C464 HydrophobicContact CB-CB 3.76Å; C455-C464 WeakPolarHBondContact CB-SG 3.31Å; C455-C464 WeakPolarHBondContact SG-CA 3.38Å; C455-C464 WeakPolarHBondContact SG-CB 3.42Å; C455-C464 CovalentContact SG-SG 2.05Å; C455-C464 PolarHBondContact SG-SG 3.5Å; T459-C464 WeakPolarHBondContact CB-O 3.29Å; T459-C464 WeakPolarHBondContact OG1-CB 3.43Å; V460-C464 CarbonylContact O-C 3.49Å; G461-C464 PolarHBondContact O-N 2.97Å
465	H	96.1	Very high	96.4	Very high	86 Å²	86	53.8 Å²	53.8	40%	0.398	27%	0.267	S	S	.	.			trans	-97	-9.2	-171.8	62	-87.2	0	0	0	114.3	V460 K463 V479	V460-H465 PolarHBondContact O-N 2.83Å; K463-H465 VanDerWaalsContact C-N 3.25Å; K463-H465 PolarHBondContact O-N 3.2Å; H465-V479 HydrophobicContact CB-CG2 4.48Å
466	N	96.2	Very high	96.3	Very high	72 Å²	72	57.8 Å²	57.8	39%	0.385	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	156.8	179.3	-64.8	-49.4	0	0	0	110.3	T459 V460	T459-N466 CarbonylContact C-O 3.24Å; T459-N466 WeakPolarHBondContact CA-O 2.94Å; V460-N466 HydrophobicContact CG1-CB 3.97Å; V460-N466 PolarHBondContact N-O 2.68Å; V460-N466 PolarHBondContact O-N 2.91Å
467	C	97	Very high	96.2	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.034	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.1	169	-58.1	0	0	0	0	111.8	N458 V460 Y472 C485	N458-C467 WeakPolarHBondContact O-CA 2.97Å; V460-C467 WeakPolarHBondContact CG1-O 3.21Å; C467-Y472 VanDerWaalsContact SG-C 3.52Å; C467-C485 WeakPolarHBondContact CA-SG 3.32Å; C467-C485 HydrophobicContact CB-CB 3.78Å; C467-C485 WeakPolarHBondContact CB-SG 3.01Å; C467-C485 WeakPolarHBondContact SG-CA 3.39Å; C467-C485 WeakPolarHBondContact SG-CB 3.38Å; C467-C485 CovalentContact SG-SG 2.04Å; C467-C485 PolarHBondContact SG-SG 2.93Å
468	V	96.3	Very high	96.1	Very high	41 Å²	41	56.9 Å²	56.9	25%	0.248	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-60.5	162.6	170.8	-63.4	0	0	0	0	110.6	N458 T459 V460 G470 Y471	N458-V468 HydrophobicContact CB-CG2 3.92Å; N458-V468 WeakPolarHBondContact O-CG2 3.36Å; N458-V468 PolarHBondContact O-N 3.48Å; T459-V468 WeakPolarHBondContact O-CG1 2.91Å; V460-V468 HydrophobicContact CB-CG1 3.86Å; V460-V468 HydrophobicContact CG1-CG1 4.41Å; V468-G470 PolarHBondContact O-N 3.4Å; V468-Y471 HydrophobicContact CG2-CD2 3.46Å; V468-Y471 VanDerWaalsContact CG2-CD2 3.46Å; V468-Y471 HydrophobicContact CG2-CE2 4.08Å; V468-Y471 HydrophobicContact CG2-CG 4.06Å; V468-Y471 PolarHBondContact O-N 2.92Å; V468-Y471 VanDerWaalsContact O-N 3.14Å
469	T	94.4	Very high	96.1	Very high	77 Å²	77	56 Å²	56	47%	0.472	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	133.2	173.9	-54.8	0	0	0	0	110.5	H500 R503	T469-H500 HydrophobicContact CG2-CB 4.1Å; T469-H500 VanDerWaalsContact CG2-CG 3.47Å; T469-H500 VanDerWaalsContact CG2-ND1 3.33Å; T469-H500 WeakPolarHBondContact CG2-ND1 3.13Å; T469-R503 PolarHBondContact OG1-NH2 3.09Å
470	G	94.8	Very high	96	Very high	12 Å²	12	57.9 Å²	57.9	12%	0.124	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-0.3	-175.1	0	0	0	0	0	114.3	V468 C488 H500	V468-G470 PolarHBondContact O-N 3.4Å; G470-C488 WeakPolarHBondContact O-CB 3.24Å; G470-C488 PolarHBondContact O-N 2.84Å; G470-C488 PolarHBondContact O-SG 3.33Å; G470-H500 VanDerWaalsContact CA-CD2 3.49Å; G470-H500 WeakPolarHBondContact CA-CD2 3.42Å
471	Y	97.3	Very high	96	Very high	53 Å²	53	58.9 Å²	58.9	21%	0.208	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	155.5	174.3	-71.4	-106.6	0	0	0	110.8	N458 V468 C485 L486 E487	N458-Y471 HydrophobicContact CB-CD1 3.71Å; N458-Y471 HydrophobicContact CB-CD2 4.18Å; N458-Y471 HydrophobicContact CB-CE1 3.79Å; N458-Y471 HydrophobicContact CB-CE2 4.25Å; N458-Y471 HydrophobicContact CB-CG 3.93Å; N458-Y471 VanDerWaalsContact CG-CE1 3.44Å; N458-Y471 VanDerWaalsContact CG-CZ 3.43Å; N458-Y471 WeakPolarHBondContact ND2-CE1 3.48Å; V468-Y471 HydrophobicContact CG2-CD2 3.46Å; V468-Y471 VanDerWaalsContact CG2-CD2 3.46Å; V468-Y471 HydrophobicContact CG2-CE2 4.08Å; V468-Y471 HydrophobicContact CG2-CG 4.06Å; V468-Y471 PolarHBondContact O-N 2.92Å; V468-Y471 VanDerWaalsContact O-N 3.14Å; Y471-C485 HydrophobicContact CD1-CB 4.22Å; Y471-C485 WeakPolarHBondContact CD1-O 3.22Å; Y471-L486 CarbonylContact C-O 3.56Å; Y471-L486 WeakPolarHBondContact CA-O 3.47Å; Y471-L486 WeakPolarHBondContact CB-O 3.3Å; Y471-L486 VanDerWaalsContact CD1-C 3.43Å; Y471-E487 HydrophobicContact CD1-CB 4.18Å; Y471-E487 HydrophobicContact CE1-CB 3.8Å; Y471-E487 HydrophobicContact CE1-CG 4.41Å
472	Y	96.7	Very high	96.1	Very high	47 Å²	47	61.3 Å²	61.3	18%	0.184	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	157.9	175.8	74.3	-80.4	0	0	0	112.1	C467 C485 L486 D502 R503	C467-Y472 VanDerWaalsContact SG-C 3.52Å; Y472-C485 WeakPolarHBondContact O-CA 3.5Å; Y472-L486 HydrophobicContact CD1-CB 4.1Å; Y472-L486 WeakPolarHBondContact CD1-O 3.23Å; Y472-L486 HydrophobicContact CE1-CB 3.57Å; Y472-L486 HydrophobicContact CE2-CB 4.4Å; Y472-L486 HydrophobicContact CE2-CD1 4.26Å; Y472-L486 PolarHBondContact N-O 3.15Å; Y472-L486 PolarHBondContact O-N 3.5Å; Y472-D502 WeakPolarHBondContact CB-O 3.17Å; Y472-R503 CarbonylContact C-O 3.54Å; Y472-R503 VanDerWaalsContact CA-O 3.24Å; Y472-R503 WeakPolarHBondContact CA-O 3.49Å
473	R	96.2	Very high	96.1	Very high	35 Å²	35	62.2 Å²	62.2	13%	0.132	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	125	-175.8	-178.7	63.8	171.9	83	4.6	111.8	W475 K477 R503	R473-W475 HydrophobicContact CB-CZ2 4.23Å; R473-W475 HydrophobicContact CG-CD2 3.8Å; R473-W475 HydrophobicContact CG-CE3 4.13Å; R473-W475 HydrophobicContact CG-CG 4.28Å; R473-W475 HydrophobicContact CG-CH2 4.22Å; R473-W475 HydrophobicContact CG-CZ2 3.88Å; R473-W475 HydrophobicContact CG-CZ3 4.33Å; R473-W475 PolarHBondContact O-N 3.06Å; R473-K477 VanDerWaalsContact CZ-O 3.25Å; R473-K477 PolarHBondContact NH1-O 3.15Å; R473-K477 PolarHBondContact NH2-O 3.08Å; R473-R503 PolarHBondContact N-O 3.23Å
474	D	96.4	Very high	96.1	Very high	24 Å²	24	59.7 Å²	59.7	13%	0.128	31%	0.306	C	S	.	.			trans	-86.2	87.5	170.4	179.2	2.4	0	0	0	111.4	T476 K477 V484 L486	D474-T476 VanDerWaalsContact CG-OG1 3.29Å; D474-T476 PolarHBondContact O-N 2.81Å; D474-T476 WeakPolarHBondContact OD1-CB 3.44Å; D474-T476 PolarHBondContact OD1-N 3.11Å; D474-T476 PolarHBondContact OD1-OG1 2.98Å; D474-T476 PolarHBondContact OD2-OG1 3.01Å; D474-K477 PolarHBondContact O-N 2.9Å; D474-K477 WeakPolarHBondContact OD2-CD 3.42Å; D474-K477 WeakPolarHBondContact OD2-CE 3.3Å; D474-K477 IonicContact OD2-NZ 3.18Å; D474-K477 PolarHBondContact OD2-NZ 2.94Å; D474-V484 PolarHBondContact N-O 3.32Å; D474-L486 HydrophobicContact CB-CD1 3.69Å; D474-L486 HydrophobicContact CB-CG 3.9Å
475	W	94.5	Very high	96.1	Very high	176 Å²	176	60 Å²	60	67%	0.667	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-9.1	-174.8	-62.8	98.7	0	0	0	115.7	R473 K477 K504	R473-W475 HydrophobicContact CB-CZ2 4.23Å; R473-W475 HydrophobicContact CG-CD2 3.8Å; R473-W475 HydrophobicContact CG-CE3 4.13Å; R473-W475 HydrophobicContact CG-CG 4.28Å; R473-W475 HydrophobicContact CG-CH2 4.22Å; R473-W475 HydrophobicContact CG-CZ2 3.88Å; R473-W475 HydrophobicContact CG-CZ3 4.33Å; R473-W475 PolarHBondContact O-N 3.06Å; W475-K477 VanDerWaalsContact C-N 3.28Å; W475-K504 PolarHBondContact NE1-O 3.24Å
476	T	95.3	Very high	96.1	Very high	123 Å²	123	58.3 Å²	58.3	76%	0.755	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-19.2	173.2	70.4	0	0	0	0	113.2	D474	D474-T476 VanDerWaalsContact CG-OG1 3.29Å; D474-T476 PolarHBondContact O-N 2.81Å; D474-T476 WeakPolarHBondContact OD1-CB 3.44Å; D474-T476 PolarHBondContact OD1-N 3.11Å; D474-T476 PolarHBondContact OD1-OG1 2.98Å; D474-T476 PolarHBondContact OD2-OG1 3.01Å
477	K	94.5	Very high	96.1	Very high	59 Å²	59	60.4 Å²	60.4	26%	0.257	31%	0.31	S	S	.	.	S	Bend	trans	-108.4	149.9	-178.1	-64	174.7	-171.6	158.5	0	111.7	R473 D474 W475 H481 Q483	R473-K477 VanDerWaalsContact CZ-O 3.25Å; R473-K477 PolarHBondContact NH1-O 3.15Å; R473-K477 PolarHBondContact NH2-O 3.08Å; D474-K477 PolarHBondContact O-N 2.9Å; D474-K477 WeakPolarHBondContact OD2-CD 3.42Å; D474-K477 WeakPolarHBondContact OD2-CE 3.3Å; D474-K477 IonicContact OD2-NZ 3.18Å; D474-K477 PolarHBondContact OD2-NZ 2.94Å; W475-K477 VanDerWaalsContact C-N 3.28Å; K477-H481 HydrophobicContact CB-CB 4.06Å; K477-Q483 WeakPolarHBondContact CD-O 3.47Å; K477-Q483 PolarHBondContact NZ-O 2.97Å
478	P	96.3	Very high	96	Very high	80 Å²	80	61.3 Å²	61.3	52%	0.519	32%	0.315	S	S	.	.			trans	-63.9	157.6	171.9	28	-33.6	0	0	0	110.8	S480 H481	P478-S480 PolarHBondContact O-N 2.71Å; P478-S480 VanDerWaalsContact O-N 3.14Å; P478-H481 HydrophobicContact CG-CB 4.2Å; P478-H481 WeakPolarHBondContact O-CB 3.29Å; P478-H481 PolarHBondContact O-N 3.41Å
479	V	95.4	Very high	96	Very high	48 Å²	48	69.3 Å²	69.3	29%	0.291	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26	-177	64.9	0	0	0	0	112.5	N428 H430 H465 H481	N428-V479 HydrophobicContact CB-CG1 4.35Å; N428-V479 HydrophobicContact CB-CG2 4.4Å; N428-V479 VanDerWaalsContact OD1-CG1 3.23Å; N428-V479 WeakPolarHBondContact OD1-CG1 3.41Å; H430-V479 PolarHBondContact NE2-O 3.22Å; H465-V479 HydrophobicContact CB-CG2 4.48Å; V479-H481 VanDerWaalsContact C-N 3.31Å; V479-H481 PolarHBondContact O-N 3.46Å
480	S	96.5	Very high	96	Very high	44 Å²	44	67.3 Å²	67.3	31%	0.308	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-0.1	-177.5	60	0	0	0	0	115.1	N428 H430 P478	N428-S480 VanDerWaalsContact O-CA 3.22Å; N428-S480 WeakPolarHBondContact O-CA 3.42Å; H430-S480 VanDerWaalsContact CE1-C 3.41Å; H430-S480 PolarHBondContact CE1-O 3.3Å; P478-S480 PolarHBondContact O-N 2.71Å; P478-S480 VanDerWaalsContact O-N 3.14Å
481	H	97.4	Very high	96.1	Very high	79 Å²	79	70.3 Å²	70.3	37%	0.366	34%	0.341	S	S	.	.			trans	-78.1	137.7	-175.7	-169.6	-76.6	0	0	0	111.7	H430 K477 P478 V479 Q483 V484	H430-H481 PolarHBondContact CE1-O 3.07Å; K477-H481 HydrophobicContact CB-CB 4.06Å; P478-H481 HydrophobicContact CG-CB 4.2Å; P478-H481 WeakPolarHBondContact O-CB 3.29Å; P478-H481 PolarHBondContact O-N 3.41Å; V479-H481 VanDerWaalsContact C-N 3.31Å; V479-H481 PolarHBondContact O-N 3.46Å; H481-Q483 PolarHBondContact ND1-N 2.86Å; H481-Q483 PolarHBondContact O-N 2.9Å; H481-V484 HydrophobicContact CB-CB 4.43Å; H481-V484 WeakPolarHBondContact O-CB 3.47Å; H481-V484 WeakPolarHBondContact O-CG1 3.41Å; H481-V484 PolarHBondContact O-N 3.49Å
482	D	96.6	Very high	95.9	Very high	82 Å²	82	73.1 Å²	73.1	44%	0.439	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.5	-174.5	-59.5	-4.1	0	0	0	114.5	H457	H457-D482 VanDerWaalsContact CB-O 3.26Å; H457-D482 WeakPolarHBondContact CB-O 3.45Å; H457-D482 IonicContact CE1-OD1 2.64Å; H457-D482 PolarHBondContact CE1-OD1 2.02Å; H457-D482 IonicContact CE1-OD2 3.85Å; H457-D482 IonicContact ND1-OD1 3.76Å; H457-D482 PolarHBondContact ND1-OD1 3.17Å; H457-D482 IonicContact NE2-OD1 2.9Å; H457-D482 IonicContact NE2-OD2 3.87Å
483	Q	95.7	Very high	95.8	Very high	108 Å²	108	74.6 Å²	74.6	51%	0.505	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	35.9	175.9	-59.4	-63.1	-61.8	0	0	112.9	K477 H481 C485	K477-Q483 WeakPolarHBondContact CD-O 3.47Å; K477-Q483 PolarHBondContact NZ-O 2.97Å; H481-Q483 PolarHBondContact ND1-N 2.86Å; H481-Q483 PolarHBondContact O-N 2.9Å; Q483-C485 VanDerWaalsContact C-N 3.34Å
484	V	96.7	Very high	95.7	Very high	2 Å²	2	73 Å²	73	1%	0.012	37%	0.37	C	S	.	.			trans	-72.3	-26.2	179.3	66.6	0	0	0	0	113.4	T459 D474 H481	T459-V484 HydrophobicContact CG2-CG1 3.85Å; D474-V484 PolarHBondContact N-O 3.32Å; H481-V484 HydrophobicContact CB-CB 4.43Å; H481-V484 WeakPolarHBondContact O-CB 3.47Å; H481-V484 WeakPolarHBondContact O-CG1 3.41Å; H481-V484 PolarHBondContact O-N 3.49Å
485	C	97.5	Very high	95.7	Very high	6 Å²	6	72.2 Å²	72.2	4%	0.041	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116	-178.9	-71.2	0	0	0	0	110.4	N458 C467 Y471 Y472 Q483	N458-C485 HydrophobicContact CB-CB 4.05Å; C467-C485 WeakPolarHBondContact CA-SG 3.32Å; C467-C485 HydrophobicContact CB-CB 3.78Å; C467-C485 WeakPolarHBondContact CB-SG 3.01Å; C467-C485 WeakPolarHBondContact SG-CA 3.39Å; C467-C485 WeakPolarHBondContact SG-CB 3.38Å; C467-C485 CovalentContact SG-SG 2.04Å; C467-C485 PolarHBondContact SG-SG 2.93Å; Y471-C485 HydrophobicContact CD1-CB 4.22Å; Y471-C485 WeakPolarHBondContact CD1-O 3.22Å; Y472-C485 WeakPolarHBondContact O-CA 3.5Å; Q483-C485 VanDerWaalsContact C-N 3.34Å
486	L	96.5	Very high	95.7	Very high	51 Å²	51	67.1 Å²	67.1	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	141	179.7	-63.7	176.3	0	0	0	110.8	Y471 Y472 D474	Y471-L486 CarbonylContact C-O 3.56Å; Y471-L486 WeakPolarHBondContact CA-O 3.47Å; Y471-L486 WeakPolarHBondContact CB-O 3.3Å; Y471-L486 VanDerWaalsContact CD1-C 3.43Å; Y472-L486 HydrophobicContact CD1-CB 4.1Å; Y472-L486 WeakPolarHBondContact CD1-O 3.23Å; Y472-L486 HydrophobicContact CE1-CB 3.57Å; Y472-L486 HydrophobicContact CE2-CB 4.4Å; Y472-L486 HydrophobicContact CE2-CD1 4.26Å; Y472-L486 PolarHBondContact N-O 3.15Å; Y472-L486 PolarHBondContact O-N 3.5Å; D474-L486 HydrophobicContact CB-CD1 3.69Å; D474-L486 HydrophobicContact CB-CG 3.9Å
487	E	96.4	Very high	95.3	Very high	117 Å²	117	64.8 Å²	64.8	55%	0.547	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	138.6	-179.8	-170.8	177.8	-160.2	0	0	111.8	Y471 R489	Y471-E487 HydrophobicContact CD1-CB 4.18Å; Y471-E487 HydrophobicContact CE1-CB 3.8Å; Y471-E487 HydrophobicContact CE1-CG 4.41Å; E487-R489 PolarHBondContact O-N 2.83Å
488	C	95.5	Very high	94.8	Very high	23 Å²	23	69.8 Å²	69.8	16%	0.155	38%	0.375	C	S	.	.			trans	-67.3	113	174.1	-63.2	0	0	0	0	110.6	G470 C490 C501	G470-C488 WeakPolarHBondContact O-CB 3.24Å; G470-C488 PolarHBondContact O-N 2.84Å; G470-C488 PolarHBondContact O-SG 3.33Å; C488-C490 PolarHBondContact O-N 2.88Å; C488-C501 HydrophobicContact CB-CB 3.72Å; C488-C501 WeakPolarHBondContact CB-SG 3.3Å; C488-C501 WeakPolarHBondContact SG-CB 3.49Å; C488-C501 PolarHBondContact SG-N 3.03Å; C488-C501 VanDerWaalsContact SG-N 3.38Å; C488-C501 CovalentContact SG-SG 2.02Å; C488-C501 PolarHBondContact SG-SG 3.22Å
489	R	95.1	Very high	94.5	Very high	210 Å²	210	71.1 Å²	71.1	79%	0.792	37%	0.374	S	S	*	.			trans	-96.7	57.2	176.1	-64.5	-176.7	-179.2	171.2	0.5	112.4	E487 A518	E487-R489 PolarHBondContact O-N 2.83Å; R489-A518 WeakPolarHBondContact O-CB 3Å
490	C	95.8	Very high	94.3	Very high	35 Å²	35	74.1 Å²	74.1	24%	0.236	38%	0.384	C	S	.	.			trans	-71.2	129.2	-179.5	-58.2	0	0	0	0	111.7	C488 S495 C508	C488-C490 PolarHBondContact O-N 2.88Å; C490-S495 WeakPolarHBondContact CB-OG 3.1Å; C490-C508 WeakPolarHBondContact CA-SG 3.37Å; C490-C508 HydrophobicContact CB-CB 3.7Å; C490-C508 WeakPolarHBondContact CB-SG 3.41Å; C490-C508 WeakPolarHBondContact SG-CB 3.18Å; C490-C508 CovalentContact SG-SG 2.03Å; C490-C508 PolarHBondContact SG-SG 2.85Å
491	H	95.6	Very high	94.2	Very high	74 Å²	74	72.2 Å²	72.2	34%	0.343	37%	0.371	S	S	.	.			trans	-65.4	126.3	-179.4	-171	-102	0	0	0	110	I493 G494 S495 A518 C519 N520	H491-I493 VanDerWaalsContact C-N 3.27Å; H491-I493 PolarHBondContact O-N 2.81Å; H491-G494 PolarHBondContact ND1-N 3.27Å; H491-G494 VanDerWaalsContact ND1-N 3.18Å; H491-G494 PolarHBondContact O-N 2.94Å; H491-S495 PolarHBondContact N-OG 2.92Å; H491-S495 VanDerWaalsContact O-CB 3.22Å; H491-S495 WeakPolarHBondContact O-CB 3.37Å; H491-S495 PolarHBondContact O-N 2.79Å; H491-S495 PolarHBondContact O-OG 3.18Å; H491-A518 WeakPolarHBondContact CB-O 3.49Å; H491-A518 PolarHBondContact N-O 2.92Å; H491-C519 VanDerWaalsContact CB-O 3.3Å; H491-C519 WeakPolarHBondContact CB-O 3.4Å; H491-N520 HydrophobicContact CB-CB 4.33Å
492	P	93.9	Very high	94.1	Very high	112 Å²	112	72.2 Å²	72.2	73%	0.727	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-30.6	-168.3	23.3	-34.3	0	0	0	113.5
493	I	94.1	Very high	93.9	Very high	79 Å²	79	73.5 Å²	73.5	41%	0.405	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-38.5	179.2	-63.5	171.1	0	0	0	111.2	H491 K511 P535	H491-I493 VanDerWaalsContact C-N 3.27Å; H491-I493 PolarHBondContact O-N 2.81Å; I493-K511 WeakPolarHBondContact O-CD 3.32Å; I493-K511 WeakPolarHBondContact O-CE 3.06Å; I493-K511 PolarHBondContact O-NZ 2.9Å; I493-P535 HydrophobicContact CG2-CB 3.68Å; I493-P535 HydrophobicContact CG2-CG 4.14Å
494	G	94.7	Very high	93.8	Very high	2 Å²	2	75.2 Å²	75.2	2%	0.021	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.4	-170.9	0	0	0	0	0	113.9	H491 K511 C519	H491-G494 PolarHBondContact ND1-N 3.27Å; H491-G494 VanDerWaalsContact ND1-N 3.18Å; H491-G494 PolarHBondContact O-N 2.94Å; G494-K511 PolarHBondContact O-N 3.23Å; G494-C519 WeakPolarHBondContact CA-O 3.21Å
495	S	96.1	Very high	93.7	Very high	7 Å²	7	78.7 Å²	78.7	5%	0.049	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-96.6	160.2	177.4	-45.4	0	0	0	0	111.6	C490 H491 A497 P509 K511 C519	C490-S495 WeakPolarHBondContact CB-OG 3.1Å; H491-S495 PolarHBondContact N-OG 2.92Å; H491-S495 VanDerWaalsContact O-CB 3.22Å; H491-S495 WeakPolarHBondContact O-CB 3.37Å; H491-S495 PolarHBondContact O-N 2.79Å; H491-S495 PolarHBondContact O-OG 3.18Å; S495-A497 PolarHBondContact O-N 3.17Å; S495-P509 CarbonylContact C-O 3.49Å; S495-P509 VanDerWaalsContact CA-O 3.29Å; S495-P509 WeakPolarHBondContact CA-O 3.16Å; S495-K511 WeakPolarHBondContact O-CE 3.37Å; S495-C519 WeakPolarHBondContact OG-CB 3.47Å
496	I	94.1	Very high	93.6	Very high	68 Å²	68	78.6 Å²	78.6	35%	0.349	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-73.2	124.2	171.8	-58.5	175.2	0	0	0	108.7	Q499 P509 K511	I496-Q499 HydrophobicContact CG2-CG 4.12Å; I496-Q499 PolarHBondContact O-N 3.44Å; I496-P509 HydrophobicContact CB-CB 4.37Å; I496-P509 HydrophobicContact CB-CG 4.45Å; I496-P509 HydrophobicContact CD1-CB 4.26Å; I496-P509 HydrophobicContact CG1-CB 4.47Å; I496-P509 PolarHBondContact N-O 3.05Å; I496-K511 HydrophobicContact CG1-CG 4.35Å
497	A	88.2	Confident	93.6	Very high	75 Å²	75	80 Å²	80	62%	0.62	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	144.5	-177.2	0	0	0	0	0	112.5	S495 Q499	S495-A497 PolarHBondContact O-N 3.17Å; A497-Q499 PolarHBondContact O-N 3.22Å
498	N	83.5	Confident	93.6	Very high	164 Å²	164	74.7 Å²	74.7	88%	0.877	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	19.8	178.5	-57.3	-37.4	0	0	0	115.7
499	Q	89.1	Confident	93.6	Very high	107 Å²	107	74.8 Å²	74.8	50%	0.5	38%	0.381	S	S	.	.			trans	-114.2	135.9	171.3	-61.1	-169	13.2	0	0	110.2	I496 A497 P509	I496-Q499 HydrophobicContact CG2-CG 4.12Å; I496-Q499 PolarHBondContact O-N 3.44Å; A497-Q499 PolarHBondContact O-N 3.22Å; Q499-P509 HydrophobicContact CB-CB 4.36Å; Q499-P509 HydrophobicContact CB-CG 3.43Å; Q499-P509 VanDerWaalsContact CB-CG 3.43Å; Q499-P509 HydrophobicContact CG-CG 4.48Å
500	H	91.5	Very high	93.7	Very high	111 Å²	111	66.5 Å²	66.5	51%	0.514	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-89.6	158.8	179.8	-56.6	85.1	0	0	0	109.8	T469 G470	T469-H500 HydrophobicContact CG2-CB 4.1Å; T469-H500 VanDerWaalsContact CG2-CG 3.47Å; T469-H500 VanDerWaalsContact CG2-ND1 3.33Å; T469-H500 WeakPolarHBondContact CG2-ND1 3.13Å; G470-H500 VanDerWaalsContact CA-CD2 3.49Å; G470-H500 WeakPolarHBondContact CA-CD2 3.42Å
501	C	95.1	Very high	93.7	Very high	5 Å²	5	66.6 Å²	66.6	3%	0.034	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-64.1	159.6	173.5	76.5	0	0	0	0	111.9	C488 R503 G506 Q507	C488-C501 HydrophobicContact CB-CB 3.72Å; C488-C501 WeakPolarHBondContact CB-SG 3.3Å; C488-C501 WeakPolarHBondContact SG-CB 3.49Å; C488-C501 PolarHBondContact SG-N 3.03Å; C488-C501 VanDerWaalsContact SG-N 3.38Å; C488-C501 CovalentContact SG-SG 2.02Å; C488-C501 PolarHBondContact SG-SG 3.22Å; C501-R503 PolarHBondContact O-N 3.37Å; C501-G506 WeakPolarHBondContact CB-O 3.22Å; C501-Q507 VanDerWaalsContact CA-O 3.32Å; C501-Q507 WeakPolarHBondContact CA-O 3.38Å; C501-Q507 WeakPolarHBondContact CB-O 3.16Å
502	D	94.9	Very high	93.7	Very high	79 Å²	79	68.6 Å²	68.6	42%	0.422	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-61.5	125.6	171.6	174.5	-5	0	0	0	110.2	Y472 K504 T505 G506 Q507	Y472-D502 WeakPolarHBondContact CB-O 3.17Å; D502-K504 PolarHBondContact O-N 2.77Å; D502-K504 VanDerWaalsContact O-N 3.15Å; D502-K504 PolarHBondContact OD1-N 3.11Å; D502-T505 VanDerWaalsContact CB-OG1 3.28Å; D502-T505 WeakPolarHBondContact CB-OG1 3.36Å; D502-T505 VanDerWaalsContact CG-OG1 3.23Å; D502-T505 PolarHBondContact O-N 3.02Å; D502-T505 PolarHBondContact OD2-OG1 2.95Å; D502-G506 VanDerWaalsContact O-CA 3.31Å; D502-G506 WeakPolarHBondContact O-CA 3.34Å; D502-G506 PolarHBondContact O-N 3.16Å; D502-Q507 PolarHBondContact N-O 2.85Å
503	R	92.9	Very high	93.7	Very high	109 Å²	109	63.6 Å²	63.6	41%	0.411	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.9	-176.7	-62.8	-176.2	-177.7	-178.9	0.1	114	T469 Y472 R473 C501	T469-R503 PolarHBondContact OG1-NH2 3.09Å; Y472-R503 CarbonylContact C-O 3.54Å; Y472-R503 VanDerWaalsContact CA-O 3.24Å; Y472-R503 WeakPolarHBondContact CA-O 3.49Å; R473-R503 PolarHBondContact N-O 3.23Å; C501-R503 PolarHBondContact O-N 3.37Å
504	K	93.2	Very high	93.8	Very high	143 Å²	143	60.3 Å²	60.3	62%	0.622	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-41.9	179	-69.9	-173	178.3	-175.4	0	112.7	W475 D502	W475-K504 PolarHBondContact NE1-O 3.24Å; D502-K504 PolarHBondContact O-N 2.77Å; D502-K504 VanDerWaalsContact O-N 3.15Å; D502-K504 PolarHBondContact OD1-N 3.11Å
505	T	94	Very high	93.9	Very high	76 Å²	76	62.4 Å²	62.4	47%	0.466	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-18.1	-170.3	61.4	0	0	0	0	113.5	D502 Q507 Q517	D502-T505 VanDerWaalsContact CB-OG1 3.28Å; D502-T505 WeakPolarHBondContact CB-OG1 3.36Å; D502-T505 VanDerWaalsContact CG-OG1 3.23Å; D502-T505 PolarHBondContact O-N 3.02Å; D502-T505 PolarHBondContact OD2-OG1 2.95Å; T505-Q507 PolarHBondContact O-N 3.29Å; T505-Q507 PolarHBondContact OG1-N 2.97Å; T505-Q517 PolarHBondContact O-NE2 2.95Å
506	G	94.8	Very high	93.8	Very high	4 Å²	4	62.9 Å²	62.9	4%	0.041	34%	0.342	C	S	.	.			trans	72.9	3.8	-172.3	0	0	0	0	0	114.2	C501 D502 C508 Q517	C501-G506 WeakPolarHBondContact CB-O 3.22Å; D502-G506 VanDerWaalsContact O-CA 3.31Å; D502-G506 WeakPolarHBondContact O-CA 3.34Å; D502-G506 PolarHBondContact O-N 3.16Å; G506-C508 PolarHBondContact O-N 3.24Å; G506-Q517 WeakPolarHBondContact O-CG 3.33Å
507	Q	96.6	Very high	93.8	Very high	81 Å²	81	64.2 Å²	64.2	38%	0.379	35%	0.346	S	S	.	.			trans	-69.1	121.7	-178.9	-178.9	58.7	57.1	0	0	110.7	C501 D502 T505 C510 G516 Q517	C501-Q507 VanDerWaalsContact CA-O 3.32Å; C501-Q507 WeakPolarHBondContact CA-O 3.38Å; C501-Q507 WeakPolarHBondContact CB-O 3.16Å; D502-Q507 PolarHBondContact N-O 2.85Å; T505-Q507 PolarHBondContact O-N 3.29Å; T505-Q507 PolarHBondContact OG1-N 2.97Å; Q507-C510 PolarHBondContact NE2-SG 3.06Å; Q507-G516 PolarHBondContact NE2-O 3.06Å; Q507-Q517 PolarHBondContact NE2-O 3.31Å
508	C	96.8	Very high	94.2	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.027	33%	0.327	C	S	.	.			trans	-76.2	148.8	173.5	-66	0	0	0	0	111.1	C490 G506 C510 Q517 C519	C490-C508 WeakPolarHBondContact CA-SG 3.37Å; C490-C508 HydrophobicContact CB-CB 3.7Å; C490-C508 WeakPolarHBondContact CB-SG 3.41Å; C490-C508 WeakPolarHBondContact SG-CB 3.18Å; C490-C508 CovalentContact SG-SG 2.03Å; C490-C508 PolarHBondContact SG-SG 2.85Å; G506-C508 PolarHBondContact O-N 3.24Å; C508-C510 PolarHBondContact O-N 3.1Å; C508-C510 VanDerWaalsContact O-N 3.12Å; C508-C510 PolarHBondContact O-SG 3.39Å; C508-Q517 VanDerWaalsContact CB-O 3.23Å; C508-Q517 WeakPolarHBondContact CB-O 3.36Å; C508-Q517 PolarHBondContact N-O 3.28Å; C508-Q517 PolarHBondContact SG-O 2.05Å; C508-Q517 VanDerWaalsContact SG-O 3.35Å; C508-C519 VanDerWaalsContact C-SG 3.58Å; C508-C519 WeakPolarHBondContact CB-SG 3.13Å; C508-C519 PolarHBondContact O-SG 3.14Å
509	P	96.5	Very high	94.8	Very high	26 Å²	26	54.1 Å²	54.1	17%	0.169	29%	0.286	C	S	.	.			trans	-75.1	101.5	176.3	27.4	-29.4	0	0	0	109.7	S495 I496 Q499	S495-P509 CarbonylContact C-O 3.49Å; S495-P509 VanDerWaalsContact CA-O 3.29Å; S495-P509 WeakPolarHBondContact CA-O 3.16Å; I496-P509 HydrophobicContact CB-CB 4.37Å; I496-P509 HydrophobicContact CB-CG 4.45Å; I496-P509 HydrophobicContact CD1-CB 4.26Å; I496-P509 HydrophobicContact CG1-CB 4.47Å; I496-P509 PolarHBondContact N-O 3.05Å; Q499-P509 HydrophobicContact CB-CB 4.36Å; Q499-P509 HydrophobicContact CB-CG 3.43Å; Q499-P509 VanDerWaalsContact CB-CG 3.43Å; Q499-P509 HydrophobicContact CG-CG 4.48Å
510	C	96.6	Very high	95.2	Very high	35 Å²	35	53.9 Å²	53.9	24%	0.236	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-82	145.3	-174.3	-55.1	0	0	0	0	112.8	Q507 C508 V514 C519	Q507-C510 PolarHBondContact NE2-SG 3.06Å; C508-C510 PolarHBondContact O-N 3.1Å; C508-C510 VanDerWaalsContact O-N 3.12Å; C508-C510 PolarHBondContact O-SG 3.39Å; C510-V514 HydrophobicContact CB-CB 4.21Å; C510-V514 HydrophobicContact CB-CG1 4.48Å; C510-V514 VanDerWaalsContact CB-O 3.28Å; C510-V514 WeakPolarHBondContact CB-O 3.48Å; C510-C519 WeakPolarHBondContact CA-SG 3.27Å; C510-C519 HydrophobicContact CB-CB 3.73Å; C510-C519 WeakPolarHBondContact CB-SG 3.3Å; C510-C519 PolarHBondContact N-SG 3.04Å; C510-C519 WeakPolarHBondContact SG-CA 3.42Å; C510-C519 WeakPolarHBondContact SG-CB 3.47Å; C510-C519 CovalentContact SG-SG 2.04Å; C510-C519 PolarHBondContact SG-SG 3.22Å
511	K	95.8	Very high	95.4	Very high	37 Å²	37	56.5 Å²	56.5	16%	0.161	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66.7	158.4	169.1	-73.6	-177.3	-179.2	163.7	0	110.7	I493 G494 S495 I496 G513 V514 P532 P535	I493-K511 WeakPolarHBondContact O-CD 3.32Å; I493-K511 WeakPolarHBondContact O-CE 3.06Å; I493-K511 PolarHBondContact O-NZ 2.9Å; G494-K511 PolarHBondContact O-N 3.23Å; S495-K511 WeakPolarHBondContact O-CE 3.37Å; I496-K511 HydrophobicContact CG1-CG 4.35Å; K511-G513 PolarHBondContact O-N 2.76Å; K511-V514 HydrophobicContact CB-CG2 4.02Å; K511-V514 WeakPolarHBondContact O-CB 3.41Å; K511-V514 PolarHBondContact O-N 2.91Å; K511-P532 PolarHBondContact NZ-O 3.15Å; K511-P535 HydrophobicContact CD-CG 4.12Å
512	P	94.5	Very high	95.4	Very high	116 Å²	116	58 Å²	58	75%	0.753	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	132.6	177.5	-26.7	35.3	0	0	0	112.4	V514	P512-V514 VanDerWaalsContact C-N 3.27Å; P512-V514 PolarHBondContact O-N 3.09Å
513	G	94.3	Very high	95.4	Very high	7 Å²	7	58.7 Å²	58.7	7%	0.072	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	2.7	-178.6	0	0	0	0	0	115.5	K511 C522 Q523 Y526 C536	K511-G513 PolarHBondContact O-N 2.76Å; G513-C522 CarbonylContact O-C 3.58Å; G513-C522 WeakPolarHBondContact O-CA 3.36Å; G513-Q523 PolarHBondContact O-N 2.71Å; G513-Y526 VanDerWaalsContact CA-CE1 3.48Å; G513-C536 VanDerWaalsContact O-CB 3.3Å; G513-C536 WeakPolarHBondContact O-CB 3.27Å
514	V	97	Very high	95.4	Very high	11 Å²	11	62.6 Å²	62.6	7%	0.067	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.7	175.5	-171.7	0	0	0	0	109.6	C510 K511 P512 C519 R521 P535 C536	C510-V514 HydrophobicContact CB-CB 4.21Å; C510-V514 HydrophobicContact CB-CG1 4.48Å; C510-V514 VanDerWaalsContact CB-O 3.28Å; C510-V514 WeakPolarHBondContact CB-O 3.48Å; K511-V514 HydrophobicContact CB-CG2 4.02Å; K511-V514 WeakPolarHBondContact O-CB 3.41Å; K511-V514 PolarHBondContact O-N 2.91Å; P512-V514 VanDerWaalsContact C-N 3.27Å; P512-V514 PolarHBondContact O-N 3.09Å; V514-C519 VanDerWaalsContact CG1-C 3.48Å; V514-C519 HydrophobicContact CG1-CB 3.84Å; V514-C519 WeakPolarHBondContact CG1-O 3.44Å; V514-R521 CarbonylContact C-O 3.3Å; V514-R521 WeakPolarHBondContact CA-O 3.45Å; V514-R521 WeakPolarHBondContact CG1-O 3.29Å; V514-P535 HydrophobicContact CG2-CG 3.84Å; V514-C536 HydrophobicContact CG2-CB 4.13Å
515	V	96.1	Very high	95.4	Very high	46 Å²	46	58.2 Å²	58.2	28%	0.279	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	176	-179.4	-59.7	0	0	0	0	112.1	N520 R521 Q523	V515-N520 PolarHBondContact O-N 3.39Å; V515-R521 HydrophobicContact CG2-CG 3.81Å; V515-R521 PolarHBondContact N-O 2.96Å; V515-R521 WeakPolarHBondContact O-CG 3.47Å; V515-R521 PolarHBondContact O-N 3.21Å; V515-Q523 HydrophobicContact CG1-CB 3.76Å; V515-Q523 HydrophobicContact CG1-CG 3.94Å
516	G	95.1	Very high	95.4	Very high	17 Å²	17	57.5 Å²	57.5	18%	0.175	31%	0.311	C	S	.	.	S	Bend	trans	98.5	155.4	-175.1	0	0	0	0	0	112.3	Q507 A518 C519	Q507-G516 PolarHBondContact NE2-O 3.06Å; G516-A518 PolarHBondContact O-N 2.94Å; G516-C519 PolarHBondContact O-N 2.55Å
517	Q	94.5	Very high	95.3	Very high	96 Å²	96	62.4 Å²	62.4	45%	0.449	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-38.1	-178.9	-167.3	-176.7	15.4	0	0	111.8	T505 G506 Q507 C508	T505-Q517 PolarHBondContact O-NE2 2.95Å; G506-Q517 WeakPolarHBondContact O-CG 3.33Å; Q507-Q517 PolarHBondContact NE2-O 3.31Å; C508-Q517 VanDerWaalsContact CB-O 3.23Å; C508-Q517 WeakPolarHBondContact CB-O 3.36Å; C508-Q517 PolarHBondContact N-O 3.28Å; C508-Q517 PolarHBondContact SG-O 2.05Å; C508-Q517 VanDerWaalsContact SG-O 3.35Å
518	A	95.9	Very high	95.1	Very high	26 Å²	26	65.8 Å²	65.8	22%	0.215	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	3.1	176.6	0	0	0	0	0	114.3	R489 H491 G516 N520	R489-A518 WeakPolarHBondContact O-CB 3Å; H491-A518 WeakPolarHBondContact CB-O 3.49Å; H491-A518 PolarHBondContact N-O 2.92Å; G516-A518 PolarHBondContact O-N 2.94Å; A518-N520 VanDerWaalsContact C-N 3.34Å; A518-N520 HydrophobicContact CB-CB 4.32Å; A518-N520 PolarHBondContact O-N 3.37Å
519	C	96.8	Very high	94.7	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.007	35%	0.353	C	S	.	.	S	Bend	trans	54.5	44.9	-173.2	-48.7	0	0	0	0	113.7	H491 G494 S495 C508 C510 V514 G516	H491-C519 VanDerWaalsContact CB-O 3.3Å; H491-C519 WeakPolarHBondContact CB-O 3.4Å; G494-C519 WeakPolarHBondContact CA-O 3.21Å; S495-C519 WeakPolarHBondContact OG-CB 3.47Å; C508-C519 VanDerWaalsContact C-SG 3.58Å; C508-C519 WeakPolarHBondContact CB-SG 3.13Å; C508-C519 PolarHBondContact O-SG 3.14Å; C510-C519 WeakPolarHBondContact CA-SG 3.27Å; C510-C519 HydrophobicContact CB-CB 3.73Å; C510-C519 WeakPolarHBondContact CB-SG 3.3Å; C510-C519 PolarHBondContact N-SG 3.04Å; C510-C519 WeakPolarHBondContact SG-CA 3.42Å; C510-C519 WeakPolarHBondContact SG-CB 3.47Å; C510-C519 CovalentContact SG-SG 2.04Å; C510-C519 PolarHBondContact SG-SG 3.22Å; V514-C519 VanDerWaalsContact CG1-C 3.48Å; V514-C519 HydrophobicContact CG1-CB 3.84Å; V514-C519 WeakPolarHBondContact CG1-O 3.44Å; G516-C519 PolarHBondContact O-N 2.55Å
520	N	95.6	Very high	94.4	Very high	102 Å²	102	77.5 Å²	77.5	55%	0.545	39%	0.39	S	S	.	.			trans	-106.5	5.1	-168.9	64.3	-28.9	0	0	0	114.3	H491 V515 A518	H491-N520 HydrophobicContact CB-CB 4.33Å; V515-N520 PolarHBondContact O-N 3.39Å; A518-N520 VanDerWaalsContact C-N 3.34Å; A518-N520 HydrophobicContact CB-CB 4.32Å; A518-N520 PolarHBondContact O-N 3.37Å
521	R	95.8	Very high	93.9	Very high	166 Å²	166	81.2 Å²	81.2	63%	0.626	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	152.9	-179.9	58.6	-179.8	-179.4	-177.3	2.3	111.7	V514 V515	V514-R521 CarbonylContact C-O 3.3Å; V514-R521 WeakPolarHBondContact CA-O 3.45Å; V514-R521 WeakPolarHBondContact CG1-O 3.29Å; V515-R521 HydrophobicContact CG2-CG 3.81Å; V515-R521 PolarHBondContact N-O 2.96Å; V515-R521 WeakPolarHBondContact O-CG 3.47Å; V515-R521 PolarHBondContact O-N 3.21Å
522	C	95.5	Very high	93.6	Very high	35 Å²	35	83.3 Å²	83.3	24%	0.236	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	148.3	172.4	-61.2	0	0	0	0	111	G513 C536	G513-C522 CarbonylContact O-C 3.58Å; G513-C522 WeakPolarHBondContact O-CA 3.36Å; C522-C536 WeakPolarHBondContact CA-SG 3.16Å; C522-C536 HydrophobicContact CB-CB 3.79Å; C522-C536 WeakPolarHBondContact CB-SG 3.27Å; C522-C536 WeakPolarHBondContact SG-CB 3.45Å; C522-C536 CovalentContact SG-SG 2.04Å; C522-C536 PolarHBondContact SG-SG 2.79Å
523	Q	95.6	Very high	93.3	Very high	95 Å²	95	84.9 Å²	84.9	44%	0.444	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-60.6	154.1	169.7	-169	168	-20.3	0	0	110.2	G513 V515 G525 Y526	G513-Q523 PolarHBondContact O-N 2.71Å; V515-Q523 HydrophobicContact CG1-CB 3.76Å; V515-Q523 HydrophobicContact CG1-CG 3.94Å; Q523-G525 PolarHBondContact O-N 3.12Å; Q523-Y526 HydrophobicContact CB-CD2 3.84Å; Q523-Y526 HydrophobicContact CB-CE2 4.34Å; Q523-Y526 HydrophobicContact CB-CG 4.39Å; Q523-Y526 HydrophobicContact CG-CD2 4.46Å; Q523-Y526 WeakPolarHBondContact O-CB 3.33Å; Q523-Y526 PolarHBondContact O-N 3.28Å
524	E	93.5	Very high	93.2	Very high	190 Å²	190	86.4 Å²	86.4	89%	0.888	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	134.9	171.6	-168.2	168.1	-168.7	0	0	110.9	Y526	E524-Y526 VanDerWaalsContact C-N 3.33Å
525	G	92.5	Very high	93	Very high	52 Å²	52	86.4 Å²	86.4	54%	0.536	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-4.8	-172.3	0	0	0	0	0	115.7	Q523 A539	Q523-G525 PolarHBondContact O-N 3.12Å; G525-A539 WeakPolarHBondContact O-CB 3.44Å; G525-A539 PolarHBondContact O-N 2.85Å
526	Y	94.7	Very high	92.9	Very high	60 Å²	60	84.8 Å²	84.8	24%	0.235	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	154.4	174.3	-72.6	-113.5	0	0	0	111.7	G513 Q523 E524 C536 I537 K538	G513-Y526 VanDerWaalsContact CA-CE1 3.48Å; Q523-Y526 HydrophobicContact CB-CD2 3.84Å; Q523-Y526 HydrophobicContact CB-CE2 4.34Å; Q523-Y526 HydrophobicContact CB-CG 4.39Å; Q523-Y526 HydrophobicContact CG-CD2 4.46Å; Q523-Y526 WeakPolarHBondContact O-CB 3.33Å; Q523-Y526 PolarHBondContact O-N 3.28Å; E524-Y526 VanDerWaalsContact C-N 3.33Å; Y526-C536 HydrophobicContact CD1-CB 4.2Å; Y526-I537 CarbonylContact C-O 3.47Å; Y526-I537 WeakPolarHBondContact CA-O 3.48Å; Y526-I537 WeakPolarHBondContact CB-O 3.21Å; Y526-I537 WeakPolarHBondContact CD1-O 3.47Å; Y526-K538 HydrophobicContact CD1-CG 4.33Å; Y526-K538 HydrophobicContact CE1-CG 3.78Å; Y526-K538 HydrophobicContact CE2-CG 4Å; Y526-K538 WeakPolarHBondContact OH-CE 3.42Å
527	K	91.3	Very high	92.8	Very high	107 Å²	107	85.3 Å²	85.3	47%	0.465	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.8	175.5	-64.9	-63.8	-177.3	-175.2	0	110.2	C536 I537 A539 H542	K527-C536 WeakPolarHBondContact O-CA 3.47Å; K527-I537 PolarHBondContact N-O 3.03Å; K527-I537 PolarHBondContact O-N 3.27Å; K527-I537 VanDerWaalsContact O-N 3.07Å; K527-A539 HydrophobicContact CG-CB 3.98Å; K527-H542 HydrophobicContact CB-CB 4.27Å
528	Q	92.1	Very high	92.7	Very high	153 Å²	153	85.8 Å²	85.8	72%	0.715	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	134.3	180	-173.8	175.7	-5.4	0	0	110.8	P535	Q528-P535 CarbonylContact C-O 3.5Å; Q528-P535 WeakPolarHBondContact CA-O 3.43Å
529	T	89.7	Confident	92	Very high	23 Å²	23	85.7 Å²	85.7	14%	0.141	43%	0.428	C	S	.	.			trans	-106.2	172.2	176.4	79.5	0	0	0	0	111.2	L531 A534 P535 I537	T529-L531 VanDerWaalsContact C-N 3.29Å; T529-L531 PolarHBondContact OG1-N 3.43Å; T529-A534 PolarHBondContact OG1-O 2.79Å; T529-P535 PolarHBondContact N-O 2.86Å; T529-I537 HydrophobicContact CG2-CB 4.11Å; T529-I537 HydrophobicContact CG2-CD1 3.58Å; T529-I537 HydrophobicContact CG2-CG1 3.47Å; T529-I537 VanDerWaalsContact CG2-CG1 3.47Å; T529-I537 HydrophobicContact CG2-CG2 3.73Å
530	R	88.8	Confident	91.1	Very high	252 Å²	252	93.5 Å²	93.5	95%	0.951	47%	0.466	S	S	*	.	S	Bend	trans	-84.8	-0.1	170	-63	-178.6	-178	165.2	-0.3	113.2	P532	R530-P532 WeakPolarHBondContact O-CD 3.43Å
531	L	87.1	Confident	90.1	Very high	113 Å²	113	93.4 Å²	93.4	59%	0.592	46%	0.462	S	S	*	.			trans	-90.8	120	-175.1	-65.3	169.1	0	0	0	110.6	T529 D533 A534 P535	T529-L531 VanDerWaalsContact C-N 3.29Å; T529-L531 PolarHBondContact OG1-N 3.43Å; L531-D533 VanDerWaalsContact C-N 3.29Å; L531-D533 PolarHBondContact O-N 2.99Å; L531-A534 CarbonylContact O-C 3.34Å; L531-A534 PolarHBondContact O-N 2.68Å; L531-P535 WeakPolarHBondContact O-CA 3.26Å
532	P	89.3	Confident	88.8	Confident	82 Å²	82	87.2 Å²	87.2	53%	0.532	44%	0.441	S	S	.	.	S	Bend	trans	-61.5	-32.7	178.7	-25.4	35.2	0	0	0	114.2	K511 R530	K511-P532 PolarHBondContact NZ-O 3.15Å; R530-P532 WeakPolarHBondContact O-CD 3.43Å
533	D	88.7	Confident	87.6	Confident	148 Å²	148	91.8 Å²	91.8	79%	0.791	45%	0.454	S	S	*	.	S	Bend	trans	-78.3	-27.9	-177.7	-69	-29.2	0	0	0	113.3	L531	L531-D533 VanDerWaalsContact C-N 3.29Å; L531-D533 PolarHBondContact O-N 2.99Å
534	A	91.3	Very high	86.3	Confident	40 Å²	40	90 Å²	90	33%	0.331	46%	0.455	S	S	.	.	S	Bend	trans	-132	67	-179.9	0	0	0	0	0	110.6	T529 L531 C536 I537	T529-A534 PolarHBondContact OG1-O 2.79Å; L531-A534 CarbonylContact O-C 3.34Å; L531-A534 PolarHBondContact O-N 2.68Å; A534-C536 PolarHBondContact O-N 3.46Å; A534-I537 HydrophobicContact CB-CG2 4.39Å
535	P	93.7	Very high	84.8	Confident	10 Å²	10	87.1 Å²	87.1	7%	0.065	44%	0.441	C	S	.	.	S	Bend	trans	-67.8	-20.1	-170.2	27.9	-36.2	0	0	0	113.7	I493 K511 V514 Q528 T529 L531	I493-P535 HydrophobicContact CG2-CB 3.68Å; I493-P535 HydrophobicContact CG2-CG 4.14Å; K511-P535 HydrophobicContact CD-CG 4.12Å; V514-P535 HydrophobicContact CG2-CG 3.84Å; Q528-P535 CarbonylContact C-O 3.5Å; Q528-P535 WeakPolarHBondContact CA-O 3.43Å; T529-P535 PolarHBondContact N-O 2.86Å; L531-P535 WeakPolarHBondContact O-CA 3.26Å
536	C	94.7	Very high	83.4	Confident	12 Å²	12	91 Å²	91	8%	0.081	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.1	177	-63.5	0	0	0	0	109.3	G513 V514 C522 Y526 K527 A534	G513-C536 VanDerWaalsContact O-CB 3.3Å; G513-C536 WeakPolarHBondContact O-CB 3.27Å; V514-C536 HydrophobicContact CG2-CB 4.13Å; C522-C536 WeakPolarHBondContact CA-SG 3.16Å; C522-C536 HydrophobicContact CB-CB 3.79Å; C522-C536 WeakPolarHBondContact CB-SG 3.27Å; C522-C536 WeakPolarHBondContact SG-CB 3.45Å; C522-C536 CovalentContact SG-SG 2.04Å; C522-C536 PolarHBondContact SG-SG 2.79Å; Y526-C536 HydrophobicContact CD1-CB 4.2Å; K527-C536 WeakPolarHBondContact O-CA 3.47Å; A534-C536 PolarHBondContact O-N 3.46Å
537	I	92.7	Very high	81.7	Confident	29 Å²	29	98 Å²	98	15%	0.149	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	160.6	174.3	65.4	178.1	0	0	0	110.1	Y526 K527 T529 A534 E541 H542	Y526-I537 CarbonylContact C-O 3.47Å; Y526-I537 WeakPolarHBondContact CA-O 3.48Å; Y526-I537 WeakPolarHBondContact CB-O 3.21Å; Y526-I537 WeakPolarHBondContact CD1-O 3.47Å; K527-I537 PolarHBondContact N-O 3.03Å; K527-I537 PolarHBondContact O-N 3.27Å; K527-I537 VanDerWaalsContact O-N 3.07Å; T529-I537 HydrophobicContact CG2-CB 4.11Å; T529-I537 HydrophobicContact CG2-CD1 3.58Å; T529-I537 HydrophobicContact CG2-CG1 3.47Å; T529-I537 VanDerWaalsContact CG2-CG1 3.47Å; T529-I537 HydrophobicContact CG2-CG2 3.73Å; A534-I537 HydrophobicContact CB-CG2 4.39Å; I537-E541 HydrophobicContact CD1-CB 4.46Å; I537-H542 HydrophobicContact CD1-CB 3.77Å; I537-H542 HydrophobicContact CG1-CB 3.97Å
538	K	91	Very high	80	Confident	106 Å²	106	100.5 Å²	100.5	46%	0.461	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	141.4	178.7	-69.8	179.9	178.8	178	0	110	Y526 M540 E541 H542	Y526-K538 HydrophobicContact CD1-CG 4.33Å; Y526-K538 HydrophobicContact CE1-CG 3.78Å; Y526-K538 HydrophobicContact CE2-CG 4Å; Y526-K538 WeakPolarHBondContact OH-CE 3.42Å; K538-M540 PolarHBondContact O-N 3.46Å; K538-M540 VanDerWaalsContact O-N 3.14Å; K538-E541 HydrophobicContact CB-CG 4.4Å; K538-E541 WeakPolarHBondContact O-CB 3.39Å; K538-E541 PolarHBondContact O-N 2.93Å; K538-H542 PolarHBondContact O-N 3.36Å; K538-H542 VanDerWaalsContact O-N 3.09Å
539	A	82.5	Confident	78.1	Confident	23 Å²	23	100.5 Å²	100.5	19%	0.19	48%	0.477	C	S	.	.	H	α-helix	trans	-54.4	-39.1	-175.8	0	0	0	0	0	112.8	G525 K527 E541 H542 Y543	G525-A539 WeakPolarHBondContact O-CB 3.44Å; G525-A539 PolarHBondContact O-N 2.85Å; K527-A539 HydrophobicContact CG-CB 3.98Å; A539-E541 PolarHBondContact O-N 3.45Å; A539-H542 WeakPolarHBondContact O-CB 3.26Å; A539-H542 PolarHBondContact O-N 3.45Å; A539-Y543 HydrophobicContact CB-CE2 4.44Å; A539-Y543 WeakPolarHBondContact O-CD2 3.37Å; A539-Y543 PolarHBondContact O-N 2.86Å; A539-Y543 VanDerWaalsContact O-N 3.14Å
540	M	77.7	Confident	76.2	Confident	166 Å²	166	105.8 Å²	105.8	82%	0.818	50%	0.504	S	S	*	.	H	α-helix	trans	-59.6	-42.3	177	-68	-179.5	167.3	0	0	112.9	K538 Y543 A544	K538-M540 PolarHBondContact O-N 3.46Å; K538-M540 VanDerWaalsContact O-N 3.14Å; M540-Y543 PolarHBondContact O-N 2.82Å; M540-A544 PolarHBondContact O-N 3.48Å
541	E	74.4	Confident	74.4	Confident	99 Å²	99	100.8 Å²	100.8	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-38.7	176.6	-66.4	167.7	179.2	0	0	111	I537 K538 A539 Y543 A544 H545	I537-E541 HydrophobicContact CD1-CB 4.46Å; K538-E541 HydrophobicContact CB-CG 4.4Å; K538-E541 WeakPolarHBondContact O-CB 3.39Å; K538-E541 PolarHBondContact O-N 2.93Å; A539-E541 PolarHBondContact O-N 3.45Å; E541-Y543 VanDerWaalsContact C-N 3.3Å; E541-Y543 PolarHBondContact O-N 3.35Å; E541-A544 PolarHBondContact O-N 2.84Å; E541-A544 VanDerWaalsContact O-N 3.16Å; E541-H545 PolarHBondContact O-CD2 2.81Å; E541-H545 VanDerWaalsContact O-CD2 3.3Å; E541-H545 PolarHBondContact O-N 3.07Å
542	H	68	Low	72.6	Confident	37 Å²	37	103.3 Å²	103.3	17%	0.171	51%	0.505	C	S	.	.	H	α-helix	trans	-61.3	-36.2	177.5	-169.4	-69.5	0	0	0	112.7	K527 I537 K538 A539 R546	K527-H542 HydrophobicContact CB-CB 4.27Å; I537-H542 HydrophobicContact CD1-CB 3.77Å; I537-H542 HydrophobicContact CG1-CB 3.97Å; K538-H542 PolarHBondContact O-N 3.36Å; K538-H542 VanDerWaalsContact O-N 3.09Å; A539-H542 WeakPolarHBondContact O-CB 3.26Å; A539-H542 PolarHBondContact O-N 3.45Å; H542-R546 PolarHBondContact O-N 2.84Å
543	Y	70.2	Confident	70.2	Confident	131 Å²	131	105.6 Å²	105.6	51%	0.514	52%	0.518	S	S	.	.	H	α-helix	trans	-73.8	-34.6	175.1	-70.6	-70.8	0	0	0	112.5	A539 M540 E541 R546 R547	A539-Y543 HydrophobicContact CB-CE2 4.44Å; A539-Y543 WeakPolarHBondContact O-CD2 3.37Å; A539-Y543 PolarHBondContact O-N 2.86Å; A539-Y543 VanDerWaalsContact O-N 3.14Å; M540-Y543 PolarHBondContact O-N 2.82Å; E541-Y543 VanDerWaalsContact C-N 3.3Å; E541-Y543 PolarHBondContact O-N 3.35Å; Y543-R546 PolarHBondContact O-N 3.39Å; Y543-R547 PolarHBondContact O-N 3.47Å; Y543-R547 VanDerWaalsContact O-N 3.15Å
544	A	69.2	Low	67.8	Low	56 Å²	56	103.2 Å²	103.2	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-40.4	175.5	0	0	0	0	0	112.3	M540 E541 R547 K548	M540-A544 PolarHBondContact O-N 3.48Å; E541-A544 PolarHBondContact O-N 2.84Å; E541-A544 VanDerWaalsContact O-N 3.16Å; A544-R547 PolarHBondContact O-N 2.92Å; A544-K548 PolarHBondContact O-N 2.86Å
545	H	61.8	Low	65.5	Low	130 Å²	130	109.8 Å²	109.8	60%	0.602	54%	0.536	S	S	*	.	H	α-helix	trans	-66.3	-40.5	176	-81.9	-71.6	0	0	0	112.7	E541 R547 K548	E541-H545 PolarHBondContact O-CD2 2.81Å; E541-H545 VanDerWaalsContact O-CD2 3.3Å; E541-H545 PolarHBondContact O-N 3.07Å; H545-R547 VanDerWaalsContact C-N 3.34Å; H545-R547 PolarHBondContact O-N 2.88Å; H545-K548 PolarHBondContact O-N 3.12Å
546	R	62.6	Low	62.6	Low	134 Å²	134	114.9 Å²	114.9	51%	0.506	57%	0.572	S	S	.	*	H	α-helix	trans	-66.2	-31	175.8	-90.7	-160.1	-75.1	-163.1	-5.3	114	H542 Y543	H542-R546 PolarHBondContact O-N 2.84Å; Y543-R546 PolarHBondContact O-N 3.39Å
547	R	58.1	Low	59.8	Low	206 Å²	206	120.3 Å²	120.3	78%	0.777	61%	0.605	S	S	*	*	H	α-helix	trans	-67.4	-34.2	175.4	-86	-172.5	-179.7	157.9	-0	112.8	Y543 A544 H545 N550	Y543-R547 PolarHBondContact O-N 3.47Å; Y543-R547 VanDerWaalsContact O-N 3.15Å; A544-R547 PolarHBondContact O-N 2.92Å; H545-R547 VanDerWaalsContact C-N 3.34Å; H545-R547 PolarHBondContact O-N 2.88Å; R547-N550 PolarHBondContact O-N 3.35Å
548	K	56.1	Low	57	Low	160 Å²	160	129.1 Å²	129.1	70%	0.696	64%	0.642	S	S	*	*	H	α-helix	trans	-73.9	-25.1	180	-74.1	-173.2	176.3	-176.7	0	114.2	A544 H545	A544-K548 PolarHBondContact O-N 2.86Å; H545-K548 PolarHBondContact O-N 3.12Å
549	E	53.6	Low	54.3	Low	153 Å²	153	129.4 Å²	129.4	72%	0.715	66%	0.658	S	S	*	*	H	α-helix	trans	-75.1	-23.3	174.8	-84.4	-178.2	151.2	0	0	113.2
550	N	48.1	Very low	52.1	Low	134 Å²	134	137.1 Å²	137.1	72%	0.717	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-10.8	-178.5	-86.4	2.8	0	0	0	114.8	R547	R547-N550 PolarHBondContact O-N 3.35Å
551	D	52	Low	49.9	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	6.6	-177.7	-99.3	-15.5	0	0	0	114.2
552	Q	48.6	Very low	47.9	Very low	166 Å²	166	137.8 Å²	137.8	78%	0.776	71%	0.708	S	S	*	*			trans	-111.8	22.7	-174.6	-71.3	-172.4	-10.9	0	0	115.2	S554	Q552-S554 VanDerWaalsContact C-N 3.31Å; Q552-S554 PolarHBondContact O-N 3.48Å; Q552-S554 VanDerWaalsContact O-N 3.13Å
553	T	39.9	Very low	46.3	Very low	131 Å²	131	144.2 Å²	144.2	80%	0.804	74%	0.735	S	S	*	*			trans	-84.6	55.7	173.8	50	0	0	0	0	113.3
554	S	37.4	Very low	44.6	Very low	98 Å²	98	142.9 Å²	142.9	69%	0.685	74%	0.743	S	S	*	*	S	Bend	trans	-176.3	78.4	163	55.6	0	0	0	0	111.7	Q552	Q552-S554 VanDerWaalsContact C-N 3.31Å; Q552-S554 PolarHBondContact O-N 3.48Å; Q552-S554 VanDerWaalsContact O-N 3.13Å
555	H	43.1	Very low	43.1	Very low	178 Å²	178	149.1 Å²	149.1	82%	0.824	76%	0.762	S	S	*	*			trans	174	114.3	131.1	-94.9	-52.6	0	0	0	110.1	T557	H555-T557 PolarHBondContact O-N 3.1Å
556	S	31.9	Very low	41.9	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	77%	0.768	S	S	*	*			trans	-65.9	108.4	162	175.9	0	0	0	0	109.1
557	T	37.4	Very low	41.1	Very low	127 Å²	127	149.3 Å²	149.3	78%	0.779	78%	0.782	S	S	*	*			trans	-142.1	112	152.2	15.2	0	0	0	0	108.3	H555 S559	H555-T557 PolarHBondContact O-N 3.1Å; T557-S559 PolarHBondContact O-N 3.08Å
558	K	32.8	Very low	41.2	Very low	213 Å²	213	142.8 Å²	142.8	93%	0.926	76%	0.762	S	S	*	*			trans	-41.7	101.9	169	-76.6	168.9	170.2	171.3	0	110.9
559	S	35.5	Very low	41.6	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	77%	0.765	S	S	*	*			trans	-105.8	116.9	156	79.7	0	0	0	0	108.1	T557	T557-S559 PolarHBondContact O-N 3.08Å
560	Q	36.3	Very low	42.2	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	75%	0.746	S	S	*	*			trans	-52.9	136.3	-174.7	-64.4	176.9	-9.7	0	0	112.3	S562	Q560-S562 PolarHBondContact O-N 3.01Å
561	L	30.3	Very low	43.3	Very low	167 Å²	167	132.8 Å²	132.8	87%	0.874	73%	0.727	S	S	*	*			trans	-50.1	94.4	164.8	-173.6	71.1	0	0	0	110.5	K563	L561-K563 PolarHBondContact O-N 2.86Å
562	S	33.7	Very low	44.1	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	72%	0.722	S	S	*	*			trans	-72.1	107.4	163.5	56.4	0	0	0	0	107.8	Q560	Q560-S562 PolarHBondContact O-N 3.01Å
563	K	34.6	Very low	45.3	Very low	172 Å²	172	124.8 Å²	124.8	75%	0.748	70%	0.698	S	S	*	*			trans	-40.5	150.1	165.4	-74	171	175.3	173.5	0	110.7	L561 E565	L561-K563 PolarHBondContact O-N 2.86Å; K563-E565 PolarHBondContact O-N 2.86Å
564	P	33.4	Very low	46.8	Very low	104 Å²	104	127 Å²	127	68%	0.675	70%	0.699	S	S	*	*			trans	-56.4	122.7	166.1	26.5	-30.6	0	0	0	106.4	T566	P564-T566 HydrophobicContact CB-CG2 4.36Å; P564-T566 HydrophobicContact CG-CG2 4.28Å; P564-T566 PolarHBondContact O-N 2.76Å
565	E	37	Very low	47.8	Very low	187 Å²	187	132.5 Å²	132.5	87%	0.874	71%	0.705	S	S	*	*			trans	-63.1	82.2	176	-76	-176.7	156.3	0	0	109.1	K563 N567	K563-E565 PolarHBondContact O-N 2.86Å; E565-N567 VanDerWaalsContact C-N 3.28Å; E565-N567 PolarHBondContact O-N 3.31Å
566	T	38.4	Very low	48.5	Very low	117 Å²	117	126.5 Å²	126.5	72%	0.718	68%	0.682	S	S	*	*			trans	-86.8	69.5	171	54.1	0	0	0	0	108.2	P564	P564-T566 HydrophobicContact CB-CG2 4.36Å; P564-T566 HydrophobicContact CG-CG2 4.28Å; P564-T566 PolarHBondContact O-N 2.76Å
567	N	45.5	Very low	49.6	Very low	151 Å²	151	130.6 Å²	130.6	81%	0.807	69%	0.686	S	S	*	*			trans	174.1	82.7	151	-105.6	-18.9	0	0	0	108.9	E565 D569	E565-N567 VanDerWaalsContact C-N 3.28Å; E565-N567 PolarHBondContact O-N 3.31Å; N567-D569 PolarHBondContact O-N 2.99Å; N567-D569 VanDerWaalsContact O-N 3.12Å
568	I	59.1	Low	50.7	Low	68 Å²	68	130 Å²	130	35%	0.349	67%	0.672	S	S	.	*			trans	-73.5	100.2	159.3	-61.2	171	0	0	0	105.4	C570	I568-C570 VanDerWaalsContact C-N 3.29Å; I568-C570 PolarHBondContact O-N 2.82Å
569	D	64.2	Low	52.6	Low	141 Å²	141	128.2 Å²	128.2	75%	0.754	66%	0.66	S	S	*	*			trans	-76	85.5	179.1	-145.9	7.3	0	0	0	108.6	N567	N567-D569 PolarHBondContact O-N 2.99Å; N567-D569 VanDerWaalsContact O-N 3.12Å
570	C	66.4	Low	54.7	Low	47 Å²	47	123.2 Å²	123.2	32%	0.318	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-63.1	133.4	-178.6	-71.8	0	0	0	0	110.4	I568 C655	I568-C570 VanDerWaalsContact C-N 3.29Å; I568-C570 PolarHBondContact O-N 2.82Å; C570-C655 WeakPolarHBondContact CA-SG 3.49Å; C570-C655 HydrophobicContact CB-CB 3.72Å; C570-C655 WeakPolarHBondContact CB-SG 3.23Å; C570-C655 VanDerWaalsContact SG-CA 3.55Å; C570-C655 WeakPolarHBondContact SG-CB 3.37Å; C570-C655 CovalentContact SG-SG 2.04Å; C570-C655 PolarHBondContact SG-SG 3.43Å
571	P	71.1	Confident	57.1	Low	49 Å²	49	122 Å²	122	32%	0.318	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-56.3	136.5	172.7	22.9	-31.9	0	0	0	109.4	C573	P571-C573 PolarHBondContact O-N 3.19Å
572	P	69.3	Low	59.9	Low	107 Å²	107	115.2 Å²	115.2	70%	0.695	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-58	128.9	-175.3	20.6	-31.1	0	0	0	110.1	E574 N646	P572-E574 PolarHBondContact O-N 2.99Å; P572-N646 PolarHBondContact O-ND2 2.84Å
573	C	74.6	Confident	62.5	Low	38 Å²	38	114.1 Å²	114.1	26%	0.257	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-50.2	133.6	171	-65.9	0	0	0	0	109.2	P571 R575 N646 C657	P571-C573 PolarHBondContact O-N 3.19Å; C573-R575 PolarHBondContact O-N 3.46Å; C573-N646 WeakPolarHBondContact CA-ND2 3.33Å; C573-C657 WeakPolarHBondContact CA-SG 3.28Å; C573-C657 HydrophobicContact CB-CB 3.91Å; C573-C657 WeakPolarHBondContact CB-SG 3.05Å; C573-C657 VanDerWaalsContact SG-CA 3.51Å; C573-C657 WeakPolarHBondContact SG-CB 3.18Å; C573-C657 CovalentContact SG-SG 2.04Å; C573-C657 PolarHBondContact SG-SG 3.12Å
574	E	70.3	Confident	65	Low	178 Å²	178	107.7 Å²	107.7	83%	0.832	53%	0.528	S	S	*	.			trans	-48.8	111.5	-179.1	-166.6	-176.4	175.6	0	0	109	P572 S576	P572-E574 PolarHBondContact O-N 2.99Å; E574-S576 PolarHBondContact O-N 3.39Å
575	R	59.3	Low	67.8	Low	214 Å²	214	103 Å²	103	81%	0.808	50%	0.497	S	S	*	.			trans	-66	107.8	-175.7	-73.6	-176.3	179.5	171.5	2	106.1	C573 K577	C573-R575 PolarHBondContact O-N 3.46Å; R575-K577 PolarHBondContact O-N 3.38Å
576	S	57.4	Low	70.3	Confident	51 Å²	51	94.9 Å²	94.9	36%	0.357	46%	0.461	S	S	.	.			trans	-61.1	92.3	168.1	61.4	0	0	0	0	108.2	E574 K578 L692	E574-S576 PolarHBondContact O-N 3.39Å; S576-K578 PolarHBondContact O-N 2.84Å; S576-L692 WeakPolarHBondContact OG-CD2 3.47Å
577	K	54.4	Low	72.7	Confident	203 Å²	203	96.4 Å²	96.4	88%	0.883	45%	0.454	S	S	*	.			trans	-68.4	67	175.4	-73.3	-177.6	-179.1	175.1	0	108.3	R575	R575-K577 PolarHBondContact O-N 3.38Å
578	K	62.3	Low	74.7	Confident	113 Å²	113	89.8 Å²	89.8	49%	0.491	42%	0.418	S	S	.	.			trans	-119	85.7	-171.6	-67.1	-173.7	-179	178.2	0	109.3	S576 I580 V690	S576-K578 PolarHBondContact O-N 2.84Å; K578-I580 PolarHBondContact O-N 3.35Å; K578-V690 HydrophobicContact CD-CG2 4.11Å
579	R	70.9	Confident	76.1	Confident	177 Å²	177	89.2 Å²	89.2	67%	0.668	41%	0.414	S	S	*	.			trans	-49	126.2	165.3	-174	178.2	-174.6	-168.2	-0.6	108.8	R581	R579-R581 PolarHBondContact O-N 3.03Å
580	I	79.9	Confident	77.4	Confident	7 Å²	7	82.5 Å²	82.5	4%	0.036	38%	0.378	C	S	.	.			trans	-74.5	98.2	-178.4	-47.7	169.3	0	0	0	108.6	K578 L667 I669 W698 R701 L702 F705	K578-I580 PolarHBondContact O-N 3.35Å; I580-L667 HydrophobicContact CD1-CD2 3.39Å; I580-I669 HydrophobicContact CD1-CD1 4.28Å; I580-I669 HydrophobicContact CG1-CD1 4.09Å; I580-I669 HydrophobicContact CG2-CD1 4.05Å; I580-W698 HydrophobicContact CD1-CB 4.49Å; I580-W698 HydrophobicContact CD1-CD2 3.65Å; I580-W698 HydrophobicContact CD1-CE3 4.23Å; I580-W698 HydrophobicContact CD1-CG 3.78Å; I580-W698 HydrophobicContact CD1-CZ2 4.34Å; I580-R701 VanDerWaalsContact O-CZ 3.22Å; I580-R701 PolarHBondContact O-NE 2.82Å; I580-R701 PolarHBondContact O-NH2 3.27Å; I580-L702 HydrophobicContact CG2-CD2 4.25Å; I580-F705 HydrophobicContact CG2-CE2 3.95Å; I580-F705 WeakPolarHBondContact O-CZ 3.44Å
581	R	87.5	Confident	78.7	Confident	160 Å²	160	80.3 Å²	80.3	60%	0.604	36%	0.363	S	S	*	.			trans	-92.3	155.9	174.1	-63.4	-172.8	-177.7	-134.3	5.1	110.3	R579 K583 K584 F585	R579-R581 PolarHBondContact O-N 3.03Å; R581-K583 VanDerWaalsContact C-N 3.32Å; R581-K583 PolarHBondContact O-N 3.38Å; R581-K584 WeakPolarHBondContact O-CB 3.46Å; R581-K584 PolarHBondContact O-N 2.69Å; R581-K584 VanDerWaalsContact O-N 3.1Å; R581-F585 PolarHBondContact O-N 2.65Å; R581-F585 VanDerWaalsContact O-N 3.16Å
582	F	89.3	Confident	79.8	Confident	24 Å²	24	78 Å²	78	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-41.5	179.4	-178.1	-116.9	0	0	0	112.4	K584 F585 C586 F705 R708 A709	F582-K584 VanDerWaalsContact C-N 3.27Å; F582-K584 PolarHBondContact O-N 2.96Å; F582-F585 HydrophobicContact CD2-CD1 4.23Å; F582-F585 HydrophobicContact CE2-CD1 4.11Å; F582-F585 WeakPolarHBondContact O-CA 3.39Å; F582-F585 VanDerWaalsContact O-CB 3.29Å; F582-F585 WeakPolarHBondContact O-CB 3.25Å; F582-F585 PolarHBondContact O-N 3.06Å; F582-C586 VanDerWaalsContact CZ-SG 3.56Å; F582-C586 PolarHBondContact O-N 3.16Å; F582-F705 HydrophobicContact CB-CD1 3.97Å; F582-F705 HydrophobicContact CB-CE1 3.8Å; F582-F705 HydrophobicContact CB-CG 4.5Å; F582-F705 HydrophobicContact CB-CZ 4.17Å; F582-F705 HydrophobicContact CD2-CB 3.77Å; F582-F705 AromaticContact CD2-CD1 3.62Å; F582-F705 HydrophobicContact CD2-CD1 3.62Å; F582-F705 HydrophobicContact CD2-CE1 4.33Å; F582-F705 AromaticContact CD2-CG 3.74Å; F582-F705 HydrophobicContact CD2-CG 3.74Å; F582-F705 HydrophobicContact CE2-CB 4.15Å; F582-F705 WeakPolarHBondContact CE2-O 3.43Å; F582-F705 HydrophobicContact CG-CD1 4.22Å; F582-R708 HydrophobicContact CD1-CG 4.41Å; F582-R708 HydrophobicContact CD2-CB 4.33Å; F582-R708 HydrophobicContact CD2-CG 4.42Å; F582-R708 HydrophobicContact CE1-CG 3.87Å; F582-R708 HydrophobicContact CE2-CB 3.75Å; F582-R708 HydrophobicContact CE2-CG 3.9Å; F582-R708 HydrophobicContact CZ-CB 3.9Å; F582-R708 HydrophobicContact CZ-CG 3.59Å; F582-A709 HydrophobicContact CE2-CB 4.14Å; F582-A709 HydrophobicContact CZ-CB 4.17Å
583	K	87.7	Confident	81	Confident	88 Å²	88	74.7 Å²	74.7	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-54.4	-39.6	173.9	-171.2	165.4	-177.6	155.5	0	113.1	R581 C586 R587 E717	R581-K583 VanDerWaalsContact C-N 3.32Å; R581-K583 PolarHBondContact O-N 3.38Å; K583-C586 PolarHBondContact O-N 3.15Å; K583-R587 VanDerWaalsContact CE-CZ 3.4Å; K583-R587 WeakPolarHBondContact O-CB 3.23Å; K583-R587 VanDerWaalsContact O-CG 3.24Å; K583-R587 WeakPolarHBondContact O-CG 3.41Å; K583-R587 PolarHBondContact O-N 2.77Å; K583-R587 VanDerWaalsContact O-N 3.07Å; K583-E717 VanDerWaalsContact CD-OE2 3.25Å; K583-E717 WeakPolarHBondContact CD-OE2 3.41Å; K583-E717 WeakPolarHBondContact CE-OE2 3.47Å; K583-E717 IonicContact NZ-OE1 2.79Å; K583-E717 PolarHBondContact NZ-OE1 3.06Å; K583-E717 IonicContact NZ-OE2 3.66Å; K583-E717 PolarHBondContact NZ-OE2 3.06Å
584	K	87.9	Confident	81.9	Confident	38 Å²	38	72.9 Å²	72.9	17%	0.165	31%	0.31	C	S	.	.	H	α-helix	trans	-70.9	-37.1	175.6	-169.2	178.2	-179.6	-172.1	0	111.9	R581 F582 N588 I669	R581-K584 WeakPolarHBondContact O-CB 3.46Å; R581-K584 PolarHBondContact O-N 2.69Å; R581-K584 VanDerWaalsContact O-N 3.1Å; F582-K584 VanDerWaalsContact C-N 3.27Å; F582-K584 PolarHBondContact O-N 2.96Å; K584-N588 PolarHBondContact O-OD1 3.13Å; K584-I669 HydrophobicContact CG-CG2 4.31Å
585	F	91	Very high	83.1	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-42.6	173.7	171.2	-91.4	0	0	0	112	R581 F582 V591 W616 R617 L702 F705 V706 A709	R581-F585 PolarHBondContact O-N 2.65Å; R581-F585 VanDerWaalsContact O-N 3.16Å; F582-F585 HydrophobicContact CD2-CD1 4.23Å; F582-F585 HydrophobicContact CE2-CD1 4.11Å; F582-F585 WeakPolarHBondContact O-CA 3.39Å; F582-F585 VanDerWaalsContact O-CB 3.29Å; F582-F585 WeakPolarHBondContact O-CB 3.25Å; F582-F585 PolarHBondContact O-N 3.06Å; F585-V591 HydrophobicContact CD2-CB 4.16Å; F585-V591 HydrophobicContact CD2-CG1 4.1Å; F585-V591 HydrophobicContact CD2-CG2 3.9Å; F585-V591 HydrophobicContact CE2-CB 4.12Å; F585-V591 HydrophobicContact CE2-CG1 4.26Å; F585-V591 HydrophobicContact CE2-CG2 4.24Å; F585-W616 HydrophobicContact CE2-CB 3.82Å; F585-W616 HydrophobicContact CZ-CB 4.39Å; F585-R617 HydrophobicContact CE2-CB 3.9Å; F585-R617 HydrophobicContact CZ-CB 3.83Å; F585-R617 WeakPolarHBondContact O-CD 3.14Å; F585-L702 HydrophobicContact CD2-CD2 4.2Å; F585-F705 HydrophobicContact CB-CB 4.43Å; F585-F705 HydrophobicContact CB-CD2 3.78Å; F585-F705 HydrophobicContact CB-CE2 4.44Å; F585-F705 HydrophobicContact CB-CG 4.42Å; F585-F705 HydrophobicContact CD1-CB 3.81Å; F585-F705 HydrophobicContact CD2-CB 4.14Å; F585-F705 HydrophobicContact CD2-CD2 4.29Å; F585-F705 HydrophobicContact CE1-CB 4.04Å; F585-F705 HydrophobicContact CE2-CB 4.36Å; F585-F705 HydrophobicContact CG-CB 3.86Å; F585-F705 HydrophobicContact CG-CD2 4.02Å; F585-F705 HydrophobicContact CG-CG 4.35Å; F585-F705 HydrophobicContact CZ-CB 4.31Å; F585-V706 HydrophobicContact CE2-CG2 4.47Å; F585-V706 HydrophobicContact CZ-CG2 3.96Å; F585-A709 HydrophobicContact CE1-CB 4.1Å
586	C	89.9	Confident	84.7	Confident	18 Å²	18	56 Å²	56	12%	0.122	24%	0.241	C	C	.	.	H	α-helix	trans	-73.5	-33.7	178.9	-75.5	0	0	0	0	114.1	F582 K583 N588 R617 C714	F582-C586 VanDerWaalsContact CZ-SG 3.56Å; F582-C586 PolarHBondContact O-N 3.16Å; K583-C586 PolarHBondContact O-N 3.15Å; C586-N588 VanDerWaalsContact C-N 3.26Å; C586-N588 PolarHBondContact O-N 3.14Å; C586-R617 PolarHBondContact O-NH2 3.35Å; C586-C714 HydrophobicContact CB-CB 3.52Å; C586-C714 WeakPolarHBondContact CB-SG 3.21Å; C586-C714 VanDerWaalsContact SG-CA 3.56Å; C586-C714 WeakPolarHBondContact SG-CB 3Å; C586-C714 CovalentContact SG-SG 2.05Å; C586-C714 PolarHBondContact SG-SG 3.2Å
587	R	88	Confident	86.4	Confident	149 Å²	149	59.5 Å²	59.5	56%	0.562	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-10.2	-178.8	-77.5	176.5	175.2	-165.7	-7.4	115.1	K583 R671	K583-R587 VanDerWaalsContact CE-CZ 3.4Å; K583-R587 WeakPolarHBondContact O-CB 3.23Å; K583-R587 VanDerWaalsContact O-CG 3.24Å; K583-R587 WeakPolarHBondContact O-CG 3.41Å; K583-R587 PolarHBondContact O-N 2.77Å; K583-R587 VanDerWaalsContact O-N 3.07Å; R587-R671 PolarHBondContact O-NE 2.75Å; R587-R671 VanDerWaalsContact O-NE 3.11Å; R587-R671 PolarHBondContact O-NH2 2.86Å
588	N	89.1	Confident	88.2	Confident	11 Å²	11	51.6 Å²	51.6	6%	0.059	22%	0.22	C	C	.	.			trans	-108.2	144.2	-177.9	-80	89.4	0	0	0	109.4	K584 C586 V591 R617 I669 T670 R671	K584-N588 PolarHBondContact O-OD1 3.13Å; C586-N588 VanDerWaalsContact C-N 3.26Å; C586-N588 PolarHBondContact O-N 3.14Å; N588-V591 HydrophobicContact CB-CG2 4.42Å; N588-R617 WeakPolarHBondContact O-CD 3.46Å; N588-R617 PolarHBondContact O-NE 3.41Å; N588-I669 HydrophobicContact CB-CG2 3.82Å; N588-I669 VanDerWaalsContact CG-CG2 3.49Å; N588-I669 PolarHBondContact ND2-O 3.37Å; N588-T670 WeakPolarHBondContact CB-O 3.13Å; N588-T670 PolarHBondContact ND2-N 3.46Å; N588-T670 PolarHBondContact ND2-O 2.9Å; N588-R671 PolarHBondContact ND2-N 2.87Å
589	E	88	Confident	89.6	Confident	57 Å²	57	51.9 Å²	51.9	27%	0.266	22%	0.218	S	C	.	.	S	Bend	trans	-81.7	-37.5	-174.5	-70.4	-175.9	146	0	0	112.2	I618 T619 T670 S672	E589-I618 CarbonylContact O-C 3.58Å; E589-I618 WeakPolarHBondContact O-CA 3.44Å; E589-T619 WeakPolarHBondContact CA-OG1 3.39Å; E589-T619 WeakPolarHBondContact CB-O 3.42Å; E589-T619 PolarHBondContact O-N 2.91Å; E589-T619 PolarHBondContact O-OG1 2.79Å; E589-T670 PolarHBondContact N-O 2.04Å; E589-S672 PolarHBondContact OE2-N 3.5Å; E589-S672 VanDerWaalsContact OE2-N 3.09Å; E589-S672 VanDerWaalsContact OE2-O 3.11Å; E589-S672 PolarHBondContact OE2-OG 2.75Å
590	A	91.1	Very high	90.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.6	-179.3	0	0	0	0	0	111.4	F592 R617 I618 A622 L626 T670	A590-F592 HydrophobicContact CB-CD1 4.03Å; A590-F592 HydrophobicContact CB-CE1 4.08Å; A590-R617 CarbonylContact C-O 3.57Å; A590-R617 VanDerWaalsContact CA-O 3.3Å; A590-R617 WeakPolarHBondContact CA-O 3.16Å; A590-I618 HydrophobicContact CB-CD1 3.96Å; A590-A622 HydrophobicContact CB-CB 3.67Å; A590-L626 HydrophobicContact CB-CD1 4.19Å; A590-T670 PolarHBondContact N-O 3.35Å; A590-T670 PolarHBondContact O-N 3.06Å; A590-T670 PolarHBondContact O-OG1 3.23Å
591	V	94.4	Very high	90.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	105.4	173.5	-175	0	0	0	0	109	F585 N588 W616 R617 L667 F668 I669 L702	F585-V591 HydrophobicContact CD2-CB 4.16Å; F585-V591 HydrophobicContact CD2-CG1 4.1Å; F585-V591 HydrophobicContact CD2-CG2 3.9Å; F585-V591 HydrophobicContact CE2-CB 4.12Å; F585-V591 HydrophobicContact CE2-CG1 4.26Å; F585-V591 HydrophobicContact CE2-CG2 4.24Å; N588-V591 HydrophobicContact CB-CG2 4.42Å; V591-W616 HydrophobicContact CG1-CE3 4.42Å; V591-W616 PolarHBondContact O-N 2.85Å; V591-R617 HydrophobicContact CB-CB 4.06Å; V591-R617 HydrophobicContact CG2-CB 4.17Å; V591-R617 PolarHBondContact N-O 2.86Å; V591-R617 PolarHBondContact O-N 2.79Å; V591-L667 HydrophobicContact CG1-CD1 4.23Å; V591-F668 VanDerWaalsContact CA-O 3.3Å; V591-F668 WeakPolarHBondContact CA-O 3.38Å; V591-I669 HydrophobicContact CG1-CG1 4.17Å; V591-I669 HydrophobicContact CG2-CG2 4.28Å; V591-L702 HydrophobicContact CG1-CD2 3.99Å
592	F	94.1	Very high	90.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	157.4	-174.6	65.1	-85.3	0	0	0	112.1	A590 V610 I612 N614 T615 I618 L626 F668	A590-F592 HydrophobicContact CB-CD1 4.03Å; A590-F592 HydrophobicContact CB-CE1 4.08Å; F592-V610 HydrophobicContact CE2-CG1 4.38Å; F592-I612 HydrophobicContact CD2-CG1 4.3Å; F592-N614 CarbonylContact C-O 3.58Å; F592-N614 VanDerWaalsContact CA-O 3.27Å; F592-N614 WeakPolarHBondContact CA-O 3.49Å; F592-N614 WeakPolarHBondContact CB-O 3.45Å; F592-T615 HydrophobicContact CB-CG2 4.05Å; F592-I618 HydrophobicContact CD1-CD1 4.32Å; F592-L626 HydrophobicContact CD1-CD1 3.82Å; F592-L626 HydrophobicContact CE1-CD1 3.41Å; F592-L626 VanDerWaalsContact CE1-CD1 3.41Å; F592-L626 HydrophobicContact CZ-CD1 3.86Å; F592-F668 HydrophobicContact CD1-CB 3.97Å; F592-F668 HydrophobicContact CD2-CB 4.14Å; F592-F668 AromaticContact CD2-CD2 3.95Å; F592-F668 HydrophobicContact CD2-CD2 3.95Å; F592-F668 HydrophobicContact CD2-CG 4.28Å; F592-F668 HydrophobicContact CE1-CB 3.57Å; F592-F668 HydrophobicContact CE1-CG 4.23Å; F592-F668 HydrophobicContact CE2-CB 3.76Å; F592-F668 HydrophobicContact CE2-CD1 4.36Å; F592-F668 AromaticContact CE2-CD2 3.49Å; F592-F668 HydrophobicContact CE2-CD2 3.49Å; F592-F668 VanDerWaalsContact CE2-CD2 3.49Å; F592-F668 HydrophobicContact CE2-CE2 4.17Å; F592-F668 AromaticContact CE2-CG 3.62Å; F592-F668 HydrophobicContact CE2-CG 3.62Å; F592-F668 HydrophobicContact CG-CB 4.24Å; F592-F668 HydrophobicContact CZ-CB 3.46Å; F592-F668 VanDerWaalsContact CZ-CB 3.46Å; F592-F668 HydrophobicContact CZ-CD1 4.09Å; F592-F668 AromaticContact CZ-CD2 3.99Å; F592-F668 HydrophobicContact CZ-CD2 3.99Å; F592-F668 AromaticContact CZ-CG 3.59Å; F592-F668 HydrophobicContact CZ-CG 3.59Å; F592-F668 PolarHBondContact N-O 2.84Å; F592-F668 PolarHBondContact O-N 2.85Å
593	R	94.8	Very high	90.4	Very high	37 Å²	37	48.4 Å²	48.4	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	132.3	172.4	177.7	-170.6	175.4	-159.9	-0.4	108.3	Q613 N614 W616 S665 Y666 W694	R593-Q613 HydrophobicContact CG-CB 4.22Å; R593-Q613 PolarHBondContact O-N 3.06Å; R593-N614 HydrophobicContact CB-CB 4.21Å; R593-N614 WeakPolarHBondContact CD-OD1 3.33Å; R593-N614 PolarHBondContact N-O 3.25Å; R593-N614 PolarHBondContact NH1-OD1 3.32Å; R593-N614 PolarHBondContact O-N 3.06Å; R593-W616 HydrophobicContact CB-CH2 3.83Å; R593-W616 HydrophobicContact CB-CZ3 3.71Å; R593-S665 WeakPolarHBondContact CG-OG 3.41Å; R593-S665 PolarHBondContact NE-OG 2.73Å; R593-Y666 WeakPolarHBondContact CA-O 3.42Å; R593-W694 HydrophobicContact CB-CE3 4.21Å; R593-W694 HydrophobicContact CB-CZ3 4.24Å; R593-W694 HydrophobicContact CG-CD2 4.01Å; R593-W694 HydrophobicContact CG-CE3 3.86Å; R593-W694 HydrophobicContact CG-CG 4.43Å; R593-W694 HydrophobicContact CG-CZ3 4.32Å
594	G	93.5	Very high	90.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.9	176.8	0	0	0	0	0	112.7	G611 S665 Y666	G594-G611 CarbonylContact C-O 3.59Å; G594-G611 VanDerWaalsContact CA-O 3.26Å; G594-G611 WeakPolarHBondContact CA-O 3.38Å; G594-S665 CarbonylContact O-C 3.57Å; G594-S665 WeakPolarHBondContact O-CA 3.48Å; G594-S665 PolarHBondContact O-OG 3.47Å; G594-Y666 PolarHBondContact N-O 2.86Å; G594-Y666 PolarHBondContact O-N 2.8Å
595	I	94.7	Very high	90.3	Very high	37 Å²	37	51.3 Å²	51.3	19%	0.19	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.6	171.1	-62.3	170.5	0	0	0	107.5	K597 V610 G611 Q613 Q664	I595-K597 PolarHBondContact O-N 2.77Å; I595-V610 CarbonylContact O-C 3.55Å; I595-V610 WeakPolarHBondContact O-CA 3.48Å; I595-G611 PolarHBondContact N-O 2.62Å; I595-G611 PolarHBondContact O-N 3.38Å; I595-Q613 HydrophobicContact CD1-CG 3.88Å; I595-Q613 HydrophobicContact CG1-CG 3.95Å; I595-Q664 WeakPolarHBondContact CA-O 3.17Å
596	V	94	Very high	90.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115.4	176.5	177.4	0	0	0	0	108.4	L608 V662 G663 Q664 Y666	V596-L608 HydrophobicContact CG1-CD2 4.02Å; V596-L608 HydrophobicContact CG2-CD1 4.32Å; V596-V662 HydrophobicContact CG1-CG2 4.39Å; V596-G663 PolarHBondContact O-N 2.87Å; V596-Q664 PolarHBondContact N-O 3.37Å; V596-Q664 VanDerWaalsContact N-O 3.09Å; V596-Y666 HydrophobicContact CG2-CD2 3.7Å; V596-Y666 HydrophobicContact CG2-CE2 3.99Å
597	K	92.4	Very high	90.5	Very high	126 Å²	126	52 Å²	52	55%	0.548	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-36.3	-179.2	-67.6	-67.4	-171.7	172.9	0	112.3	I595 E609 A636 V662	I595-K597 PolarHBondContact O-N 2.77Å; K597-E609 HydrophobicContact CB-CB 4.41Å; K597-E609 PolarHBondContact N-O 2.72Å; K597-A636 HydrophobicContact CG-CB 4.47Å; K597-V662 WeakPolarHBondContact O-CG1 3.26Å
598	S	91.8	Very high	90.8	Very high	36 Å²	36	44.9 Å²	44.9	25%	0.252	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.5	174.7	68.9	0	0	0	0	109.9	L608 E609	S598-L608 WeakPolarHBondContact O-CA 3.14Å; S598-E609 PolarHBondContact N-O 3.21Å; S598-E609 PolarHBondContact O-N 3.15Å; S598-E609 VanDerWaalsContact OG-CB 3.27Å; S598-E609 WeakPolarHBondContact OG-CB 3.04Å; S598-E609 VanDerWaalsContact OG-CG 3.26Å; S598-E609 WeakPolarHBondContact OG-CG 3Å; S598-E609 PolarHBondContact OG-OE2 2.89Å
599	R	90.7	Very high	91	Very high	119 Å²	119	47.4 Å²	47.4	45%	0.449	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.9	173.8	71.4	-179.2	-173.9	174.6	6.7	109.4	M606 R607 L608 L660 V662	R599-M606 HydrophobicContact CB-CG 4.43Å; R599-M606 HydrophobicContact CB-SD 4.12Å; R599-R607 CarbonylContact C-O 3.47Å; R599-R607 WeakPolarHBondContact CA-O 3.47Å; R599-L608 HydrophobicContact CB-CD2 3.53Å; R599-L660 PolarHBondContact NH1-O 2.98Å; R599-V662 HydrophobicContact CB-CG2 4.47Å; R599-V662 HydrophobicContact CG-CG2 3.96Å
600	T	89.5	Confident	91.3	Very high	60 Å²	60	44.7 Å²	44.7	37%	0.368	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.3	177	45.6	0	0	0	0	108.7	M606 R607	T600-M606 CarbonylContact O-C 3.57Å; T600-M606 WeakPolarHBondContact O-CA 3.28Å; T600-R607 PolarHBondContact N-O 3.01Å; T600-R607 PolarHBondContact O-N 3.06Å; T600-R607 WeakPolarHBondContact OG1-CB 3.24Å; T600-R607 PolarHBondContact OG1-O 2.97Å
601	I	86.9	Confident	91.4	Very high	95 Å²	95	45.1 Å²	45.1	49%	0.487	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	131.1	-177.7	-63.5	159.2	0	0	0	108	I643 L656	I601-I643 HydrophobicContact CG2-CD1 3.7Å; I601-L656 HydrophobicContact CD1-CD1 3.38Å; I601-L656 HydrophobicContact CG1-CD1 4.21Å
602	H	85.4	Confident	91.4	Very high	79 Å²	79	45.4 Å²	45.4	37%	0.366	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	91.1	-179.9	-68.5	-86.7	0	0	0	108.5	D604 L605 W640	H602-D604 PolarHBondContact O-N 2.89Å; H602-L605 CarbonylContact C-O 3.5Å; H602-L605 PolarHBondContact N-O 2.93Å; H602-L605 PolarHBondContact O-N 2.64Å; H602-W640 HydrophobicContact CB-CH2 4.44Å; H602-W640 HydrophobicContact CB-CZ3 3.95Å; H602-W640 AromaticContact CD2-CH2 3.78Å; H602-W640 AromaticContact CD2-CZ3 3.78Å
603	G	84	Confident	91.2	Very high	62 Å²	62	49.5 Å²	49.5	64%	0.639	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	-124.4	-173.7	0	0	0	0	0	111.1	L605	G603-L605 VanDerWaalsContact C-N 3.25Å; G603-L605 PolarHBondContact O-N 3.26Å
604	D	86.1	Confident	91.1	Very high	133 Å²	133	50.1 Å²	50.1	71%	0.711	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	8.8	179.3	-58.9	-30.7	0	0	0	113.9	H602 I643	H602-D604 PolarHBondContact O-N 2.89Å; D604-I643 WeakPolarHBondContact O-CG1 3.31Å; D604-I643 PolarHBondContact O-N 3.04Å
605	L	87.9	Confident	91.1	Very high	54 Å²	54	51.4 Å²	51.4	28%	0.283	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.6	178.1	-65.6	171.6	0	0	0	111.1	H602 G603 W640 L641 R642 L684	H602-L605 CarbonylContact C-O 3.5Å; H602-L605 PolarHBondContact N-O 2.93Å; H602-L605 PolarHBondContact O-N 2.64Å; G603-L605 VanDerWaalsContact C-N 3.25Å; G603-L605 PolarHBondContact O-N 3.26Å; L605-W640 HydrophobicContact CB-CE3 3.91Å; L605-W640 HydrophobicContact CB-CZ3 4.2Å; L605-W640 HydrophobicContact CD1-CE3 4.3Å; L605-L641 WeakPolarHBondContact CA-O 3.09Å; L605-R642 HydrophobicContact CD2-CB 4.4Å; L605-R642 HydrophobicContact CD2-CG 3.55Å; L605-L684 HydrophobicContact CD2-CD1 4.09Å
606	M	90.6	Very high	91	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.1	168.6	178	-177.9	2.6	0	0	108.9	R599 T600 L608 W640 L641 I643	R599-M606 HydrophobicContact CB-CG 4.43Å; R599-M606 HydrophobicContact CB-SD 4.12Å; T600-M606 CarbonylContact O-C 3.57Å; T600-M606 WeakPolarHBondContact O-CA 3.28Å; M606-L608 HydrophobicContact CG-CD2 3.91Å; M606-L608 HydrophobicContact SD-CD2 3.7Å; M606-W640 CarbonylContact O-C 3.55Å; M606-W640 WeakPolarHBondContact O-CA 3.08Å; M606-L641 HydrophobicContact CB-CD2 4.46Å; M606-L641 HydrophobicContact CB-CG 4.21Å; M606-L641 HydrophobicContact CE-CD1 3.86Å; M606-L641 HydrophobicContact CE-CG 4.42Å; M606-L641 PolarHBondContact N-O 3.27Å; M606-L641 PolarHBondContact O-N 2.95Å; M606-I643 HydrophobicContact CB-CG2 3.59Å; M606-I643 HydrophobicContact CE-CG2 3.26Å
607	R	93.1	Very high	90.9	Very high	31 Å²	31	53.5 Å²	53.5	12%	0.117	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.3	175.7	-174.9	-170.3	-172.5	-141.4	-5.8	109.9	R599 T600 R638 W640 E682	R599-R607 CarbonylContact C-O 3.47Å; R599-R607 WeakPolarHBondContact CA-O 3.47Å; T600-R607 PolarHBondContact N-O 3.01Å; T600-R607 PolarHBondContact O-N 3.06Å; T600-R607 WeakPolarHBondContact OG1-CB 3.24Å; T600-R607 PolarHBondContact OG1-O 2.97Å; R607-R638 VanDerWaalsContact NH2-CD 3.27Å; R607-W640 HydrophobicContact CB-CD2 3.83Å; R607-W640 HydrophobicContact CB-CE3 3.66Å; R607-W640 HydrophobicContact CB-CH2 3.85Å; R607-W640 HydrophobicContact CB-CZ2 3.99Å; R607-W640 HydrophobicContact CB-CZ3 3.69Å; R607-W640 HydrophobicContact CG-CD2 3.88Å; R607-W640 HydrophobicContact CG-CE3 4.2Å; R607-W640 HydrophobicContact CG-CG 4.49Å; R607-W640 HydrophobicContact CG-CH2 4.01Å; R607-W640 HydrophobicContact CG-CZ2 3.64Å; R607-W640 HydrophobicContact CG-CZ3 4.28Å; R607-E682 IonicContact CZ-OE1 2.93Å; R607-E682 IonicContact CZ-OE2 3.39Å; R607-E682 IonicContact NE-OE1 3.9Å; R607-E682 IonicContact NE-OE2 3.88Å; R607-E682 PolarHBondContact NE-OE2 3.35Å; R607-E682 IonicContact NH2-OE1 2.89Å; R607-E682 PolarHBondContact NH2-OE1 3.34Å; R607-E682 IonicContact NH2-OE2 3.71Å; R607-E682 PolarHBondContact NH2-OE2 2.88Å
608	L	93.8	Very high	90.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.7	-179.3	-57.5	179.2	0	0	0	110.9	V596 S598 R599 M606 V610 R638 V639 L641 L660 F668	V596-L608 HydrophobicContact CG1-CD2 4.02Å; V596-L608 HydrophobicContact CG2-CD1 4.32Å; S598-L608 WeakPolarHBondContact O-CA 3.14Å; R599-L608 HydrophobicContact CB-CD2 3.53Å; M606-L608 HydrophobicContact CG-CD2 3.91Å; M606-L608 HydrophobicContact SD-CD2 3.7Å; L608-V610 HydrophobicContact CB-CG2 3.78Å; L608-V610 HydrophobicContact CD1-CG2 4.36Å; L608-R638 WeakPolarHBondContact O-CA 3.32Å; L608-V639 PolarHBondContact N-O 3.31Å; L608-V639 PolarHBondContact O-N 2.92Å; L608-L641 HydrophobicContact CD1-CD2 3.26Å; L608-L641 HydrophobicContact CD2-CD2 4.34Å; L608-L641 HydrophobicContact CG-CD2 3.51Å; L608-L660 HydrophobicContact CD1-CD1 3.66Å; L608-F668 HydrophobicContact CD1-CE1 4.34Å
609	E	94.4	Very high	90.7	Very high	63 Å²	63	49 Å²	49	29%	0.294	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.3	158	-63.6	-174.8	147	0	0	109.1	K597 S598 A636 Y637 R638	K597-E609 HydrophobicContact CB-CB 4.41Å; K597-E609 PolarHBondContact N-O 2.72Å; S598-E609 PolarHBondContact N-O 3.21Å; S598-E609 PolarHBondContact O-N 3.15Å; S598-E609 VanDerWaalsContact OG-CB 3.27Å; S598-E609 WeakPolarHBondContact OG-CB 3.04Å; S598-E609 VanDerWaalsContact OG-CG 3.26Å; S598-E609 WeakPolarHBondContact OG-CG 3Å; S598-E609 PolarHBondContact OG-OE2 2.89Å; E609-A636 HydrophobicContact CB-CB 4.12Å; E609-Y637 CarbonylContact C-O 3.37Å; E609-Y637 WeakPolarHBondContact CA-O 3.19Å; E609-R638 HydrophobicContact CG-CG 4.35Å; E609-R638 IonicContact OE1-NE 2.95Å
610	V	93.7	Very high	90.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.1	-169.4	-175.3	0	0	0	0	110.1	F592 I595 L608 I612 Y637 V639 F668	F592-V610 HydrophobicContact CE2-CG1 4.38Å; I595-V610 CarbonylContact O-C 3.55Å; I595-V610 WeakPolarHBondContact O-CA 3.48Å; L608-V610 HydrophobicContact CB-CG2 3.78Å; L608-V610 HydrophobicContact CD1-CG2 4.36Å; V610-I612 PolarHBondContact O-N 3.18Å; V610-Y637 PolarHBondContact N-O 3.38Å; V610-Y637 PolarHBondContact O-N 3.14Å; V610-V639 HydrophobicContact CG2-CB 4.44Å; V610-V639 HydrophobicContact CG2-CG2 4.36Å; V610-F668 HydrophobicContact CG1-CE2 3.91Å; V610-F668 HydrophobicContact CG1-CZ 4.14Å; V610-F668 HydrophobicContact CG2-CZ 4.08Å
611	G	93.7	Very high	90.1	Very high	10 Å²	10	43.1 Å²	43.1	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.6	170.9	0	0	0	0	0	110.5	G594 I595	G594-G611 CarbonylContact C-O 3.59Å; G594-G611 VanDerWaalsContact CA-O 3.26Å; G594-G611 WeakPolarHBondContact CA-O 3.38Å; I595-G611 PolarHBondContact N-O 2.62Å; I595-G611 PolarHBondContact O-N 3.38Å
612	I	93.5	Very high	90.1	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.1	-174.4	-62.7	175.2	0	0	0	110.6	F592 V610 T615 L626 P627 A630 Y637	F592-I612 HydrophobicContact CD2-CG1 4.3Å; V610-I612 PolarHBondContact O-N 3.18Å; I612-T615 HydrophobicContact CG2-CG2 3.66Å; I612-L626 HydrophobicContact CD1-CB 4.42Å; I612-L626 HydrophobicContact CD1-CD2 3.71Å; I612-P627 HydrophobicContact CD1-CG 3.77Å; I612-A630 HydrophobicContact CG2-CB 4.39Å; I612-Y637 HydrophobicContact CB-CD2 4.5Å; I612-Y637 HydrophobicContact CD1-CD2 3.34Å; I612-Y637 HydrophobicContact CD1-CE2 3.78Å; I612-Y637 HydrophobicContact CD1-CG 3.79Å; I612-Y637 HydrophobicContact CG1-CD2 3.77Å; I612-Y637 HydrophobicContact CG1-CE2 4.35Å; I612-Y637 HydrophobicContact CG1-CG 4.48Å
613	Q	91.5	Very high	90.1	Very high	87 Å²	87	38.6 Å²	38.6	41%	0.407	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-38.7	-177.8	-70.8	-73	-60	0	0	112.5	R593 I595 A630	R593-Q613 HydrophobicContact CG-CB 4.22Å; R593-Q613 PolarHBondContact O-N 3.06Å; I595-Q613 HydrophobicContact CD1-CG 3.88Å; I595-Q613 HydrophobicContact CG1-CG 3.95Å; Q613-A630 VanDerWaalsContact C-CB 3.5Å; Q613-A630 WeakPolarHBondContact O-CB 3.4Å
614	N	92.9	Very high	90	Very high	49 Å²	49	42.9 Å²	42.9	26%	0.262	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	144.4	179.2	-58.4	108	0	0	0	110.1	F592 R593 W616	F592-N614 CarbonylContact C-O 3.58Å; F592-N614 VanDerWaalsContact CA-O 3.27Å; F592-N614 WeakPolarHBondContact CA-O 3.49Å; F592-N614 WeakPolarHBondContact CB-O 3.45Å; R593-N614 HydrophobicContact CB-CB 4.21Å; R593-N614 WeakPolarHBondContact CD-OD1 3.33Å; R593-N614 PolarHBondContact N-O 3.25Å; R593-N614 PolarHBondContact NH1-OD1 3.32Å; R593-N614 PolarHBondContact O-N 3.06Å; N614-W616 HydrophobicContact CB-CE3 4.47Å; N614-W616 HydrophobicContact CB-CH2 3.49Å; N614-W616 VanDerWaalsContact CB-CH2 3.49Å; N614-W616 HydrophobicContact CB-CZ2 3.74Å; N614-W616 HydrophobicContact CB-CZ3 3.9Å
615	T	92.7	Very high	90.1	Very high	28 Å²	28	38.4 Å²	38.4	17%	0.172	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.4	177.1	51	0	0	0	0	108.8	F592 I612 I618 P627 K628	F592-T615 HydrophobicContact CB-CG2 4.05Å; I612-T615 HydrophobicContact CG2-CG2 3.66Å; T615-I618 HydrophobicContact CG2-CD1 4.47Å; T615-I618 HydrophobicContact CG2-CG1 4.34Å; T615-P627 WeakPolarHBondContact CG2-O 3.31Å; T615-K628 WeakPolarHBondContact CB-O 3.35Å; T615-K628 PolarHBondContact OG1-O 2.94Å
616	W	92.8	Very high	90.2	Very high	31 Å²	31	36.2 Å²	36.2	12%	0.117	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-27.1	177.8	-66.9	-82.7	0	0	0	112.6	F585 V591 R593 N614 L667 W694 L702 V706	F585-W616 HydrophobicContact CE2-CB 3.82Å; F585-W616 HydrophobicContact CZ-CB 4.39Å; V591-W616 HydrophobicContact CG1-CE3 4.42Å; V591-W616 PolarHBondContact O-N 2.85Å; R593-W616 HydrophobicContact CB-CH2 3.83Å; R593-W616 HydrophobicContact CB-CZ3 3.71Å; N614-W616 HydrophobicContact CB-CE3 4.47Å; N614-W616 HydrophobicContact CB-CH2 3.49Å; N614-W616 VanDerWaalsContact CB-CH2 3.49Å; N614-W616 HydrophobicContact CB-CZ2 3.74Å; N614-W616 HydrophobicContact CB-CZ3 3.9Å; W616-L667 HydrophobicContact CZ3-CD1 4.06Å; W616-W694 AromaticContact CH2-CH2 3.45Å; W616-W694 HydrophobicContact CH2-CH2 3.45Å; W616-W694 VanDerWaalsContact CH2-CH2 3.45Å; W616-W694 HydrophobicContact CH2-CZ2 4.49Å; W616-W694 AromaticContact CH2-CZ3 3.6Å; W616-W694 HydrophobicContact CH2-CZ3 3.6Å; W616-W694 AromaticContact CZ2-CH2 3.95Å; W616-W694 HydrophobicContact CZ2-CH2 3.95Å; W616-W694 HydrophobicContact CZ2-CZ3 4.47Å; W616-W694 HydrophobicContact CZ3-CH2 4.41Å; W616-W694 HydrophobicContact CZ3-CZ3 4.14Å; W616-L702 HydrophobicContact CD2-CB 3.78Å; W616-L702 HydrophobicContact CD2-CD1 3.83Å; W616-L702 HydrophobicContact CD2-CG 4.36Å; W616-L702 HydrophobicContact CE3-CD1 3.71Å; W616-L702 HydrophobicContact CG-CB 3.79Å; W616-L702 HydrophobicContact CH2-CD1 3.87Å; W616-L702 HydrophobicContact CZ2-CB 4.33Å; W616-L702 HydrophobicContact CZ2-CD1 3.99Å; W616-L702 HydrophobicContact CZ3-CD1 3.72Å; W616-V706 HydrophobicContact CB-CG2 3.72Å; W616-V706 HydrophobicContact CG-CG2 4.15Å; W616-V706 VanDerWaalsContact O-CG2 3.3Å; W616-V706 WeakPolarHBondContact O-CG2 3.48Å
617	R	92.1	Very high	90.1	Very high	49 Å²	49	37 Å²	37	19%	0.185	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	130	175.6	-172.4	179.3	-178.5	94.1	-1.7	108.1	F585 C586 N588 A590 V591 T619 C714	F585-R617 HydrophobicContact CE2-CB 3.9Å; F585-R617 HydrophobicContact CZ-CB 3.83Å; F585-R617 WeakPolarHBondContact O-CD 3.14Å; C586-R617 PolarHBondContact O-NH2 3.35Å; N588-R617 WeakPolarHBondContact O-CD 3.46Å; N588-R617 PolarHBondContact O-NE 3.41Å; A590-R617 CarbonylContact C-O 3.57Å; A590-R617 VanDerWaalsContact CA-O 3.3Å; A590-R617 WeakPolarHBondContact CA-O 3.16Å; V591-R617 HydrophobicContact CB-CB 4.06Å; V591-R617 HydrophobicContact CG2-CB 4.17Å; V591-R617 PolarHBondContact N-O 2.86Å; V591-R617 PolarHBondContact O-N 2.79Å; R617-T619 HydrophobicContact CG-CG2 4.37Å; R617-C714 PolarHBondContact NH1-SG 2.9Å
618	I	91.3	Very high	89.7	Confident	17 Å²	17	41.7 Å²	41.7	9%	0.087	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	110	173.6	-59.8	-66.1	0	0	0	105.5	E589 A590 F592 T615 A622 L626	E589-I618 CarbonylContact O-C 3.58Å; E589-I618 WeakPolarHBondContact O-CA 3.44Å; A590-I618 HydrophobicContact CB-CD1 3.96Å; F592-I618 HydrophobicContact CD1-CD1 4.32Å; T615-I618 HydrophobicContact CG2-CD1 4.47Å; T615-I618 HydrophobicContact CG2-CG1 4.34Å; I618-A622 HydrophobicContact CG2-CB 4.25Å; I618-L626 HydrophobicContact CD1-CB 4.01Å; I618-L626 HydrophobicContact CD1-CD1 4.01Å; I618-L626 HydrophobicContact CG2-CB 4.45Å
619	T	88.7	Confident	89.2	Confident	50 Å²	50	47 Å²	47	31%	0.307	25%	0.248	S	C	.	.			trans	-141.5	169.6	179.2	60.7	0	0	0	0	109.3	E589 R617	E589-T619 WeakPolarHBondContact CA-OG1 3.39Å; E589-T619 WeakPolarHBondContact CB-O 3.42Å; E589-T619 PolarHBondContact O-N 2.91Å; E589-T619 PolarHBondContact O-OG1 2.79Å; R617-T619 HydrophobicContact CG-CG2 4.37Å
620	G	85.1	Confident	88.5	Confident	35 Å²	35	45.8 Å²	45.8	36%	0.361	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	63.6	-141.6	172	0	0	0	0	0	112.8	A622 E623	G620-A622 PolarHBondContact O-N 3.32Å; G620-A622 VanDerWaalsContact O-N 3.08Å; G620-E623 VanDerWaalsContact O-CB 3.28Å; G620-E623 WeakPolarHBondContact O-CB 3.38Å; G620-E623 PolarHBondContact O-N 3.42Å
621	A	82.7	Confident	87.8	Confident	21 Å²	21	48.5 Å²	48.5	17%	0.174	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-58	-28	-175.9	0	0	0	0	0	114	E623 S672 Q674	A621-E623 VanDerWaalsContact C-N 3.32Å; A621-S672 WeakPolarHBondContact CB-O 3.48Å; A621-Q674 HydrophobicContact CB-CG 3.94Å; A621-Q674 PolarHBondContact O-NE2 2.94Å
622	A	85.5	Confident	87	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-73.7	-18.7	178.4	0	0	0	0	0	114.1	A590 I618 G620 H624 L625 L626 L683	A590-A622 HydrophobicContact CB-CB 3.67Å; I618-A622 HydrophobicContact CG2-CB 4.25Å; G620-A622 PolarHBondContact O-N 3.32Å; G620-A622 VanDerWaalsContact O-N 3.08Å; A622-H624 PolarHBondContact O-N 3.15Å; A622-L625 PolarHBondContact O-N 2.89Å; A622-L626 HydrophobicContact CB-CD1 4.17Å; A622-L626 PolarHBondContact O-N 2.8Å; A622-L683 HydrophobicContact CB-CD1 4.19Å
623	E	86.4	Confident	86.3	Confident	80 Å²	80	60.6 Å²	60.6	37%	0.374	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-65	-28.7	-175.5	-168.6	165.6	-179.8	0	0	113.4	G620 A621 K628	G620-E623 VanDerWaalsContact O-CB 3.28Å; G620-E623 WeakPolarHBondContact O-CB 3.38Å; G620-E623 PolarHBondContact O-N 3.42Å; A621-E623 VanDerWaalsContact C-N 3.32Å; E623-K628 WeakPolarHBondContact OE1-CE 3.24Å; E623-K628 IonicContact OE1-NZ 2.84Å; E623-K628 PolarHBondContact OE1-NZ 2.81Å
624	H	82.6	Confident	85.9	Confident	152 Å²	152	58.9 Å²	58.9	70%	0.704	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-91.1	-14.2	177.4	-57	-68.7	0	0	0	113.6	A622	A622-H624 PolarHBondContact O-N 3.15Å
625	L	86.7	Confident	85.7	Confident	39 Å²	39	60.7 Å²	60.7	20%	0.204	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-16.1	-170	-65.2	178.2	0	0	0	113.9	A622 Y637 Q674 M681 L683	A622-L625 PolarHBondContact O-N 2.89Å; L625-Y637 WeakPolarHBondContact O-CD1 3.22Å; L625-Q674 HydrophobicContact CD1-CB 4.31Å; L625-Q674 HydrophobicContact CD1-CG 3.82Å; L625-M681 HydrophobicContact CD2-CB 4.27Å; L625-M681 WeakPolarHBondContact CD2-O 3.01Å; L625-L683 HydrophobicContact CB-CD1 4.27Å; L625-L683 HydrophobicContact CD1-CB 4.09Å; L625-L683 HydrophobicContact CD1-CD1 3.83Å
626	L	90.3	Very high	85.6	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	35%	0.353	C	S	.	.	S	Bend	trans	-127.6	146.3	177.1	-61.4	178.9	0	0	0	110	A590 F592 I612 I618 A622 Y637 L683	A590-L626 HydrophobicContact CB-CD1 4.19Å; F592-L626 HydrophobicContact CD1-CD1 3.82Å; F592-L626 HydrophobicContact CE1-CD1 3.41Å; F592-L626 VanDerWaalsContact CE1-CD1 3.41Å; F592-L626 HydrophobicContact CZ-CD1 3.86Å; I612-L626 HydrophobicContact CD1-CB 4.42Å; I612-L626 HydrophobicContact CD1-CD2 3.71Å; I618-L626 HydrophobicContact CD1-CB 4.01Å; I618-L626 HydrophobicContact CD1-CD1 4.01Å; I618-L626 HydrophobicContact CG2-CB 4.45Å; A622-L626 HydrophobicContact CB-CD1 4.17Å; A622-L626 PolarHBondContact O-N 2.8Å; L626-Y637 HydrophobicContact CD2-CD1 4.17Å; L626-Y637 HydrophobicContact CD2-CG 4.05Å; L626-L683 HydrophobicContact CD1-CD2 3.66Å; L626-L683 HydrophobicContact CD2-CD2 4.41Å; L626-L683 HydrophobicContact CG-CD2 4.05Å
627	P	88.4	Confident	85.6	Confident	21 Å²	21	62 Å²	62	14%	0.136	36%	0.355	C	S	.	.			trans	-73.7	140.8	-179.1	31.7	-30	0	0	0	110.2	I612 T615 T629 L634 Y637	I612-P627 HydrophobicContact CD1-CG 3.77Å; T615-P627 WeakPolarHBondContact CG2-O 3.31Å; P627-T629 VanDerWaalsContact C-N 3.29Å; P627-T629 PolarHBondContact O-N 2.04Å; P627-L634 HydrophobicContact CB-CD1 4.22Å; P627-L634 HydrophobicContact CB-CD2 4.31Å; P627-L634 HydrophobicContact CG-CD1 3.78Å; P627-L634 HydrophobicContact CG-CD2 4.47Å; P627-Y637 VanDerWaalsContact CD-CZ 3.47Å; P627-Y637 HydrophobicContact CG-CE1 4.43Å; P627-Y637 HydrophobicContact CG-CE2 3.8Å
628	K	85.6	Confident	85.6	Confident	129 Å²	129	64 Å²	64	56%	0.561	36%	0.363	S	S	*	.	S	Bend	trans	-67	-31.7	175.6	-70.6	-175.5	177.7	179.6	0	112.3	T615 E623	T615-K628 WeakPolarHBondContact CB-O 3.35Å; T615-K628 PolarHBondContact OG1-O 2.94Å; E623-K628 WeakPolarHBondContact OE1-CE 3.24Å; E623-K628 IonicContact OE1-NZ 2.84Å; E623-K628 PolarHBondContact OE1-NZ 2.81Å
629	T	83.7	Confident	85.7	Confident	111 Å²	111	63.1 Å²	63.1	68%	0.681	36%	0.359	S	S	*	.	S	Bend	trans	-124.4	137.7	-179.6	49.3	0	0	0	0	111	P627	P627-T629 VanDerWaalsContact C-N 3.29Å; P627-T629 PolarHBondContact O-N 2.04Å
630	A	79.7	Confident	85.8	Confident	39 Å²	39	61.3 Å²	61.3	32%	0.322	35%	0.346	S	S	.	.			trans	-82.2	137.4	176.1	0	0	0	0	0	111.2	I612 Q613	I612-A630 HydrophobicContact CG2-CB 4.39Å; Q613-A630 VanDerWaalsContact C-CB 3.5Å; Q613-A630 WeakPolarHBondContact O-CB 3.4Å
631	S	78.8	Confident	86.2	Confident	56 Å²	56	60.1 Å²	60.1	39%	0.392	33%	0.331	S	S	.	.			trans	-135.9	146.5	175.4	162.7	0	0	0	0	109.1	N633 L634	S631-N633 PolarHBondContact O-N 3.34Å; S631-N633 VanDerWaalsContact O-N 3.12Å; S631-N633 PolarHBondContact OG-N 2.88Å; S631-L634 WeakPolarHBondContact O-CG 3.37Å; S631-L634 PolarHBondContact O-N 2.94Å
632	P	75.1	Confident	86.4	Confident	125 Å²	125	66.3 Å²	66.3	81%	0.812	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-22.9	-179.7	21.3	-32.2	0	0	0	113.8
633	N	79.4	Confident	86.5	Confident	146 Å²	146	67.1 Å²	67.1	78%	0.781	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	14.6	-175.1	-63.2	-17.2	0	0	0	113.9	S631	S631-N633 PolarHBondContact O-N 3.34Å; S631-N633 VanDerWaalsContact O-N 3.12Å; S631-N633 PolarHBondContact OG-N 2.88Å
634	L	83.5	Confident	86.2	Confident	51 Å²	51	70.9 Å²	70.9	27%	0.267	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-74.2	142	179.5	-70	170.3	0	0	0	111.9	P627 S631 Y637	P627-L634 HydrophobicContact CB-CD1 4.22Å; P627-L634 HydrophobicContact CB-CD2 4.31Å; P627-L634 HydrophobicContact CG-CD1 3.78Å; P627-L634 HydrophobicContact CG-CD2 4.47Å; S631-L634 WeakPolarHBondContact O-CG 3.37Å; S631-L634 PolarHBondContact O-N 2.94Å; L634-Y637 HydrophobicContact CB-CE2 4.23Å
635	P	88.8	Confident	85.8	Confident	86 Å²	86	67.7 Å²	67.7	56%	0.558	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-66.3	167.6	172.4	30.3	-35.5	0	0	0	111.4	Y637	P635-Y637 HydrophobicContact CG-CE2 4.4Å; P635-Y637 WeakPolarHBondContact O-CD2 3.16Å; P635-Y637 WeakPolarHBondContact O-CE2 3.48Å
636	A	90.4	Very high	84.7	Confident	41 Å²	41	68.5 Å²	68.5	34%	0.339	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.2	169.2	0	0	0	0	0	110.3	K597 E609	K597-A636 HydrophobicContact CG-CB 4.47Å; E609-A636 HydrophobicContact CB-CB 4.12Å
637	Y	92.4	Very high	83.3	Confident	45 Å²	45	69.3 Å²	69.3	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	147.1	-179.2	-68.3	-92.6	0	0	0	111	E609 V610 I612 L625 L626 P627 L634 P635	E609-Y637 CarbonylContact C-O 3.37Å; E609-Y637 WeakPolarHBondContact CA-O 3.19Å; V610-Y637 PolarHBondContact N-O 3.38Å; V610-Y637 PolarHBondContact O-N 3.14Å; I612-Y637 HydrophobicContact CB-CD2 4.5Å; I612-Y637 HydrophobicContact CD1-CD2 3.34Å; I612-Y637 HydrophobicContact CD1-CE2 3.78Å; I612-Y637 HydrophobicContact CD1-CG 3.79Å; I612-Y637 HydrophobicContact CG1-CD2 3.77Å; I612-Y637 HydrophobicContact CG1-CE2 4.35Å; I612-Y637 HydrophobicContact CG1-CG 4.48Å; L625-Y637 WeakPolarHBondContact O-CD1 3.22Å; L626-Y637 HydrophobicContact CD2-CD1 4.17Å; L626-Y637 HydrophobicContact CD2-CG 4.05Å; P627-Y637 VanDerWaalsContact CD-CZ 3.47Å; P627-Y637 HydrophobicContact CG-CE1 4.43Å; P627-Y637 HydrophobicContact CG-CE2 3.8Å; L634-Y637 HydrophobicContact CB-CE2 4.23Å; P635-Y637 HydrophobicContact CG-CE2 4.4Å; P635-Y637 WeakPolarHBondContact O-CD2 3.16Å; P635-Y637 WeakPolarHBondContact O-CE2 3.48Å
638	R	92.6	Very high	81.7	Confident	91 Å²	91	73.8 Å²	73.8	34%	0.343	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.4	-173.2	-64.9	171.2	179.8	114.7	5.8	111.1	R607 L608 E609 E682 L683	R607-R638 VanDerWaalsContact NH2-CD 3.27Å; L608-R638 WeakPolarHBondContact O-CA 3.32Å; E609-R638 HydrophobicContact CG-CG 4.35Å; E609-R638 IonicContact OE1-NE 2.95Å; R638-E682 HydrophobicContact CB-CG 4.17Å; R638-E682 WeakPolarHBondContact CB-OE2 3.45Å; R638-E682 WeakPolarHBondContact CD-OE1 3.43Å; R638-L683 PolarHBondContact O-N 3.46Å
639	V	92.4	Very high	80.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	127.7	-173.1	-177.9	0	0	0	0	109.7	L608 V610 L683 L685	L608-V639 PolarHBondContact N-O 3.31Å; L608-V639 PolarHBondContact O-N 2.92Å; V610-V639 HydrophobicContact CG2-CB 4.44Å; V610-V639 HydrophobicContact CG2-CG2 4.36Å; V639-L683 CarbonylContact C-O 2.92Å; V639-L683 WeakPolarHBondContact CA-O 3.02Å; V639-L683 HydrophobicContact CG2-CD2 4.37Å; V639-L685 HydrophobicContact CG1-CD1 3.54Å; V639-L685 HydrophobicContact CG1-CD2 3.45Å; V639-L685 VanDerWaalsContact CG1-CD2 3.45Å; V639-L685 HydrophobicContact CG1-CG 3.34Å
640	W	92.8	Very high	78.9	Confident	12 Å²	12	74.3 Å²	74.3	5%	0.045	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	140.8	177.9	-64.3	80.7	0	0	0	110.8	H602 L605 M606 R607 V675 Y677 E682 L683 L684 L685	H602-W640 HydrophobicContact CB-CH2 4.44Å; H602-W640 HydrophobicContact CB-CZ3 3.95Å; H602-W640 AromaticContact CD2-CH2 3.78Å; H602-W640 AromaticContact CD2-CZ3 3.78Å; L605-W640 HydrophobicContact CB-CE3 3.91Å; L605-W640 HydrophobicContact CB-CZ3 4.2Å; L605-W640 HydrophobicContact CD1-CE3 4.3Å; M606-W640 CarbonylContact O-C 3.55Å; M606-W640 WeakPolarHBondContact O-CA 3.08Å; R607-W640 HydrophobicContact CB-CD2 3.83Å; R607-W640 HydrophobicContact CB-CE3 3.66Å; R607-W640 HydrophobicContact CB-CH2 3.85Å; R607-W640 HydrophobicContact CB-CZ2 3.99Å; R607-W640 HydrophobicContact CB-CZ3 3.69Å; R607-W640 HydrophobicContact CG-CD2 3.88Å; R607-W640 HydrophobicContact CG-CE3 4.2Å; R607-W640 HydrophobicContact CG-CG 4.49Å; R607-W640 HydrophobicContact CG-CH2 4.01Å; R607-W640 HydrophobicContact CG-CZ2 3.64Å; R607-W640 HydrophobicContact CG-CZ3 4.28Å; W640-V675 HydrophobicContact CG-CG1 4.45Å; W640-Y677 AromaticContact CH2-CD2 3.82Å; W640-Y677 HydrophobicContact CH2-CD2 3.82Å; W640-Y677 AromaticContact CH2-CE2 3.63Å; W640-Y677 HydrophobicContact CH2-CE2 3.63Å; W640-Y677 HydrophobicContact CZ2-CD1 4.32Å; W640-Y677 AromaticContact CZ2-CD2 3.43Å; W640-Y677 HydrophobicContact CZ2-CD2 3.43Å; W640-Y677 VanDerWaalsContact CZ2-CD2 3.43Å; W640-Y677 HydrophobicContact CZ2-CE1 4.47Å; W640-Y677 AromaticContact CZ2-CE2 3.62Å; W640-Y677 HydrophobicContact CZ2-CE2 3.62Å; W640-Y677 AromaticContact CZ2-CG 3.8Å; W640-Y677 HydrophobicContact CZ2-CG 3.8Å; W640-E682 PolarHBondContact NE1-OE2 2.8Å; W640-L683 PolarHBondContact N-O 3.24Å; W640-L684 HydrophobicContact CB-CD1 3.58Å; W640-L685 VanDerWaalsContact O-CB 3.32Å; W640-L685 WeakPolarHBondContact O-CB 3.3Å; W640-L685 VanDerWaalsContact O-CG 3.3Å; W640-L685 WeakPolarHBondContact O-CG 3.06Å; W640-L685 PolarHBondContact O-N 2.63Å
641	L	91.5	Very high	77.6	Confident	9 Å²	9	82.2 Å²	82.2	5%	0.047	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.9	171	59.8	140.3	0	0	0	110.9	L605 M606 L608 P658 L660 L685	L605-L641 WeakPolarHBondContact CA-O 3.09Å; M606-L641 HydrophobicContact CB-CD2 4.46Å; M606-L641 HydrophobicContact CB-CG 4.21Å; M606-L641 HydrophobicContact CE-CD1 3.86Å; M606-L641 HydrophobicContact CE-CG 4.42Å; M606-L641 PolarHBondContact N-O 3.27Å; M606-L641 PolarHBondContact O-N 2.95Å; L608-L641 HydrophobicContact CD1-CD2 3.26Å; L608-L641 HydrophobicContact CD2-CD2 4.34Å; L608-L641 HydrophobicContact CG-CD2 3.51Å; L641-P658 HydrophobicContact CD1-CG 3.3Å; L641-L660 HydrophobicContact CD1-CD1 3.95Å; L641-L660 HydrophobicContact CD2-CD1 4.18Å; L641-L685 HydrophobicContact CB-CB 4.49Å; L641-L685 HydrophobicContact CB-CD1 4.41Å
642	R	88.5	Confident	76.8	Confident	151 Å²	151	81.7 Å²	81.7	57%	0.57	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	137.1	172.4	-72.2	178.1	177.8	178.5	-0	110.8	L605 T687	L605-R642 HydrophobicContact CD2-CB 4.4Å; L605-R642 HydrophobicContact CD2-CG 3.55Å; R642-T687 VanDerWaalsContact NH1-CG2 3.35Å
643	I	87.6	Confident	75.9	Confident	18 Å²	18	79.2 Å²	79.2	9%	0.092	40%	0.401	C	S	.	.			trans	-105.3	147.4	173.1	48.2	173.6	0	0	0	110.2	I601 D604 M606 L656 C657	I601-I643 HydrophobicContact CG2-CD1 3.7Å; D604-I643 WeakPolarHBondContact O-CG1 3.31Å; D604-I643 PolarHBondContact O-N 3.04Å; M606-I643 HydrophobicContact CB-CG2 3.59Å; M606-I643 HydrophobicContact CE-CG2 3.26Å; I643-L656 HydrophobicContact CD1-CD1 4.07Å; I643-L656 HydrophobicContact CD1-CD2 4.08Å; I643-C657 WeakPolarHBondContact CA-O 3.37Å
644	K	80.1	Confident	75.3	Confident	158 Å²	158	82.4 Å²	82.4	69%	0.687	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	138	171.8	-64.5	-173.9	178.7	-172.2	0	109.2	N646 C657	K644-N646 PolarHBondContact O-N 3.29Å; K644-C657 PolarHBondContact N-O 3.06Å; K644-C657 PolarHBondContact O-N 2.79Å
645	N	72.7	Confident	74.7	Confident	85 Å²	85	80.2 Å²	80.2	46%	0.455	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.8	167.8	-168.9	-2.4	0	0	0	107.9	S647 C655	N645-S647 VanDerWaalsContact C-N 3.33Å; N645-S647 PolarHBondContact OD1-N 2.79Å; N645-C655 PolarHBondContact OD1-O 3.24Å
646	N	64.3	Low	74.2	Confident	57 Å²	57	78.6 Å²	78.6	31%	0.305	38%	0.378	S	S	.	.			trans	-98.7	17.4	-171.5	-153.8	53	0	0	0	112.5	P572 C573 K644 C655 C657	P572-N646 PolarHBondContact O-ND2 2.84Å; C573-N646 WeakPolarHBondContact CA-ND2 3.33Å; K644-N646 PolarHBondContact O-N 3.29Å; N646-C655 PolarHBondContact N-O 3.28Å; N646-C657 HydrophobicContact CB-CB 4.19Å; N646-C657 WeakPolarHBondContact CB-SG 3.49Å; N646-C657 VanDerWaalsContact CG-SG 3.54Å
647	S	59.9	Low	73.7	Confident	25 Å²	25	77.4 Å²	77.4	18%	0.175	37%	0.367	C	S	.	.			trans	-134.9	131.9	178	-168.9	0	0	0	0	111.2	N645 D649 H652	N645-S647 VanDerWaalsContact C-N 3.33Å; N645-S647 PolarHBondContact OD1-N 2.79Å; S647-D649 PolarHBondContact OG-N 2.75Å; S647-H652 VanDerWaalsContact OG-CB 3.26Å; S647-H652 WeakPolarHBondContact OG-CB 3.01Å; S647-H652 PolarHBondContact OG-ND1 3.09Å
648	A	55.7	Low	73.2	Confident	114 Å²	114	77.2 Å²	77.2	94%	0.942	37%	0.371	S	S	*	.	S	Bend	trans	-75.2	-13.3	169.9	0	0	0	0	0	112.2
649	D	52.5	Low	72.7	Confident	61 Å²	61	77.5 Å²	77.5	33%	0.326	38%	0.379	S	S	.	.	S	Bend	trans	-90.3	123.2	-179	-175.2	-2.4	0	0	0	110.9	S647 R651 H652	S647-D649 PolarHBondContact OG-N 2.75Å; D649-R651 PolarHBondContact O-N 3.4Å; D649-R651 PolarHBondContact OD1-N 2.98Å; D649-R651 VanDerWaalsContact OD1-N 3.08Å; D649-R651 IonicContact OD1-NE 3.76Å; D649-R651 IonicContact OD2-NE 3.67Å; D649-H652 PolarHBondContact O-N 2.88Å; D649-H652 IonicContact OD2-CE1 3.72Å; D649-H652 IonicContact OD2-ND1 3.5Å
650	K	58	Low	72.5	Confident	190 Å²	190	77.7 Å²	77.7	83%	0.826	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-55	-24.7	177.6	-75.2	-177.8	177.7	177.9	0	112.8	H652 S653	K650-H652 PolarHBondContact O-N 2.92Å; K650-S653 PolarHBondContact O-N 2.69Å; K650-S653 PolarHBondContact O-OG 2.89Å
651	R	52.6	Low	72.2	Confident	206 Å²	206	81.5 Å²	81.5	78%	0.777	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-66.6	-20.7	175.8	-72.9	-175.6	-92.5	-159.5	-8.9	114	D649	D649-R651 PolarHBondContact O-N 3.4Å; D649-R651 PolarHBondContact OD1-N 2.98Å; D649-R651 VanDerWaalsContact OD1-N 3.08Å; D649-R651 IonicContact OD1-NE 3.76Å; D649-R651 IonicContact OD2-NE 3.67Å
652	H	61.2	Low	72.1	Confident	45 Å²	45	84.8 Å²	84.8	21%	0.208	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-104.9	22.1	-178	-64.4	99.2	0	0	0	113	S647 D649 K650 R654 C655	S647-H652 VanDerWaalsContact OG-CB 3.26Å; S647-H652 WeakPolarHBondContact OG-CB 3.01Å; S647-H652 PolarHBondContact OG-ND1 3.09Å; D649-H652 PolarHBondContact O-N 2.88Å; D649-H652 IonicContact OD2-CE1 3.72Å; D649-H652 IonicContact OD2-ND1 3.5Å; K650-H652 PolarHBondContact O-N 2.92Å; H652-R654 PolarHBondContact O-N 2.91Å; H652-C655 HydrophobicContact CB-CB 4.37Å; H652-C655 VanDerWaalsContact O-CB 3.3Å; H652-C655 WeakPolarHBondContact O-CB 3.08Å; H652-C655 PolarHBondContact O-N 2.84Å
653	S	56.9	Low	72.2	Confident	73 Å²	73	80.2 Å²	80.2	51%	0.51	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-16.2	178.5	-59.9	0	0	0	0	114.5	K650	K650-S653 PolarHBondContact O-N 2.69Å; K650-S653 PolarHBondContact O-OG 2.89Å
654	R	66	Low	72.4	Confident	212 Å²	212	82.9 Å²	82.9	80%	0.8	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.6	176.8	-62.5	-178.8	179.1	170.1	0.1	114	H652 L656	H652-R654 PolarHBondContact O-N 2.91Å; R654-L656 PolarHBondContact O-N 3.31Å
655	C	72.1	Confident	73	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.034	40%	0.404	C	S	.	.			trans	-89.1	90.2	-176.6	-62.1	0	0	0	0	111.8	C570 N645 N646 H652	C570-C655 WeakPolarHBondContact CA-SG 3.49Å; C570-C655 HydrophobicContact CB-CB 3.72Å; C570-C655 WeakPolarHBondContact CB-SG 3.23Å; C570-C655 VanDerWaalsContact SG-CA 3.55Å; C570-C655 WeakPolarHBondContact SG-CB 3.37Å; C570-C655 CovalentContact SG-SG 2.04Å; C570-C655 PolarHBondContact SG-SG 3.43Å; N645-C655 PolarHBondContact OD1-O 3.24Å; N646-C655 PolarHBondContact N-O 3.28Å; H652-C655 HydrophobicContact CB-CB 4.37Å; H652-C655 VanDerWaalsContact O-CB 3.3Å; H652-C655 WeakPolarHBondContact O-CB 3.08Å; H652-C655 PolarHBondContact O-N 2.84Å
656	L	78.3	Confident	74.1	Confident	52 Å²	52	72.7 Å²	72.7	27%	0.272	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.5	-178.5	-61.2	173	0	0	0	112.5	I601 I643 R654	I601-L656 HydrophobicContact CD1-CD1 3.38Å; I601-L656 HydrophobicContact CG1-CD1 4.21Å; I643-L656 HydrophobicContact CD1-CD1 4.07Å; I643-L656 HydrophobicContact CD1-CD2 4.08Å; R654-L656 PolarHBondContact O-N 3.31Å
657	C	79	Confident	75.5	Confident	17 Å²	17	70 Å²	70	12%	0.115	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.5	173.8	-70.5	0	0	0	0	111.9	C573 I643 K644 N646	C573-C657 WeakPolarHBondContact CA-SG 3.28Å; C573-C657 HydrophobicContact CB-CB 3.91Å; C573-C657 WeakPolarHBondContact CB-SG 3.05Å; C573-C657 VanDerWaalsContact SG-CA 3.51Å; C573-C657 WeakPolarHBondContact SG-CB 3.18Å; C573-C657 CovalentContact SG-SG 2.04Å; C573-C657 PolarHBondContact SG-SG 3.12Å; I643-C657 WeakPolarHBondContact CA-O 3.37Å; K644-C657 PolarHBondContact N-O 3.06Å; K644-C657 PolarHBondContact O-N 2.79Å; N646-C657 HydrophobicContact CB-CB 4.19Å; N646-C657 WeakPolarHBondContact CB-SG 3.49Å; N646-C657 VanDerWaalsContact CG-SG 3.54Å
658	P	82.6	Confident	77.1	Confident	40 Å²	40	68.8 Å²	68.8	26%	0.26	36%	0.362	S	S	.	.	S	Bend	cis	-76.1	138.5	2.7	30.9	-34.1	0	0	0	113.2	L641 L660	L641-P658 HydrophobicContact CD1-CG 3.3Å; P658-L660 HydrophobicContact CB-CD2 4.29Å; P658-L660 HydrophobicContact CB-CG 4.19Å; P658-L660 HydrophobicContact CG-CD1 4.14Å; P658-L660 HydrophobicContact CG-CG 4.11Å; P658-L660 PolarHBondContact O-N 3.47Å
659	N	82.5	Confident	78.8	Confident	97 Å²	97	63.4 Å²	63.4	52%	0.519	32%	0.317	S	S	.	.			trans	-77.8	83.9	177.2	-172.4	1.3	0	0	0	111.1
660	L	87.4	Confident	80.6	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-93.7	125.2	179.8	-57.4	177.4	0	0	0	110.9	R599 L608 L641 P658 Y666 V691	R599-L660 PolarHBondContact NH1-O 2.98Å; L608-L660 HydrophobicContact CD1-CD1 3.66Å; L641-L660 HydrophobicContact CD1-CD1 3.95Å; L641-L660 HydrophobicContact CD2-CD1 4.18Å; P658-L660 HydrophobicContact CB-CD2 4.29Å; P658-L660 HydrophobicContact CB-CG 4.19Å; P658-L660 HydrophobicContact CG-CD1 4.14Å; P658-L660 HydrophobicContact CG-CG 4.11Å; P658-L660 PolarHBondContact O-N 3.47Å; L660-Y666 HydrophobicContact CB-CE2 4.48Å; L660-Y666 HydrophobicContact CD2-CD1 3.58Å; L660-Y666 HydrophobicContact CD2-CD2 4.45Å; L660-Y666 HydrophobicContact CD2-CE1 3.39Å; L660-Y666 HydrophobicContact CD2-CE2 4.27Å; L660-Y666 HydrophobicContact CD2-CG 4.14Å; L660-V691 HydrophobicContact CD1-CG1 4.17Å; L660-V691 HydrophobicContact CD2-CB 4.4Å; L660-V691 HydrophobicContact CD2-CG1 3.67Å
661	Q	86.9	Confident	82	Confident	93 Å²	93	56.1 Å²	56.1	44%	0.435	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-95.7	136.7	-179	-67.4	177.2	-29.8	0	0	110.5	Q664 Y666	Q661-Q664 HydrophobicContact CB-CB 4.22Å; Q661-Q664 HydrophobicContact CB-CG 3.74Å; Q661-Q664 PolarHBondContact O-N 3.38Å; Q661-Y666 PolarHBondContact N-OH 2.02Å
662	V	90.1	Very high	83.4	Confident	78 Å²	78	46.4 Å²	46.4	47%	0.473	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	142.6	172.5	-179.3	0	0	0	0	109.4	V596 K597 R599 Q664	V596-V662 HydrophobicContact CG1-CG2 4.39Å; K597-V662 WeakPolarHBondContact O-CG1 3.26Å; R599-V662 HydrophobicContact CB-CG2 4.47Å; R599-V662 HydrophobicContact CG-CG2 3.96Å; V662-Q664 VanDerWaalsContact C-N 3.25Å; V662-Q664 PolarHBondContact O-N 3.19Å
663	G	89.2	Confident	84.5	Confident	55 Å²	55	49.4 Å²	49.4	57%	0.567	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	-12.2	-175.4	0	0	0	0	0	114.8	V596	V596-G663 PolarHBondContact O-N 2.87Å
664	Q	92.1	Very high	85.8	Confident	74 Å²	74	49.4 Å²	49.4	35%	0.346	25%	0.249	S	C	.	.			trans	-90	151	-179.1	-67.8	-69.7	-29.6	0	0	112.4	I595 V596 Q661 V662 Y666	I595-Q664 WeakPolarHBondContact CA-O 3.17Å; V596-Q664 PolarHBondContact N-O 3.37Å; V596-Q664 VanDerWaalsContact N-O 3.09Å; Q661-Q664 HydrophobicContact CB-CB 4.22Å; Q661-Q664 HydrophobicContact CB-CG 3.74Å; Q661-Q664 PolarHBondContact O-N 3.38Å; V662-Q664 VanDerWaalsContact C-N 3.25Å; V662-Q664 PolarHBondContact O-N 3.19Å; Q664-Y666 HydrophobicContact CB-CD2 4.39Å; Q664-Y666 HydrophobicContact CB-CE2 3.54Å; Q664-Y666 WeakPolarHBondContact O-CD2 3.42Å
665	S	93.6	Very high	86.7	Confident	17 Å²	17	41.3 Å²	41.3	12%	0.119	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.9	178	-170.1	0	0	0	0	111.5	R593 G594 W694	R593-S665 WeakPolarHBondContact CG-OG 3.41Å; R593-S665 PolarHBondContact NE-OG 2.73Å; G594-S665 CarbonylContact O-C 3.57Å; G594-S665 WeakPolarHBondContact O-CA 3.48Å; G594-S665 PolarHBondContact O-OG 3.47Å; S665-W694 VanDerWaalsContact O-CB 3.31Å; S665-W694 WeakPolarHBondContact O-CB 3.03Å; S665-W694 PolarHBondContact O-N 3.37Å
666	Y	94.6	Very high	87.3	Confident	11 Å²	11	45.5 Å²	45.5	4%	0.043	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.3	-179.7	-64.2	-91.2	0	0	0	111.2	R593 G594 V596 L660 Q661 Q664 V691 L692 K693	R593-Y666 WeakPolarHBondContact CA-O 3.42Å; G594-Y666 PolarHBondContact N-O 2.86Å; G594-Y666 PolarHBondContact O-N 2.8Å; V596-Y666 HydrophobicContact CG2-CD2 3.7Å; V596-Y666 HydrophobicContact CG2-CE2 3.99Å; L660-Y666 HydrophobicContact CB-CE2 4.48Å; L660-Y666 HydrophobicContact CD2-CD1 3.58Å; L660-Y666 HydrophobicContact CD2-CD2 4.45Å; L660-Y666 HydrophobicContact CD2-CE1 3.39Å; L660-Y666 HydrophobicContact CD2-CE2 4.27Å; L660-Y666 HydrophobicContact CD2-CG 4.14Å; Q661-Y666 PolarHBondContact N-OH 2.02Å; Q664-Y666 HydrophobicContact CB-CD2 4.39Å; Q664-Y666 HydrophobicContact CB-CE2 3.54Å; Q664-Y666 WeakPolarHBondContact O-CD2 3.42Å; Y666-V691 HydrophobicContact CD1-CG1 4.06Å; Y666-V691 HydrophobicContact CG-CG1 4.13Å; Y666-L692 CarbonylContact C-O 3.57Å; Y666-L692 VanDerWaalsContact CA-O 3.25Å; Y666-L692 WeakPolarHBondContact CA-O 3.48Å; Y666-K693 HydrophobicContact CD1-CB 4.3Å; Y666-K693 HydrophobicContact CE1-CB 4.09Å; Y666-K693 HydrophobicContact CE1-CG 4.48Å
667	L	94.5	Very high	87.6	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.8	166.3	177	62.7	0	0	0	108.8	I580 V591 W616 I669 V691 L692 W694 W698 L702	I580-L667 HydrophobicContact CD1-CD2 3.39Å; V591-L667 HydrophobicContact CG1-CD1 4.23Å; W616-L667 HydrophobicContact CZ3-CD1 4.06Å; L667-I669 HydrophobicContact CD2-CD1 3.92Å; L667-I669 HydrophobicContact CD2-CG1 4.19Å; L667-I669 HydrophobicContact CG-CD1 4.31Å; L667-I669 HydrophobicContact CG-CG1 4.07Å; L667-V691 WeakPolarHBondContact O-CA 3.4Å; L667-L692 PolarHBondContact N-O 2.98Å; L667-L692 PolarHBondContact O-N 3.5Å; L667-W694 HydrophobicContact CB-CE3 4.11Å; L667-W694 HydrophobicContact CD1-CZ3 4.26Å; L667-W698 HydrophobicContact CB-CE3 3.9Å; L667-W698 HydrophobicContact CB-CZ3 3.74Å; L667-W698 HydrophobicContact CD2-CD2 4.05Å; L667-W698 HydrophobicContact CD2-CE3 3.44Å; L667-W698 VanDerWaalsContact CD2-CE3 3.44Å; L667-W698 HydrophobicContact CD2-CZ3 3.82Å; L667-W698 HydrophobicContact CG-CE3 4.3Å; L667-W698 HydrophobicContact CG-CZ3 4.45Å; L667-L702 HydrophobicContact CD1-CD1 3.82Å; L667-L702 HydrophobicContact CD2-CD1 4.2Å
668	F	93.2	Very high	87.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.3	175.6	-64.3	-95.9	0	0	0	108.3	V591 F592 L608 V610 T670 L685 V691	V591-F668 VanDerWaalsContact CA-O 3.3Å; V591-F668 WeakPolarHBondContact CA-O 3.38Å; F592-F668 HydrophobicContact CD1-CB 3.97Å; F592-F668 HydrophobicContact CD2-CB 4.14Å; F592-F668 AromaticContact CD2-CD2 3.95Å; F592-F668 HydrophobicContact CD2-CD2 3.95Å; F592-F668 HydrophobicContact CD2-CG 4.28Å; F592-F668 HydrophobicContact CE1-CB 3.57Å; F592-F668 HydrophobicContact CE1-CG 4.23Å; F592-F668 HydrophobicContact CE2-CB 3.76Å; F592-F668 HydrophobicContact CE2-CD1 4.36Å; F592-F668 AromaticContact CE2-CD2 3.49Å; F592-F668 HydrophobicContact CE2-CD2 3.49Å; F592-F668 VanDerWaalsContact CE2-CD2 3.49Å; F592-F668 HydrophobicContact CE2-CE2 4.17Å; F592-F668 AromaticContact CE2-CG 3.62Å; F592-F668 HydrophobicContact CE2-CG 3.62Å; F592-F668 HydrophobicContact CG-CB 4.24Å; F592-F668 HydrophobicContact CZ-CB 3.46Å; F592-F668 VanDerWaalsContact CZ-CB 3.46Å; F592-F668 HydrophobicContact CZ-CD1 4.09Å; F592-F668 AromaticContact CZ-CD2 3.99Å; F592-F668 HydrophobicContact CZ-CD2 3.99Å; F592-F668 AromaticContact CZ-CG 3.59Å; F592-F668 HydrophobicContact CZ-CG 3.59Å; F592-F668 PolarHBondContact N-O 2.84Å; F592-F668 PolarHBondContact O-N 2.85Å; L608-F668 HydrophobicContact CD1-CE1 4.34Å; V610-F668 HydrophobicContact CG1-CE2 3.91Å; V610-F668 HydrophobicContact CG1-CZ 4.14Å; V610-F668 HydrophobicContact CG2-CZ 4.08Å; F668-T670 HydrophobicContact CB-CG2 3.8Å; F668-T670 HydrophobicContact CD1-CG2 4.49Å; F668-L685 HydrophobicContact CD1-CD1 4.06Å; F668-V691 HydrophobicContact CD1-CB 4.47Å; F668-V691 HydrophobicContact CD1-CG1 4.01Å; F668-V691 HydrophobicContact CD1-CG2 3.73Å; F668-V691 HydrophobicContact CE1-CG1 3.73Å; F668-V691 HydrophobicContact CE1-CG2 3.94Å; F668-V691 HydrophobicContact CZ-CG1 4.09Å
669	I	91.7	Very high	87.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	98.3	171.3	-60.1	164.7	0	0	0	106.2	I580 K584 N588 V591 L667 S689 V690	I580-I669 HydrophobicContact CD1-CD1 4.28Å; I580-I669 HydrophobicContact CG1-CD1 4.09Å; I580-I669 HydrophobicContact CG2-CD1 4.05Å; K584-I669 HydrophobicContact CG-CG2 4.31Å; N588-I669 HydrophobicContact CB-CG2 3.82Å; N588-I669 VanDerWaalsContact CG-CG2 3.49Å; N588-I669 PolarHBondContact ND2-O 3.37Å; V591-I669 HydrophobicContact CG1-CG1 4.17Å; V591-I669 HydrophobicContact CG2-CG2 4.28Å; L667-I669 HydrophobicContact CD2-CD1 3.92Å; L667-I669 HydrophobicContact CD2-CG1 4.19Å; L667-I669 HydrophobicContact CG-CD1 4.31Å; L667-I669 HydrophobicContact CG-CG1 4.07Å; I669-S689 WeakPolarHBondContact O-CA 3.34Å; I669-V690 PolarHBondContact N-O 3.34Å; I669-V690 PolarHBondContact O-N 3.25Å
670	T	90	Very high	87.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.9	-158.8	72.8	0	0	0	0	112.2	N588 E589 A590 F668 L685 S689	N588-T670 WeakPolarHBondContact CB-O 3.13Å; N588-T670 PolarHBondContact ND2-N 3.46Å; N588-T670 PolarHBondContact ND2-O 2.9Å; E589-T670 PolarHBondContact N-O 2.04Å; A590-T670 PolarHBondContact N-O 3.35Å; A590-T670 PolarHBondContact O-N 3.06Å; A590-T670 PolarHBondContact O-OG1 3.23Å; F668-T670 HydrophobicContact CB-CG2 3.8Å; F668-T670 HydrophobicContact CD1-CG2 4.49Å; T670-L685 HydrophobicContact CG2-CD1 3.72Å; T670-L685 HydrophobicContact CG2-CD2 3.69Å; T670-L685 HydrophobicContact CG2-CG 4.2Å; T670-S689 WeakPolarHBondContact CA-OG 3.4Å; T670-S689 WeakPolarHBondContact CB-OG 3.33Å
671	R	87.7	Confident	87.7	Confident	98 Å²	98	60.4 Å²	60.4	37%	0.37	33%	0.328	S	S	.	.			trans	-101.6	140.8	157.5	-75.2	179.3	177.4	179.2	-6.3	105.7	R587 N588 D686 S689	R587-R671 PolarHBondContact O-NE 2.75Å; R587-R671 VanDerWaalsContact O-NE 3.11Å; R587-R671 PolarHBondContact O-NH2 2.86Å; N588-R671 PolarHBondContact ND2-N 2.87Å; R671-D686 HydrophobicContact CB-CB 3.95Å; R671-D686 WeakPolarHBondContact O-CB 3.26Å; R671-D686 PolarHBondContact O-N 2.97Å; R671-S689 PolarHBondContact N-OG 3.28Å; R671-S689 PolarHBondContact O-OG 3.25Å
672	S	81.1	Confident	87.9	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.007	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.7	-167.1	31.4	0	0	0	0	111	E589 A621 L684	E589-S672 PolarHBondContact OE2-N 3.5Å; E589-S672 VanDerWaalsContact OE2-N 3.09Å; E589-S672 VanDerWaalsContact OE2-O 3.11Å; E589-S672 PolarHBondContact OE2-OG 2.75Å; A621-S672 WeakPolarHBondContact CB-O 3.48Å; S672-L684 WeakPolarHBondContact CA-O 3Å
673	H	84.8	Confident	87.9	Confident	108 Å²	108	52.5 Å²	52.5	50%	0.5	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.2	163.1	-59.1	-73.3	0	0	0	108	L684	H673-L684 PolarHBondContact N-O 3.49Å; H673-L684 PolarHBondContact O-N 3.35Å
674	Q	84.3	Confident	88	Confident	74 Å²	74	51.5 Å²	51.5	35%	0.346	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	134.9	172.1	-52.6	-172.6	2	0	0	108.1	A621 L625 M681	A621-Q674 HydrophobicContact CB-CG 3.94Å; A621-Q674 PolarHBondContact O-NE2 2.94Å; L625-Q674 HydrophobicContact CD1-CB 4.31Å; L625-Q674 HydrophobicContact CD1-CG 3.82Å; Q674-M681 HydrophobicContact CB-CB 4.48Å; Q674-M681 HydrophobicContact CB-CE 3.52Å
675	V	85.9	Confident	88	Confident	42 Å²	42	48.2 Å²	48.2	26%	0.255	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	131.2	174.8	65.9	0	0	0	0	109.2	W640 E682 L684	W640-V675 HydrophobicContact CG-CG1 4.45Å; V675-E682 HydrophobicContact CG1-CB 4.36Å; V675-E682 PolarHBondContact N-O 3.23Å; V675-E682 PolarHBondContact O-N 2.84Å; V675-L684 HydrophobicContact CB-CB 4.11Å; V675-L684 HydrophobicContact CG1-CB 3.93Å
676	P	84.4	Confident	87.6	Confident	92 Å²	92	49.2 Å²	49.2	60%	0.597	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	135.3	172.6	28.3	-33	0	0	0	110.2	M681	P676-M681 HydrophobicContact CB-SD 3.95Å
677	Y	84.1	Confident	87	Confident	85 Å²	85	52.6 Å²	52.6	33%	0.333	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	102.7	174.1	-176.2	-97.1	0	0	0	110	W640 R680 E682	W640-Y677 AromaticContact CH2-CD2 3.82Å; W640-Y677 HydrophobicContact CH2-CD2 3.82Å; W640-Y677 AromaticContact CH2-CE2 3.63Å; W640-Y677 HydrophobicContact CH2-CE2 3.63Å; W640-Y677 HydrophobicContact CZ2-CD1 4.32Å; W640-Y677 AromaticContact CZ2-CD2 3.43Å; W640-Y677 HydrophobicContact CZ2-CD2 3.43Å; W640-Y677 VanDerWaalsContact CZ2-CD2 3.43Å; W640-Y677 HydrophobicContact CZ2-CE1 4.47Å; W640-Y677 AromaticContact CZ2-CE2 3.62Å; W640-Y677 HydrophobicContact CZ2-CE2 3.62Å; W640-Y677 AromaticContact CZ2-CG 3.8Å; W640-Y677 HydrophobicContact CZ2-CG 3.8Å; Y677-R680 PolarHBondContact N-O 3.32Å; Y677-R680 WeakPolarHBondContact O-CG 3.2Å; Y677-E682 WeakPolarHBondContact CD1-OE1 3.29Å
678	G	82.1	Confident	86.4	Confident	69 Å²	69	58.2 Å²	58.2	71%	0.711	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-134.9	-163.4	0	0	0	0	0	110	R680	G678-R680 VanDerWaalsContact C-N 3.28Å; G678-R680 PolarHBondContact O-N 2.04Å
679	D	81.2	Confident	86.1	Confident	182 Å²	182	59.3 Å²	59.3	97%	0.973	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	16.8	-177.3	-51	-33.7	0	0	0	114
680	R	83.8	Confident	85.8	Confident	101 Å²	101	59.6 Å²	59.6	38%	0.381	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.4	-177.1	63.1	177.3	-176.5	-115.2	-19.3	113.1	Y677 G678 E682	Y677-R680 PolarHBondContact N-O 3.32Å; Y677-R680 WeakPolarHBondContact O-CG 3.2Å; G678-R680 VanDerWaalsContact C-N 3.28Å; G678-R680 PolarHBondContact O-N 2.04Å; R680-E682 HydrophobicContact CG-CG 4.33Å; R680-E682 IonicContact CZ-OE1 2.7Å; R680-E682 VanDerWaalsContact CZ-OE1 3.25Å; R680-E682 IonicContact NE-OE1 3.33Å; R680-E682 PolarHBondContact NE-OE1 2.77Å; R680-E682 IonicContact NH2-OE1 2.64Å; R680-E682 PolarHBondContact NH2-OE1 2.03Å
681	M	87.1	Confident	85.8	Confident	86 Å²	86	60.8 Å²	60.8	42%	0.424	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132	169.5	-58.7	-59.4	-85.7	0	0	109.9	L625 Q674 P676	L625-M681 HydrophobicContact CD2-CB 4.27Å; L625-M681 WeakPolarHBondContact CD2-O 3.01Å; Q674-M681 HydrophobicContact CB-CB 4.48Å; Q674-M681 HydrophobicContact CB-CE 3.52Å; P676-M681 HydrophobicContact CB-SD 3.95Å
682	E	90.1	Very high	85.9	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.019	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	161.6	173.7	-62.2	-169.8	-175.7	0	0	110	R607 R638 W640 V675 Y677 R680	R607-E682 IonicContact CZ-OE1 2.93Å; R607-E682 IonicContact CZ-OE2 3.39Å; R607-E682 IonicContact NE-OE1 3.9Å; R607-E682 IonicContact NE-OE2 3.88Å; R607-E682 PolarHBondContact NE-OE2 3.35Å; R607-E682 IonicContact NH2-OE1 2.89Å; R607-E682 PolarHBondContact NH2-OE1 3.34Å; R607-E682 IonicContact NH2-OE2 3.71Å; R607-E682 PolarHBondContact NH2-OE2 2.88Å; R638-E682 HydrophobicContact CB-CG 4.17Å; R638-E682 WeakPolarHBondContact CB-OE2 3.45Å; R638-E682 WeakPolarHBondContact CD-OE1 3.43Å; W640-E682 PolarHBondContact NE1-OE2 2.8Å; V675-E682 HydrophobicContact CG1-CB 4.36Å; V675-E682 PolarHBondContact N-O 3.23Å; V675-E682 PolarHBondContact O-N 2.84Å; Y677-E682 WeakPolarHBondContact CD1-OE1 3.29Å; R680-E682 HydrophobicContact CG-CG 4.33Å; R680-E682 IonicContact CZ-OE1 2.7Å; R680-E682 VanDerWaalsContact CZ-OE1 3.25Å; R680-E682 IonicContact NE-OE1 3.33Å; R680-E682 PolarHBondContact NE-OE1 2.77Å; R680-E682 IonicContact NH2-OE1 2.64Å; R680-E682 PolarHBondContact NH2-OE1 2.03Å
683	L	90.6	Very high	86.4	Confident	1 Å²	1	63 Å²	63	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.3	-175.5	-165.7	76.9	0	0	0	110.4	A622 L625 L626 R638 V639 W640 L685	A622-L683 HydrophobicContact CB-CD1 4.19Å; L625-L683 HydrophobicContact CB-CD1 4.27Å; L625-L683 HydrophobicContact CD1-CB 4.09Å; L625-L683 HydrophobicContact CD1-CD1 3.83Å; L626-L683 HydrophobicContact CD1-CD2 3.66Å; L626-L683 HydrophobicContact CD2-CD2 4.41Å; L626-L683 HydrophobicContact CG-CD2 4.05Å; R638-L683 PolarHBondContact O-N 3.46Å; V639-L683 CarbonylContact C-O 2.92Å; V639-L683 WeakPolarHBondContact CA-O 3.02Å; V639-L683 HydrophobicContact CG2-CD2 4.37Å; W640-L683 PolarHBondContact N-O 3.24Å; L683-L685 HydrophobicContact CD2-CD2 3.91Å; L683-L685 HydrophobicContact CG-CD2 4.31Å
684	L	92.2	Very high	86.7	Confident	34 Å²	34	59.3 Å²	59.3	18%	0.178	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118.7	171	-179.4	63.4	0	0	0	110.2	L605 W640 S672 H673 V675 D686	L605-L684 HydrophobicContact CD2-CD1 4.09Å; W640-L684 HydrophobicContact CB-CD1 3.58Å; S672-L684 WeakPolarHBondContact CA-O 3Å; H673-L684 PolarHBondContact N-O 3.49Å; H673-L684 PolarHBondContact O-N 3.35Å; V675-L684 HydrophobicContact CB-CB 4.11Å; V675-L684 HydrophobicContact CG1-CB 3.93Å; L684-D686 PolarHBondContact O-N 3.32Å
685	L	90.8	Very high	87	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	122.7	173.8	-54.3	-169.4	0	0	0	109.5	V639 W640 L641 F668 T670 L683 V691	V639-L685 HydrophobicContact CG1-CD1 3.54Å; V639-L685 HydrophobicContact CG1-CD2 3.45Å; V639-L685 VanDerWaalsContact CG1-CD2 3.45Å; V639-L685 HydrophobicContact CG1-CG 3.34Å; W640-L685 VanDerWaalsContact O-CB 3.32Å; W640-L685 WeakPolarHBondContact O-CB 3.3Å; W640-L685 VanDerWaalsContact O-CG 3.3Å; W640-L685 WeakPolarHBondContact O-CG 3.06Å; W640-L685 PolarHBondContact O-N 2.63Å; L641-L685 HydrophobicContact CB-CB 4.49Å; L641-L685 HydrophobicContact CB-CD1 4.41Å; F668-L685 HydrophobicContact CD1-CD1 4.06Å; T670-L685 HydrophobicContact CG2-CD1 3.72Å; T670-L685 HydrophobicContact CG2-CD2 3.69Å; T670-L685 HydrophobicContact CG2-CG 4.2Å; L683-L685 HydrophobicContact CD2-CD2 3.91Å; L683-L685 HydrophobicContact CG-CD2 4.31Å; L685-V691 HydrophobicContact CD1-CG2 4.22Å
686	D	85.3	Confident	87.2	Confident	38 Å²	38	66.2 Å²	66.2	20%	0.203	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-62	157.7	174.3	173.2	30.8	0	0	0	111.2	R671 L684 H688 S689	R671-D686 HydrophobicContact CB-CB 3.95Å; R671-D686 WeakPolarHBondContact O-CB 3.26Å; R671-D686 PolarHBondContact O-N 2.97Å; L684-D686 PolarHBondContact O-N 3.32Å; D686-H688 PolarHBondContact O-N 3.42Å; D686-H688 VanDerWaalsContact O-N 3.12Å; D686-H688 IonicContact OD2-CD2 2.78Å; D686-H688 PolarHBondContact OD2-CD2 2.84Å; D686-H688 VanDerWaalsContact OD2-CD2 3.29Å; D686-H688 IonicContact OD2-CG 2.99Å; D686-S689 PolarHBondContact N-OG 2.86Å; D686-S689 WeakPolarHBondContact O-CA 3.36Å; D686-S689 WeakPolarHBondContact O-CB 3.3Å; D686-S689 PolarHBondContact O-N 2.04Å; D686-S689 PolarHBondContact O-OG 3.46Å
687	T	81.9	Confident	87.4	Confident	83 Å²	83	66.1 Å²	66.1	51%	0.509	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-26.1	174.3	59.3	0	0	0	0	114.7	R642 S689	R642-T687 VanDerWaalsContact NH1-CG2 3.35Å; T687-S689 VanDerWaalsContact C-N 3.29Å
688	H	82.1	Confident	87.7	Confident	117 Å²	117	63.9 Å²	63.9	54%	0.542	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.3	174.8	-65.3	-58.2	0	0	0	114.2	D686	D686-H688 PolarHBondContact O-N 3.42Å; D686-H688 VanDerWaalsContact O-N 3.12Å; D686-H688 IonicContact OD2-CD2 2.78Å; D686-H688 PolarHBondContact OD2-CD2 2.84Å; D686-H688 VanDerWaalsContact OD2-CD2 3.29Å; D686-H688 IonicContact OD2-CG 2.99Å
689	S	86.1	Confident	88.2	Confident	23 Å²	23	65.7 Å²	65.7	16%	0.161	32%	0.316	C	S	.	.			trans	-66.6	143.1	177.3	-61.5	0	0	0	0	111.2	I669 T670 R671 D686 T687	I669-S689 WeakPolarHBondContact O-CA 3.34Å; T670-S689 WeakPolarHBondContact CA-OG 3.4Å; T670-S689 WeakPolarHBondContact CB-OG 3.33Å; R671-S689 PolarHBondContact N-OG 3.28Å; R671-S689 PolarHBondContact O-OG 3.25Å; D686-S689 PolarHBondContact N-OG 2.86Å; D686-S689 WeakPolarHBondContact O-CA 3.36Å; D686-S689 WeakPolarHBondContact O-CB 3.3Å; D686-S689 PolarHBondContact O-N 2.04Å; D686-S689 PolarHBondContact O-OG 3.46Å; T687-S689 VanDerWaalsContact C-N 3.29Å
690	V	87.1	Confident	88.5	Confident	8 Å²	8	67.1 Å²	67.1	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.5	-179.3	-174.6	0	0	0	0	109.2	K578 I669 L692	K578-V690 HydrophobicContact CD-CG2 4.11Å; I669-V690 PolarHBondContact N-O 3.34Å; I669-V690 PolarHBondContact O-N 3.25Å; V690-L692 HydrophobicContact CG1-CD1 4.19Å; V690-L692 HydrophobicContact CG1-CD2 3.63Å; V690-L692 HydrophobicContact CG1-CG 3.73Å
691	V	89.3	Confident	88.9	Confident	26 Å²	26	66.5 Å²	66.5	16%	0.158	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.4	176.7	-172.5	0	0	0	0	108	L660 Y666 L667 F668 L685	L660-V691 HydrophobicContact CD1-CG1 4.17Å; L660-V691 HydrophobicContact CD2-CB 4.4Å; L660-V691 HydrophobicContact CD2-CG1 3.67Å; Y666-V691 HydrophobicContact CD1-CG1 4.06Å; Y666-V691 HydrophobicContact CG-CG1 4.13Å; L667-V691 WeakPolarHBondContact O-CA 3.4Å; F668-V691 HydrophobicContact CD1-CB 4.47Å; F668-V691 HydrophobicContact CD1-CG1 4.01Å; F668-V691 HydrophobicContact CD1-CG2 3.73Å; F668-V691 HydrophobicContact CE1-CG1 3.73Å; F668-V691 HydrophobicContact CE1-CG2 3.94Å; F668-V691 HydrophobicContact CZ-CG1 4.09Å; L685-V691 HydrophobicContact CD1-CG2 4.22Å
692	L	89.6	Confident	89.2	Confident	28 Å²	28	62.4 Å²	62.4	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.4	-176.1	-55.7	173.3	0	0	0	110.3	S576 Y666 L667 V690 W694 W698	S576-L692 WeakPolarHBondContact OG-CD2 3.47Å; Y666-L692 CarbonylContact C-O 3.57Å; Y666-L692 VanDerWaalsContact CA-O 3.25Å; Y666-L692 WeakPolarHBondContact CA-O 3.48Å; L667-L692 PolarHBondContact N-O 2.98Å; L667-L692 PolarHBondContact O-N 3.5Å; V690-L692 HydrophobicContact CG1-CD1 4.19Å; V690-L692 HydrophobicContact CG1-CD2 3.63Å; V690-L692 HydrophobicContact CG1-CG 3.73Å; L692-W694 PolarHBondContact O-N 3.38Å; L692-W698 HydrophobicContact CB-CH2 3.52Å; L692-W698 HydrophobicContact CB-CZ3 3.85Å; L692-W698 HydrophobicContact CD1-CH2 3.82Å; L692-W698 HydrophobicContact CD1-CZ2 4.18Å; L692-W698 HydrophobicContact CD1-CZ3 4.45Å; L692-W698 HydrophobicContact CG-CH2 4.3Å
693	K	90.7	Very high	89.3	Confident	116 Å²	116	64.1 Å²	64.1	50%	0.504	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	128.2	171.4	-169.9	170.7	-176.9	171.1	0	109.6	Y666 W698	Y666-K693 HydrophobicContact CD1-CB 4.3Å; Y666-K693 HydrophobicContact CE1-CB 4.09Å; Y666-K693 HydrophobicContact CE1-CG 4.48Å; K693-W698 VanDerWaalsContact O-CH2 3.24Å; K693-W698 WeakPolarHBondContact O-CH2 3.45Å; K693-W698 VanDerWaalsContact O-CZ3 3.23Å; K693-W698 WeakPolarHBondContact O-CZ3 3.36Å
694	W	92.4	Very high	89.3	Confident	32 Å²	32	71 Å²	71	12%	0.121	33%	0.328	C	S	.	.			trans	-58.4	138.8	-172.3	175.7	-106.9	0	0	0	111.8	R593 W616 S665 L667 L692 E696 W698 R699 L702	R593-W694 HydrophobicContact CB-CE3 4.21Å; R593-W694 HydrophobicContact CB-CZ3 4.24Å; R593-W694 HydrophobicContact CG-CD2 4.01Å; R593-W694 HydrophobicContact CG-CE3 3.86Å; R593-W694 HydrophobicContact CG-CG 4.43Å; R593-W694 HydrophobicContact CG-CZ3 4.32Å; W616-W694 AromaticContact CH2-CH2 3.45Å; W616-W694 HydrophobicContact CH2-CH2 3.45Å; W616-W694 VanDerWaalsContact CH2-CH2 3.45Å; W616-W694 HydrophobicContact CH2-CZ2 4.49Å; W616-W694 AromaticContact CH2-CZ3 3.6Å; W616-W694 HydrophobicContact CH2-CZ3 3.6Å; W616-W694 AromaticContact CZ2-CH2 3.95Å; W616-W694 HydrophobicContact CZ2-CH2 3.95Å; W616-W694 HydrophobicContact CZ2-CZ3 4.47Å; W616-W694 HydrophobicContact CZ3-CH2 4.41Å; W616-W694 HydrophobicContact CZ3-CZ3 4.14Å; S665-W694 VanDerWaalsContact O-CB 3.31Å; S665-W694 WeakPolarHBondContact O-CB 3.03Å; S665-W694 PolarHBondContact O-N 3.37Å; L667-W694 HydrophobicContact CB-CE3 4.11Å; L667-W694 HydrophobicContact CD1-CZ3 4.26Å; L692-W694 PolarHBondContact O-N 3.38Å; W694-E696 PolarHBondContact NE1-OE2 2.98Å; W694-W698 HydrophobicContact CE3-CE3 4Å; W694-W698 HydrophobicContact CH2-CB 4.16Å; W694-W698 HydrophobicContact CZ3-CB 4.13Å; W694-W698 HydrophobicContact CZ3-CE3 4.27Å; W694-R699 HydrophobicContact CH2-CB 4.22Å; W694-R699 HydrophobicContact CZ2-CB 4.05Å; W694-L702 HydrophobicContact CH2-CD1 4.49Å; W694-L702 HydrophobicContact CZ3-CD1 4.22Å
695	R	91.2	Very high	89.3	Confident	165 Å²	165	70.4 Å²	70.4	62%	0.623	32%	0.324	S	S	*	.			trans	-127.7	131.1	169.7	-63.3	-175.7	-179.2	-171	-1.5	109.2	S697 W698	R695-S697 PolarHBondContact O-N 3.37Å; R695-S697 VanDerWaalsContact O-N 3.15Å; R695-W698 HydrophobicContact CB-CD2 4.03Å; R695-W698 HydrophobicContact CB-CE3 4.24Å; R695-W698 HydrophobicContact CB-CG 4.48Å; R695-W698 HydrophobicContact CB-CH2 4.41Å; R695-W698 HydrophobicContact CB-CZ2 4.24Å; R695-W698 HydrophobicContact CB-CZ3 4.44Å; R695-W698 HydrophobicContact CG-CH2 4.13Å; R695-W698 HydrophobicContact CG-CZ2 4.07Å; R695-W698 WeakPolarHBondContact O-CB 3.19Å; R695-W698 PolarHBondContact O-N 3.36Å
696	E	89.7	Confident	89.4	Confident	96 Å²	96	72.9 Å²	72.9	45%	0.449	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.5	-174.4	-164.3	46.9	-123.7	0	0	113.1	W694 W698 R699	W694-E696 PolarHBondContact NE1-OE2 2.98Å; E696-W698 PolarHBondContact O-N 3.42Å; E696-R699 WeakPolarHBondContact O-CB 3.4Å; E696-R699 PolarHBondContact O-N 2.79Å; E696-R699 VanDerWaalsContact O-N 3.1Å; E696-R699 WeakPolarHBondContact OE1-CD 3.3Å; E696-R699 IonicContact OE1-CZ 2.75Å; E696-R699 IonicContact OE1-NE 2.95Å; E696-R699 PolarHBondContact OE1-NE 3.03Å; E696-R699 IonicContact OE1-NH1 2.79Å; E696-R699 IonicContact OE1-NH2 3.03Å; E696-R699 PolarHBondContact OE1-NH2 3.18Å; E696-R699 IonicContact OE2-CZ 3.84Å; E696-R699 IonicContact OE2-NE 3.18Å; E696-R699 IonicContact OE2-NH2 2.79Å; E696-R699 PolarHBondContact OE2-NH2 3.21Å
697	S	87.8	Confident	89.6	Confident	90 Å²	90	79.2 Å²	79.2	63%	0.629	36%	0.36	S	S	*	.	H	α-helix	trans	-59.3	-19.1	174.6	60.8	0	0	0	0	114.4	R695	R695-S697 PolarHBondContact O-N 3.37Å; R695-S697 VanDerWaalsContact O-N 3.15Å
698	W	91.4	Very high	90	Very high	37 Å²	37	80.5 Å²	80.5	14%	0.14	36%	0.356	C	S	.	.	H	α-helix	trans	-76.8	-25.1	176.8	-63.2	-19.9	0	0	0	113.8	I580 L667 L692 K693 W694 R695 E696 R700 R701 L702	I580-W698 HydrophobicContact CD1-CB 4.49Å; I580-W698 HydrophobicContact CD1-CD2 3.65Å; I580-W698 HydrophobicContact CD1-CE3 4.23Å; I580-W698 HydrophobicContact CD1-CG 3.78Å; I580-W698 HydrophobicContact CD1-CZ2 4.34Å; L667-W698 HydrophobicContact CB-CE3 3.9Å; L667-W698 HydrophobicContact CB-CZ3 3.74Å; L667-W698 HydrophobicContact CD2-CD2 4.05Å; L667-W698 HydrophobicContact CD2-CE3 3.44Å; L667-W698 VanDerWaalsContact CD2-CE3 3.44Å; L667-W698 HydrophobicContact CD2-CZ3 3.82Å; L667-W698 HydrophobicContact CG-CE3 4.3Å; L667-W698 HydrophobicContact CG-CZ3 4.45Å; L692-W698 HydrophobicContact CB-CH2 3.52Å; L692-W698 HydrophobicContact CB-CZ3 3.85Å; L692-W698 HydrophobicContact CD1-CH2 3.82Å; L692-W698 HydrophobicContact CD1-CZ2 4.18Å; L692-W698 HydrophobicContact CD1-CZ3 4.45Å; L692-W698 HydrophobicContact CG-CH2 4.3Å; K693-W698 VanDerWaalsContact O-CH2 3.24Å; K693-W698 WeakPolarHBondContact O-CH2 3.45Å; K693-W698 VanDerWaalsContact O-CZ3 3.23Å; K693-W698 WeakPolarHBondContact O-CZ3 3.36Å; W694-W698 HydrophobicContact CE3-CE3 4Å; W694-W698 HydrophobicContact CH2-CB 4.16Å; W694-W698 HydrophobicContact CZ3-CB 4.13Å; W694-W698 HydrophobicContact CZ3-CE3 4.27Å; R695-W698 HydrophobicContact CB-CD2 4.03Å; R695-W698 HydrophobicContact CB-CE3 4.24Å; R695-W698 HydrophobicContact CB-CG 4.48Å; R695-W698 HydrophobicContact CB-CH2 4.41Å; R695-W698 HydrophobicContact CB-CZ2 4.24Å; R695-W698 HydrophobicContact CB-CZ3 4.44Å; R695-W698 HydrophobicContact CG-CH2 4.13Å; R695-W698 HydrophobicContact CG-CZ2 4.07Å; R695-W698 WeakPolarHBondContact O-CB 3.19Å; R695-W698 PolarHBondContact O-N 3.36Å; E696-W698 PolarHBondContact O-N 3.42Å; W698-R700 PolarHBondContact O-N 2.93Å; W698-R701 PolarHBondContact O-N 2.8Å; W698-R701 VanDerWaalsContact O-N 3.08Å; W698-L702 HydrophobicContact CB-CD1 4.27Å; W698-L702 WeakPolarHBondContact O-CG 3.5Å; W698-L702 PolarHBondContact O-N 3.48Å
699	R	91.1	Very high	90.3	Very high	107 Å²	107	76.1 Å²	76.1	40%	0.404	34%	0.34	S	S	.	.	H	α-helix	trans	-55.1	-50.8	-176	-170.1	-177.7	-62.7	-171.6	7.1	112.2	W694 E696 R701 S703	W694-R699 HydrophobicContact CH2-CB 4.22Å; W694-R699 HydrophobicContact CZ2-CB 4.05Å; E696-R699 WeakPolarHBondContact O-CB 3.4Å; E696-R699 PolarHBondContact O-N 2.79Å; E696-R699 VanDerWaalsContact O-N 3.1Å; E696-R699 WeakPolarHBondContact OE1-CD 3.3Å; E696-R699 IonicContact OE1-CZ 2.75Å; E696-R699 IonicContact OE1-NE 2.95Å; E696-R699 PolarHBondContact OE1-NE 3.03Å; E696-R699 IonicContact OE1-NH1 2.79Å; E696-R699 IonicContact OE1-NH2 3.03Å; E696-R699 PolarHBondContact OE1-NH2 3.18Å; E696-R699 IonicContact OE2-CZ 3.84Å; E696-R699 IonicContact OE2-NE 3.18Å; E696-R699 IonicContact OE2-NH2 2.79Å; E696-R699 PolarHBondContact OE2-NH2 3.21Å; R699-R701 VanDerWaalsContact C-N 3.35Å; R699-R701 PolarHBondContact O-N 3.4Å; R699-S703 WeakPolarHBondContact O-CB 3.34Å; R699-S703 PolarHBondContact O-N 2.72Å; R699-S703 VanDerWaalsContact O-N 3.11Å; R699-S703 PolarHBondContact O-OG 3.3Å
700	R	88.6	Confident	90.2	Very high	213 Å²	213	79.2 Å²	79.2	80%	0.804	37%	0.367	S	S	*	.	H	α-helix	trans	-64.9	-38.5	178.8	-67.5	-176.8	-179	173.6	0.6	111.7	W698 K704	W698-R700 PolarHBondContact O-N 2.93Å; R700-K704 WeakPolarHBondContact O-CG 3.35Å; R700-K704 PolarHBondContact O-N 2.94Å; R700-K704 VanDerWaalsContact O-N 3.09Å
701	R	91.4	Very high	90	Very high	87 Å²	87	89.2 Å²	89.2	33%	0.328	40%	0.404	S	S	.	.	H	α-helix	trans	-69.4	-45.5	-178.2	-171.6	177.3	-179.6	121.1	2.7	112.1	I580 W698 R699 K704 F705	I580-R701 VanDerWaalsContact O-CZ 3.22Å; I580-R701 PolarHBondContact O-NE 2.82Å; I580-R701 PolarHBondContact O-NH2 3.27Å; W698-R701 PolarHBondContact O-N 2.8Å; W698-R701 VanDerWaalsContact O-N 3.08Å; R699-R701 VanDerWaalsContact C-N 3.35Å; R699-R701 PolarHBondContact O-N 3.4Å; R701-K704 WeakPolarHBondContact O-CB 3.41Å; R701-K704 PolarHBondContact O-N 3.12Å; R701-F705 HydrophobicContact CG-CE1 4.3Å; R701-F705 HydrophobicContact CG-CE2 4.13Å; R701-F705 HydrophobicContact CG-CZ 3.88Å; R701-F705 WeakPolarHBondContact O-CG 3.43Å; R701-F705 PolarHBondContact O-N 3.08Å
702	L	93.5	Very high	89.1	Confident	1 Å²	1	92.1 Å²	92.1	1%	0.005	42%	0.416	C	S	.	.	H	α-helix	trans	-65.6	-39.3	176.9	-68.9	169.6	0	0	0	111.4	I580 F585 V591 W616 L667 W694 W698 K704 F705 V706	I580-L702 HydrophobicContact CG2-CD2 4.25Å; F585-L702 HydrophobicContact CD2-CD2 4.2Å; V591-L702 HydrophobicContact CG1-CD2 3.99Å; W616-L702 HydrophobicContact CD2-CB 3.78Å; W616-L702 HydrophobicContact CD2-CD1 3.83Å; W616-L702 HydrophobicContact CD2-CG 4.36Å; W616-L702 HydrophobicContact CE3-CD1 3.71Å; W616-L702 HydrophobicContact CG-CB 3.79Å; W616-L702 HydrophobicContact CH2-CD1 3.87Å; W616-L702 HydrophobicContact CZ2-CB 4.33Å; W616-L702 HydrophobicContact CZ2-CD1 3.99Å; W616-L702 HydrophobicContact CZ3-CD1 3.72Å; L667-L702 HydrophobicContact CD1-CD1 3.82Å; L667-L702 HydrophobicContact CD2-CD1 4.2Å; W694-L702 HydrophobicContact CH2-CD1 4.49Å; W694-L702 HydrophobicContact CZ3-CD1 4.22Å; W698-L702 HydrophobicContact CB-CD1 4.27Å; W698-L702 WeakPolarHBondContact O-CG 3.5Å; W698-L702 PolarHBondContact O-N 3.48Å; L702-K704 VanDerWaalsContact C-N 3.3Å; L702-K704 PolarHBondContact O-N 2.94Å; L702-F705 HydrophobicContact CD2-CD2 4.26Å; L702-F705 WeakPolarHBondContact O-CA 3.22Å; L702-F705 WeakPolarHBondContact O-CB 3.32Å; L702-F705 PolarHBondContact O-N 2.87Å; L702-V706 PolarHBondContact O-N 2.9Å
703	S	91.6	Very high	88.3	Confident	40 Å²	40	94.1 Å²	94.1	28%	0.28	43%	0.432	S	S	.	.	H	α-helix	trans	-61.4	-37.1	173.2	-54.4	0	0	0	0	112.5	R699 F705 V706 R707	R699-S703 WeakPolarHBondContact O-CB 3.34Å; R699-S703 PolarHBondContact O-N 2.72Å; R699-S703 VanDerWaalsContact O-N 3.11Å; R699-S703 PolarHBondContact O-OG 3.3Å; S703-F705 VanDerWaalsContact C-N 3.34Å; S703-V706 PolarHBondContact O-N 3.07Å; S703-R707 WeakPolarHBondContact O-CG 3.2Å; S703-R707 PolarHBondContact O-N 3.09Å
704	K	90.9	Very high	87.6	Confident	146 Å²	146	90.1 Å²	90.1	64%	0.635	42%	0.418	S	S	*	.	H	α-helix	trans	-64.6	-37.5	171.5	-73.9	178.8	-178.7	-174	0	111.9	R700 R701 L702 R707 R708	R700-K704 WeakPolarHBondContact O-CG 3.35Å; R700-K704 PolarHBondContact O-N 2.94Å; R700-K704 VanDerWaalsContact O-N 3.09Å; R701-K704 WeakPolarHBondContact O-CB 3.41Å; R701-K704 PolarHBondContact O-N 3.12Å; L702-K704 VanDerWaalsContact C-N 3.3Å; L702-K704 PolarHBondContact O-N 2.94Å; K704-R707 PolarHBondContact O-N 3.01Å; K704-R708 WeakPolarHBondContact O-CB 3.05Å; K704-R708 PolarHBondContact O-N 3.18Å
705	F	93.7	Very high	86.4	Confident	21 Å²	21	93.6 Å²	93.6	9%	0.092	44%	0.439	C	S	.	.	H	α-helix	trans	-66.7	-40.8	176.3	-66.2	-14.7	0	0	0	112.4	I580 F582 F585 R701 L702 S703 R707 R708 A709	I580-F705 HydrophobicContact CG2-CE2 3.95Å; I580-F705 WeakPolarHBondContact O-CZ 3.44Å; F582-F705 HydrophobicContact CB-CD1 3.97Å; F582-F705 HydrophobicContact CB-CE1 3.8Å; F582-F705 HydrophobicContact CB-CG 4.5Å; F582-F705 HydrophobicContact CB-CZ 4.17Å; F582-F705 HydrophobicContact CD2-CB 3.77Å; F582-F705 AromaticContact CD2-CD1 3.62Å; F582-F705 HydrophobicContact CD2-CD1 3.62Å; F582-F705 HydrophobicContact CD2-CE1 4.33Å; F582-F705 AromaticContact CD2-CG 3.74Å; F582-F705 HydrophobicContact CD2-CG 3.74Å; F582-F705 HydrophobicContact CE2-CB 4.15Å; F582-F705 WeakPolarHBondContact CE2-O 3.43Å; F582-F705 HydrophobicContact CG-CD1 4.22Å; F585-F705 HydrophobicContact CB-CB 4.43Å; F585-F705 HydrophobicContact CB-CD2 3.78Å; F585-F705 HydrophobicContact CB-CE2 4.44Å; F585-F705 HydrophobicContact CB-CG 4.42Å; F585-F705 HydrophobicContact CD1-CB 3.81Å; F585-F705 HydrophobicContact CD2-CB 4.14Å; F585-F705 HydrophobicContact CD2-CD2 4.29Å; F585-F705 HydrophobicContact CE1-CB 4.04Å; F585-F705 HydrophobicContact CE2-CB 4.36Å; F585-F705 HydrophobicContact CG-CB 3.86Å; F585-F705 HydrophobicContact CG-CD2 4.02Å; F585-F705 HydrophobicContact CG-CG 4.35Å; F585-F705 HydrophobicContact CZ-CB 4.31Å; R701-F705 HydrophobicContact CG-CE1 4.3Å; R701-F705 HydrophobicContact CG-CE2 4.13Å; R701-F705 HydrophobicContact CG-CZ 3.88Å; R701-F705 WeakPolarHBondContact O-CG 3.43Å; R701-F705 PolarHBondContact O-N 3.08Å; L702-F705 HydrophobicContact CD2-CD2 4.26Å; L702-F705 WeakPolarHBondContact O-CA 3.22Å; L702-F705 WeakPolarHBondContact O-CB 3.32Å; L702-F705 PolarHBondContact O-N 2.87Å; S703-F705 VanDerWaalsContact C-N 3.34Å; F705-R707 PolarHBondContact O-N 3.14Å; F705-R708 PolarHBondContact O-N 3.06Å; F705-A709 WeakPolarHBondContact O-CB 3.09Å; F705-A709 PolarHBondContact O-N 2.85Å
706	V	91.5	Very high	84.5	Confident	57 Å²	57	89.9 Å²	89.9	35%	0.345	44%	0.438	S	S	.	.	H	α-helix	trans	-58.2	-49.2	172.8	177.7	0	0	0	0	111.2	F585 W616 L702 S703 R708 A709 A710	F585-V706 HydrophobicContact CE2-CG2 4.47Å; F585-V706 HydrophobicContact CZ-CG2 3.96Å; W616-V706 HydrophobicContact CB-CG2 3.72Å; W616-V706 HydrophobicContact CG-CG2 4.15Å; W616-V706 VanDerWaalsContact O-CG2 3.3Å; W616-V706 WeakPolarHBondContact O-CG2 3.48Å; L702-V706 PolarHBondContact O-N 2.9Å; S703-V706 PolarHBondContact O-N 3.07Å; V706-R708 VanDerWaalsContact C-N 3.28Å; V706-R708 PolarHBondContact O-N 2.81Å; V706-A709 PolarHBondContact O-N 2.04Å; V706-A710 PolarHBondContact O-N 2.67Å
707	R	90.4	Very high	82.5	Confident	170 Å²	170	91 Å²	91	64%	0.642	44%	0.444	S	S	*	.	H	α-helix	trans	-62.6	-34.8	177.7	-67.2	177.9	-166.3	179.7	2.3	112.7	S703 K704 F705 R711	S703-R707 WeakPolarHBondContact O-CG 3.2Å; S703-R707 PolarHBondContact O-N 3.09Å; K704-R707 PolarHBondContact O-N 3.01Å; F705-R707 PolarHBondContact O-N 3.14Å; R707-R711 WeakPolarHBondContact O-CG 3.47Å; R707-R711 PolarHBondContact O-N 3.36Å
708	R	90.5	Very high	80.4	Confident	111 Å²	111	95.2 Å²	95.2	42%	0.419	45%	0.451	S	S	.	.	H	α-helix	trans	-70.2	-45.3	176.4	-172.5	177	177.6	179.8	-3	111	F582 K704 F705 V706 A710 R711 E712	F582-R708 HydrophobicContact CD1-CG 4.41Å; F582-R708 HydrophobicContact CD2-CB 4.33Å; F582-R708 HydrophobicContact CD2-CG 4.42Å; F582-R708 HydrophobicContact CE1-CG 3.87Å; F582-R708 HydrophobicContact CE2-CB 3.75Å; F582-R708 HydrophobicContact CE2-CG 3.9Å; F582-R708 HydrophobicContact CZ-CB 3.9Å; F582-R708 HydrophobicContact CZ-CG 3.59Å; K704-R708 WeakPolarHBondContact O-CB 3.05Å; K704-R708 PolarHBondContact O-N 3.18Å; F705-R708 PolarHBondContact O-N 3.06Å; V706-R708 VanDerWaalsContact C-N 3.28Å; V706-R708 PolarHBondContact O-N 2.81Å; R708-A710 PolarHBondContact O-N 3.31Å; R708-R711 PolarHBondContact O-N 2.68Å; R708-E712 IonicContact CZ-OE2 3.66Å; R708-E712 IonicContact NE-OE2 2.99Å; R708-E712 PolarHBondContact NE-OE2 3.23Å; R708-E712 IonicContact NH2-OE2 3.43Å; R708-E712 PolarHBondContact NH2-OE2 3.42Å; R708-E712 PolarHBondContact O-N 3.23Å
709	A	87.3	Confident	77.7	Confident	24 Å²	24	101 Å²	101	20%	0.198	49%	0.485	C	S	.	.	H	α-helix	trans	-62.4	-27.6	176.4	0	0	0	0	0	113.5	F582 F585 F705 V706 R711 E712	F582-A709 HydrophobicContact CE2-CB 4.14Å; F582-A709 HydrophobicContact CZ-CB 4.17Å; F585-A709 HydrophobicContact CE1-CB 4.1Å; F705-A709 WeakPolarHBondContact O-CB 3.09Å; F705-A709 PolarHBondContact O-N 2.85Å; V706-A709 PolarHBondContact O-N 2.04Å; A709-R711 VanDerWaalsContact C-N 3.35Å; A709-E712 CarbonylContact C-O 3.58Å; A709-E712 VanDerWaalsContact CA-O 3.32Å; A709-E712 WeakPolarHBondContact CA-O 3.44Å; A709-E712 VanDerWaalsContact O-O 3.1Å
710	A	84.9	Confident	75	Confident	89 Å²	89	101.1 Å²	101.1	74%	0.736	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.4	173.5	0	0	0	0	0	113.9	V706 R708	V706-A710 PolarHBondContact O-N 2.67Å; R708-A710 PolarHBondContact O-N 3.31Å
711	R	81.9	Confident	72.4	Confident	217 Å²	217	96.8 Å²	96.8	82%	0.819	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-43.9	180	-69.7	175	-175.3	-174	-1.3	112.3	R707 R708 A709	R707-R711 WeakPolarHBondContact O-CG 3.47Å; R707-R711 PolarHBondContact O-N 3.36Å; R708-R711 PolarHBondContact O-N 2.68Å; A709-R711 VanDerWaalsContact C-N 3.35Å
712	E	71.7	Confident	69.4	Low	87 Å²	87	98 Å²	98	41%	0.407	52%	0.515	S	S	.	.	S	Bend	trans	-113	109.6	175.6	-67.6	163.9	-158.1	0	0	104.9	R708 A709 C714	R708-E712 IonicContact CZ-OE2 3.66Å; R708-E712 IonicContact NE-OE2 2.99Å; R708-E712 PolarHBondContact NE-OE2 3.23Å; R708-E712 IonicContact NH2-OE2 3.43Å; R708-E712 PolarHBondContact NH2-OE2 3.42Å; R708-E712 PolarHBondContact O-N 3.23Å; A709-E712 CarbonylContact C-O 3.58Å; A709-E712 VanDerWaalsContact CA-O 3.32Å; A709-E712 WeakPolarHBondContact CA-O 3.44Å; A709-E712 VanDerWaalsContact O-O 3.1Å; E712-C714 PolarHBondContact O-N 3.14Å
713	S	71.9	Confident	66.7	Low	71 Å²	71	104.5 Å²	104.5	50%	0.497	56%	0.555	S	S	.	*			trans	-50.7	146.5	176.4	-169.9	0	0	0	0	109.3	D715 S716	S713-D715 PolarHBondContact O-N 3.16Å; S713-D715 PolarHBondContact OG-OD2 3.44Å; S713-S716 PolarHBondContact O-N 3.35Å
714	C	77	Confident	63.8	Low	31 Å²	31	108.5 Å²	108.5	21%	0.209	57%	0.573	C	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	9.3	178.1	-86.9	0	0	0	0	114.5	C586 R617 E712	C586-C714 HydrophobicContact CB-CB 3.52Å; C586-C714 WeakPolarHBondContact CB-SG 3.21Å; C586-C714 VanDerWaalsContact SG-CA 3.56Å; C586-C714 WeakPolarHBondContact SG-CB 3Å; C586-C714 CovalentContact SG-SG 2.05Å; C586-C714 PolarHBondContact SG-SG 3.2Å; R617-C714 PolarHBondContact NH1-SG 2.9Å; E712-C714 PolarHBondContact O-N 3.14Å
715	D	65.6	Low	61.2	Low	105 Å²	105	108.9 Å²	108.9	56%	0.561	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	5.2	-176.6	-57.9	-52.1	0	0	0	114	S713 E717 K718	S713-D715 PolarHBondContact O-N 3.16Å; S713-D715 PolarHBondContact OG-OD2 3.44Å; D715-E717 PolarHBondContact O-N 2.99Å; D715-K718 PolarHBondContact O-N 3.3Å
716	S	52.9	Low	58.4	Low	87 Å²	87	114.3 Å²	114.3	61%	0.608	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	27.4	-173.9	73.1	0	0	0	0	116.1	S713	S713-S716 PolarHBondContact O-N 3.35Å
717	E	47.1	Very low	55.6	Low	120 Å²	120	117.4 Å²	117.4	56%	0.561	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.1	15.8	178.4	-111.3	-174.2	169.7	0	0	113.9	K583 D715	K583-E717 VanDerWaalsContact CD-OE2 3.25Å; K583-E717 WeakPolarHBondContact CD-OE2 3.41Å; K583-E717 WeakPolarHBondContact CE-OE2 3.47Å; K583-E717 IonicContact NZ-OE1 2.79Å; K583-E717 PolarHBondContact NZ-OE1 3.06Å; K583-E717 IonicContact NZ-OE2 3.66Å; K583-E717 PolarHBondContact NZ-OE2 3.06Å; D715-E717 PolarHBondContact O-N 2.99Å
718	K	43.2	Very low	52.9	Low	179 Å²	179	114.9 Å²	114.9	78%	0.778	63%	0.63	S	S	*	*	S	Bend	trans	-90.8	2	175	-87.9	-174.2	176.5	-179.7	0	115	D715	D715-K718 PolarHBondContact O-N 3.3Å
719	N	34.7	Very low	50.1	Low	159 Å²	159	116.6 Å²	116.6	85%	0.85	65%	0.648	S	S	*	*			trans	-119.9	66.1	170.8	-79.9	5.2	0	0	0	111.2
720	S	33.9	Very low	47.6	Very low	108 Å²	108	122.4 Å²	122.4	76%	0.755	68%	0.676	S	S	*	*			trans	-116.7	76.6	153.1	63.6	0	0	0	0	106.6
721	V	34	Very low	45.2	Very low	123 Å²	123	122.9 Å²	122.9	75%	0.745	67%	0.674	S	S	*	*			trans	-71.7	126	164.5	173.9	0	0	0	0	106.4	V723	V721-V723 PolarHBondContact O-N 3.15Å
722	V	30.3	Very low	42.9	Very low	111 Å²	111	119.9 Å²	119.9	67%	0.673	67%	0.673	S	S	*	*			trans	-14.9	115.2	159.4	-173.9	0	0	0	0	113
723	V	36.1	Very low	41	Very low	138 Å²	138	125.1 Å²	125.1	84%	0.836	69%	0.691	S	S	*	*			trans	-136.4	111.9	149.5	-178	0	0	0	0	105.3	V721	V721-V723 PolarHBondContact O-N 3.15Å
724	D	30.9	Very low	39.1	Very low	125 Å²	125	128 Å²	128	67%	0.668	70%	0.701	S	S	*	*			trans	-59	135	168.8	-58.9	-63.9	0	0	0	109.9
725	D	36.1	Very low	37.1	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	73%	0.731	S	S	*	*			trans	164	112.3	131.3	-91.7	-23.1	0	0	0	110.6
726	D	34.1	Very low	35.7	Very low	135 Å²	135	138.5 Å²	138.5	72%	0.722	75%	0.745	S	S	*	*			trans	44.1	129.3	130.6	-101.8	5.9	0	0	0	122.4
727	N	33.4	Very low	34.6	Very low	122 Å²	122	143.4 Å²	143.4	65%	0.652	76%	0.755	S	S	*	*			trans	87.6	111.1	138.1	-70.7	-36.7	0	0	0	120.7
728	T	33.1	Very low	33.8	Very low	117 Å²	117	148.9 Å²	148.9	72%	0.718	77%	0.771	S	S	*	*			trans	82.3	111.8	130.3	39.5	0	0	0	0	120.4
729	D	32.5	Very low	33.4	Very low	146 Å²	146	146.9 Å²	146.9	78%	0.781	77%	0.773	S	S	*	*				64	102.3	122.9	-74.5	-7	0	0	0	121.1
730	D	33.4	Very low	33.2	Very low	147 Å²	147	151 Å²	151	79%	0.786	78%	0.777	S	S	*	*				92.7	128.6	107.9	-140.4	8.8	0	0	0	119.7
731	S	34.5	Very low	33.1	Very low	99 Å²	99	157.8 Å²	157.8	69%	0.692	79%	0.786	S	S	*	*			trans	74	133.8	155	82.6	0	0	0	0	121.1
732	N	34.9	Very low	33	Very low	153 Å²	153	157.7 Å²	157.7	82%	0.818	79%	0.786	S	S	*	*			trans	101	82.7	144	-116	-9.1	0	0	0	121.1
733	Y	31	Very low	33.1	Very low	198 Å²	198	161.6 Å²	161.6	78%	0.776	80%	0.796	S	S	*	*				34.1	121.9	116.6	-127.3	-99.8	0	0	0	120.7
734	D	32.7	Very low	32.8	Very low	130 Å²	130	164.9 Å²	164.9	70%	0.695	79%	0.794	S	S	*	*			trans	50.8	111.4	151.3	-89	-25.1	0	0	0	119.7
735	K	34.5	Very low	32.9	Very low	194 Å²	194	167.1 Å²	167.1	84%	0.843	81%	0.805	S	S	*	*				-179.2	156.4	113.4	-104	166.3	-179.7	170.7	0	113.3
736	L	35.6	Very low	32.6	Very low	163 Å²	163	171.3 Å²	171.3	85%	0.853	81%	0.809	S	S	*	*			trans	92.6	86.3	151.8	-72.5	141.3	0	0	0	119.3
737	K	30.3	Very low	32.6	Very low	191 Å²	191	171 Å²	171	83%	0.83	82%	0.815	S	S	*	*			trans	-38.9	154.2	138.2	-75.6	172.9	173.7	170.6	0	113.4
738	R	30.7	Very low	32.5	Very low	235 Å²	235	168.4 Å²	168.4	89%	0.887	82%	0.817	S	S	*	*			trans	78.7	113	165.2	-70.4	173.8	162.2	155.2	-6.8	112.3
739	T	34.9	Very low	32.6	Very low	136 Å²	136	168.3 Å²	168.3	83%	0.834	82%	0.818	S	S	*	*				-164	140.6	75.6	32.3	0	0	0	0	110.8
740	R	30.4	Very low	32.7	Very low	247 Å²	247	167.9 Å²	167.9	93%	0.932	82%	0.816	S	S	*	*			trans	-75.4	128	162.1	-80.2	177.5	169.4	174.5	-5.4	108.3
741	R	32	Very low	32.6	Very low	249 Å²	249	169.4 Å²	169.4	94%	0.94	81%	0.812	S	S	*	*			trans	-136.8	115.9	152.9	-129.5	178.2	-169.6	176	2.4	108.4
742	V	30.9	Very low	32.5	Very low	121 Å²	121	173.6 Å²	173.6	73%	0.733	81%	0.814	S	S	*	*			trans	-84.7	119.3	175.7	170.9	0	0	0	0	106.7	R744	V742-R744 HydrophobicContact CG1-CG 4.27Å
743	Q	33.8	Very low	32.5	Very low	193 Å²	193	171.3 Å²	171.3	90%	0.902	81%	0.81	S	S	*	*			trans	-110.5	117.1	157.4	-92	172.1	-31.6	0	0	107.2
744	R	28.3	Very low	32.7	Very low	207 Å²	207	166 Å²	166	78%	0.781	80%	0.801	S	S	*	*			trans	-82.5	131.5	169.6	-72.8	-179.4	-173.7	175.7	1.9	108	V742	V742-R744 HydrophobicContact CG1-CG 4.27Å
745	L	34.3	Very low	32.8	Very low	173 Å²	173	167.6 Å²	167.6	91%	0.906	81%	0.81	S	S	*	*			trans	-128.3	133.5	157.6	-78	167.4	0	0	0	108.6
746	R	28.9	Very low	32.6	Very low	241 Å²	241	165.3 Å²	165.3	91%	0.909	81%	0.813	S	S	*	*			trans	-69.9	164.9	176	-63	177.4	-174	179.1	1.2	110.1
747	P	34	Very low	32.6	Very low	129 Å²	129	166.5 Å²	166.5	84%	0.838	81%	0.814	S	S	*	*				-141.4	151.6	120.9	19	2.8	0	0	0	114.9
748	G	31.9	Very low	32.8	Very low	67 Å²	67	162.5 Å²	162.5	69%	0.691	81%	0.805	S	S	*	*			trans	-81.1	-174.1	168.5	0	0	0	0	0	113.4
749	P	35.2	Very low	33	Very low	115 Å²	115	157.2 Å²	157.2	75%	0.747	80%	0.795	S	S	*	*			trans	-101.6	-171.4	-150.3	39.9	-33.5	0	0	0	114.2
750	D	33.7	Very low	33	Very low	138 Å²	138	158.6 Å²	158.6	74%	0.738	79%	0.792	S	S	*	*			trans	106.6	140.2	166.3	-54.3	-24	0	0	0	114.5
751	Y	33	Very low	33.2	Very low	178 Å²	178	154.6 Å²	154.6	70%	0.698	78%	0.783	S	S	*	*			cis	-170.3	147.6	-6.6	-133.8	-124.8	0	0	0	105.9
752	Y	32.3	Very low	33.2	Very low	187 Å²	187	149.8 Å²	149.8	73%	0.733	78%	0.776	S	S	*	*			trans	62	134.3	139.2	-85.6	-118.9	0	0	0	124.8
753	S	34.8	Very low	33.2	Very low	105 Å²	105	154.3 Å²	154.3	73%	0.734	78%	0.78	S	S	*	*				143	145.3	112.1	-141.5	0	0	0	0	108.6
754	S	34.5	Very low	33.1	Very low	86 Å²	86	152.1 Å²	152.1	60%	0.601	77%	0.773	S	S	*	*			cis	176	138.8	-12.9	40.5	0	0	0	0	105.1
755	N	34.1	Very low	33.2	Very low	165 Å²	165	150.7 Å²	150.7	88%	0.882	78%	0.775	S	S	*	*			trans	169	97.4	135.6	-86.8	-10.4	0	0	0	111
756	T	31.7	Very low	32.9	Very low	146 Å²	146	147.7 Å²	147.7	90%	0.896	77%	0.769	S	S	*	*			trans	-121.4	131.1	155	15.3	0	0	0	0	106.5
757	Q	35.5	Very low	33.1	Very low	187 Å²	187	142 Å²	142	87%	0.874	76%	0.763	S	S	*	*			trans	-105.8	122.1	164.7	-95.2	-169.4	-10.6	0	0	109.2
758	V	34.9	Very low	32.8	Very low	108 Å²	108	142.3 Å²	142.3	66%	0.655	76%	0.763	S	S	*	*			trans	77.1	87.5	133.8	-174.7	0	0	0	0	116.4
759	N	34.5	Very low	32.6	Very low	124 Å²	124	144.7 Å²	144.7	66%	0.663	77%	0.768	S	S	*	*				171.4	120.1	86.9	-101.8	-24.2	0	0	0	112.4
760	Q	34	Very low	32.7	Very low	165 Å²	165	144.6 Å²	144.6	77%	0.771	77%	0.768	S	S	*	*			trans	54.9	123.4	139	-54.3	173	8.6	0	0	118.6
761	H	34.9	Very low	32.5	Very low	162 Å²	162	143.3 Å²	143.3	75%	0.75	77%	0.77	S	S	*	*			cis	-164.2	136.4	-2.3	-122.3	-60.5	0	0	0	106.4
762	N	33	Very low	32.4	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	77%	0.774	S	S	*	*			trans	71.3	133.1	168.2	-56.9	-14.7	0	0	0	119.1
763	R	30.1	Very low	32.3	Very low	215 Å²	215	139.2 Å²	139.2	81%	0.811	78%	0.776	S	S	*	*			cis	-170	112.2	-22.7	-170.2	170.4	-162.8	-171.6	6.3	105.6
764	I	32.4	Very low	32	Very low	148 Å²	148	138.6 Å²	138.6	76%	0.759	77%	0.772	S	S	*	*			trans	73.5	101.9	150.6	-53.7	168.5	0	0	0	119.2
765	Q	30.2	Very low	31.9	Very low	177 Å²	177	139 Å²	139	83%	0.827	78%	0.775	S	S	*	*			trans	-105.2	158.9	150.6	-87.1	-177.4	-9.9	0	0	110.2
766	S	27.3	Very low	31.7	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	77%	0.767	S	S	*	*			trans	89.2	154	166.9	80.4	0	0	0	0	117.6
767	P	33.2	Very low	31.7	Very low	121 Å²	121	140 Å²	140	79%	0.786	76%	0.761	S	S	*	*			cis	-131.3	158.3	-9.8	32.2	-12.1	0	0	0	115.2
768	T	27.5	Very low	31.4	Very low	136 Å²	136	139.4 Å²	139.4	83%	0.834	76%	0.758	S	S	*	*			trans	-86	140.8	173	41.2	0	0	0	0	113.6
769	S	28.6	Very low	31.3	Very low	116 Å²	116	140.6 Å²	140.6	81%	0.811	76%	0.76	S	S	*	*			trans	130.1	164.9	155.9	71.7	0	0	0	0	113.1
770	P	36.7	Very low	31	Very low	114 Å²	114	141.1 Å²	141.1	74%	0.74	76%	0.763	S	S	*	*				-130.2	154.5	-71.6	35.5	-19.7	0	0	0	112.7
771	S	29.8	Very low	30.8	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	77%	0.771	S	S	*	*			trans	-176.3	116.3	150.5	38.1	0	0	0	0	114.9
772	T	30.3	Very low	30.6	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	78%	0.778	S	S	*	*			trans	24.8	125.1	132.2	58.1	0	0	0	0	120.7
773	L	30.8	Very low	30.4	Very low	151 Å²	151	149.8 Å²	149.8	79%	0.791	78%	0.783	S	S	*	*				-160.2	120.4	120.7	-110.2	135.4	0	0	0	113
774	S	29	Very low	30.6	Very low	93 Å²	93	145.5 Å²	145.5	65%	0.65	79%	0.786	S	S	*	*			trans	-55	137.2	166.9	161.5	0	0	0	0	112.6
775	S	31.4	Very low	30.6	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	78%	0.779	S	S	*	*			trans	-130.2	109.4	145	-171	0	0	0	0	109.5
776	N	30.2	Very low	30.9	Very low	133 Å²	133	142.5 Å²	142.5	71%	0.711	78%	0.784	S	S	*	*			trans	-70.4	118.6	165.1	-76.6	-52.3	0	0	0	107.9
777	Y	31.3	Very low	31.1	Very low	199 Å²	199	146 Å²	146	78%	0.78	79%	0.785	S	S	*	*			trans	-105.3	91.2	155.8	-87.5	-82.2	0	0	0	108.8	L779	Y777-L779 HydrophobicContact CD1-CD1 4.07Å
778	H	29.2	Very low	31.2	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.815	79%	0.791	S	S	*	*			trans	-73.4	120	153.3	-108.5	-78.4	0	0	0	107
779	L	32.3	Very low	31.5	Very low	133 Å²	133	151.1 Å²	151.1	70%	0.696	79%	0.791	S	S	*	*			trans	-144.4	101	160.6	-109.7	127.4	0	0	0	111.1	Y777	Y777-L779 HydrophobicContact CD1-CD1 4.07Å
780	N	28.9	Very low	31.6	Very low	134 Å²	134	153.2 Å²	153.2	72%	0.717	79%	0.785	S	S	*	*			trans	54.1	86.3	134.1	-58.5	-14.8	0	0	0	118.8
781	R	29.5	Very low	31.2	Very low	249 Å²	249	154.7 Å²	154.7	94%	0.94	78%	0.782	S	S	*	*			trans	-87.6	102.7	141.2	-112	-176.3	-171.6	-165.7	1.8	108.5	R783	R781-R783 PolarHBondContact O-N 3.44Å
782	L	32	Very low	31.2	Very low	170 Å²	170	155.6 Å²	155.6	89%	0.89	78%	0.777	S	S	*	*			trans	-60.6	110.3	163.5	-79.2	159.2	0	0	0	108.5
783	R	28.7	Very low	31.2	Very low	240 Å²	240	154.1 Å²	154.1	91%	0.906	77%	0.772	S	S	*	*			trans	-87.7	109.9	159	-89.6	-177.7	170.9	-177.4	-2.8	106.8	R781	R781-R783 PolarHBondContact O-N 3.44Å
784	S	32.8	Very low	31.1	Very low	125 Å²	125	155.9 Å²	155.9	87%	0.874	78%	0.776	S	S	*	*			trans	-85.3	128	155.6	-162.1	0	0	0	0	108.4
785	S	32.2	Very low	31.4	Very low	88 Å²	88	157 Å²	157	62%	0.615	78%	0.784	S	S	*	*			trans	-101.7	121.1	-172.1	169.3	0	0	0	0	108
786	N	38	Very low	31.4	Very low	173 Å²	173	156.9 Å²	156.9	93%	0.925	78%	0.783	S	S	*	*			trans	-122.1	106.4	154.6	-88.6	-20	0	0	0	109.2
787	K	30.9	Very low	31.4	Very low	185 Å²	185	157.6 Å²	157.6	80%	0.804	79%	0.785	S	S	*	*			trans	-87.3	129.2	167.9	-106.5	175.2	174.5	174.3	0	106.8
788	L	34.3	Very low	31.6	Very low	173 Å²	173	155 Å²	155	91%	0.906	78%	0.784	S	S	*	*			trans	-143.4	116.5	139.8	-134.9	83.6	0	0	0	110.5
789	K	33.7	Very low	31.8	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.826	77%	0.774	S	S	*	*			trans	-15.9	158.5	151.6	-76.2	173	179	177.4	0	116.5
790	K	30.9	Very low	32	Very low	160 Å²	160	152 Å²	152	70%	0.696	78%	0.781	S	S	*	*			cis	170.3	148.4	-9.9	-147.4	-171	174.9	-163.6	0	104.1
791	Q	28.4	Very low	32.5	Very low	145 Å²	145	150.4 Å²	150.4	68%	0.678	78%	0.778	S	S	*	*			trans	70.1	146.3	152.6	-79.1	178.1	-49.5	0	0	117
792	I	30.3	Very low	32.9	Very low	129 Å²	129	148.1 Å²	148.1	66%	0.662	78%	0.778	S	S	*	*			cis	-167.4	158.8	17.7	-108.4	155.1	0	0	0	108.8
793	S	30.5	Very low	32.8	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	77%	0.767	S	S	*	*			trans	59.1	120.6	157.8	60.8	0	0	0	0	120.8
794	Q	29.5	Very low	33.2	Very low	188 Å²	188	139 Å²	139	88%	0.879	77%	0.765	S	S	*	*				65.7	105.8	71.6	-85.3	-170.6	-17.3	0	0	115.7
795	S	33.7	Very low	33.1	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	77%	0.765	S	S	*	*			trans	158.5	160.5	139.5	56.9	0	0	0	0	108.9
796	S	31.5	Very low	33	Very low	90 Å²	90	147.5 Å²	147.5	63%	0.629	78%	0.778	S	S	*	*			cis	175.4	143.7	-49.4	53.9	0	0	0	0	106.3
797	I	31.1	Very low	32.6	Very low	147 Å²	147	146.7 Å²	146.7	75%	0.754	77%	0.772	S	S	*	*			trans	81	129.2	154.2	-48.4	151.8	0	0	0	113.3
798	I	35.6	Very low	32.5	Very low	145 Å²	145	143 Å²	143	74%	0.744	77%	0.769	S	S	*	*				-171.2	120.9	70.6	-75.2	170.6	0	0	0	107.8
799	S	33.5	Very low	32.3	Very low	87 Å²	87	142.7 Å²	142.7	61%	0.608	77%	0.768	S	S	*	*				68.7	138.4	98.4	-21.2	0	0	0	0	114.6
800	D	35.3	Very low	32	Very low	158 Å²	158	141.7 Å²	141.7	85%	0.845	77%	0.771	S	S	*	*			cis	-165.9	173.5	24.7	-105.5	-29.4	0	0	0	113.1
801	P	39.4	Very low	32	Very low	102 Å²	102	144.8 Å²	144.8	66%	0.662	78%	0.78	S	S	*	*			trans	-117.1	174.6	-161.5	43.1	-33.9	0	0	0	116.1
802	H	38.2	Very low	32.2	Very low	201 Å²	201	143.4 Å²	143.4	93%	0.931	78%	0.784	S	S	*	*			trans	-159.2	145.7	144.4	-118.6	-80	0	0	0	113.9
803	S	30.8	Very low	32.2	Very low	95 Å²	95	146.1 Å²	146.1	66%	0.664	79%	0.794	S	S	*	*			trans	-97.1	155.4	-160.9	93.4	0	0	0	0	115.3
804	S	36.5	Very low	32.3	Very low	123 Å²	123	148.2 Å²	148.2	86%	0.86	80%	0.797	S	S	*	*			trans	-152.9	130.1	136	-8.4	0	0	0	0	109.8
805	K	30	Very low	32.3	Very low	199 Å²	199	148.1 Å²	148.1	87%	0.865	79%	0.794	S	S	*	*			trans	-78.3	140.4	-176.8	-71.4	169	172.8	172.5	0	110.9
806	E	31.8	Very low	32.2	Very low	193 Å²	193	148.6 Å²	148.6	90%	0.902	79%	0.787	S	S	*	*			trans	-158	158.5	133.6	-115.7	176.3	-166.2	0	0	112.3
807	I	28.5	Very low	32.1	Very low	156 Å²	156	153.8 Å²	153.8	80%	0.8	80%	0.798	S	S	*	*			trans	-96.2	133.7	-149	-68.7	151.7	0	0	0	111.2
808	S	28.6	Very low	32	Very low	106 Å²	106	156.1 Å²	156.1	74%	0.741	80%	0.803	S	S	*	*			trans	173.5	125.6	132.7	41	0	0	0	0	115.5
809	L	30.9	Very low	31.6	Very low	167 Å²	167	157.3 Å²	157.3	87%	0.874	81%	0.806	S	S	*	*			trans	63.6	88.3	147	-66.9	157.3	0	0	0	120.2
810	N	27.4	Very low	31.4	Very low	169 Å²	169	163.6 Å²	163.6	90%	0.904	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70.3	125	161.1	-83	-28.1	0	0	0	112.3
811	Y	30	Very low	31	Very low	225 Å²	225	161.7 Å²	161.7	88%	0.882	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95	124.5	155	-101.4	-89.6	0	0	0	109.2	H813	Y811-H813 PolarHBondContact O-N 3.45Å
812	P	34.3	Very low	30.6	Very low	117 Å²	117	162 Å²	162	76%	0.76	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78	121.4	179.5	29.3	-29.4	0	0	0	110.8	D814	P812-D814 PolarHBondContact O-N 3.42Å; P812-D814 VanDerWaalsContact O-N 3.13Å
813	H	29.7	Very low	30.1	Very low	186 Å²	186	158.7 Å²	158.7	86%	0.861	80%	0.802	S	S	*	*			trans	-66.6	97.3	164.3	-120.1	-68.2	0	0	0	108.7	Y811	Y811-H813 PolarHBondContact O-N 3.45Å
814	D	32.7	Very low	30.2	Very low	141 Å²	141	163 Å²	163	75%	0.754	81%	0.808	S	S	*	*			trans	-97.8	112.5	168.1	-145.2	-10.6	0	0	0	110.6	P812 D816	P812-D814 PolarHBondContact O-N 3.42Å; P812-D814 VanDerWaalsContact O-N 3.13Å; D814-D816 PolarHBondContact O-N 3.3Å
815	K	29.2	Very low	30	Very low	186 Å²	186	164 Å²	164	81%	0.809	80%	0.804	S	S	*	*			trans	-83.1	89.5	177.8	-79.6	178.7	174.9	171.9	0	108.2
816	D	32.2	Very low	30.1	Very low	127 Å²	127	159.1 Å²	159.1	68%	0.679	79%	0.791	S	S	*	*			trans	-128.7	88.8	165.2	-99.5	-24.3	0	0	0	112.4	D814 F818	D814-D816 PolarHBondContact O-N 3.3Å; D816-F818 PolarHBondContact O-N 3.32Å
817	K	28.3	Very low	30.1	Very low	199 Å²	199	160.9 Å²	160.9	87%	0.865	79%	0.79	S	S	*	*			trans	40.9	56.1	130.6	-141.1	175.7	-167.7	172.2	0	117.7	Q819	K817-Q819 PolarHBondContact O-N 3.45Å
818	F	29	Very low	30.2	Very low	196 Å²	196	158.7 Å²	158.7	86%	0.86	79%	0.789	S	S	*	*			trans	-80.1	103.5	158	-94.7	-90.1	0	0	0	110	D816 Y820	D816-F818 PolarHBondContact O-N 3.32Å; F818-Y820 PolarHBondContact O-N 2.94Å
819	Q	28.5	Very low	30.3	Very low	171 Å²	171	158 Å²	158	80%	0.799	79%	0.785	S	S	*	*			trans	-59.2	103.8	163.7	-89.9	179.9	-47.7	0	0	108.9	K817 T821	K817-Q819 PolarHBondContact O-N 3.45Å; Q819-T821 VanDerWaalsContact C-N 3.27Å; Q819-T821 PolarHBondContact O-N 3.19Å
820	Y	28	Very low	30.3	Very low	218 Å²	218	157.4 Å²	157.4	86%	0.855	78%	0.775	S	S	*	*			trans	-57.1	94	156.3	-86.7	-94.8	0	0	0	108.2	F818 T822	F818-Y820 PolarHBondContact O-N 2.94Å; Y820-T822 PolarHBondContact O-N 3.45Å
821	T	26.8	Very low	30.4	Very low	119 Å²	119	160 Å²	160	73%	0.73	77%	0.774	S	S	*	*			trans	-87.3	93.8	154.2	34.1	0	0	0	0	105.8	Q819 N823	Q819-T821 VanDerWaalsContact C-N 3.27Å; Q819-T821 PolarHBondContact O-N 3.19Å; T821-N823 VanDerWaalsContact C-N 3.28Å; T821-N823 PolarHBondContact O-N 3.13Å
822	T	31.2	Very low	30.3	Very low	108 Å²	108	154.5 Å²	154.5	66%	0.663	77%	0.768	S	S	*	*			trans	-59.4	96	163	38.7	0	0	0	0	107.4	Y820 K824	Y820-T822 PolarHBondContact O-N 3.45Å; T822-K824 PolarHBondContact O-N 2.95Å
823	N	28.2	Very low	30.2	Very low	132 Å²	132	156.3 Å²	156.3	71%	0.706	77%	0.772	S	S	*	*			trans	-72.5	68.4	165	-109.4	-7.7	0	0	0	108.5	T821 N825	T821-N823 VanDerWaalsContact C-N 3.28Å; T821-N823 PolarHBondContact O-N 3.13Å; N823-N825 PolarHBondContact O-N 3.29Å
824	K	33.3	Very low	29.9	Very low	186 Å²	186	159.4 Å²	159.4	81%	0.809	79%	0.787	S	S	*	*			trans	-68.6	80.9	149.7	-78.5	-175.2	174.1	-176.9	0	105.7	T822	T822-K824 PolarHBondContact O-N 2.95Å
825	N	30.9	Very low	29.8	Very low	144 Å²	144	160.4 Å²	160.4	77%	0.77	79%	0.788	S	S	*	*			trans	174.5	49.6	165.7	-87.1	-12.9	0	0	0	110.6	N823	N823-N825 PolarHBondContact O-N 3.29Å
826	V	32.4	Very low	29.8	Very low	96 Å²	96	159 Å²	159	58%	0.582	79%	0.787	S	S	*	*	S	Bend	trans	-146.9	54.3	166	-164.1	0	0	0	0	109.8
827	Y	31.3	Very low	29.7	Very low	229 Å²	229	160.8 Å²	160.8	90%	0.898	79%	0.793	S	S	*	*	S	Bend	trans	-152.9	57.6	163.4	-89.1	-75.8	0	0	0	108.1
828	S	30.5	Very low	29.8	Very low	110 Å²	110	158.5 Å²	158.5	77%	0.769	79%	0.789	S	S	*	*	S	Bend	trans	-159.7	57.8	168.3	71.2	0	0	0	0	109.5
829	S	31.1	Very low	29.8	Very low	93 Å²	93	156.2 Å²	156.2	65%	0.65	78%	0.784	S	S	*	*			trans	-160	55	170.9	70.9	0	0	0	0	110.6
830	F	30.9	Very low	29.9	Very low	153 Å²	153	155.2 Å²	155.2	67%	0.671	78%	0.783	S	S	*	*	S	Bend	trans	-140.6	123.8	161.1	-89.7	-81.8	0	0	0	104.6
831	Y	30.2	Very low	30	Very low	224 Å²	224	150.7 Å²	150.7	88%	0.878	78%	0.778	S	S	*	*	S	Bend	trans	93	123.6	-161.2	-64.5	-80.7	0	0	0	114.9
832	S	28.5	Very low	30.3	Very low	110 Å²	110	153.2 Å²	153.2	77%	0.769	78%	0.782	S	S	*	*			trans	83.5	86.7	-170.8	-163.2	0	0	0	0	115.8
833	N	31	Very low	30.2	Very low	155 Å²	155	156.9 Å²	156.9	83%	0.829	79%	0.792	S	S	*	*				-161.7	104.4	123.4	-94.2	-0.7	0	0	0	108.8
834	Q	24.2	Very low	30.4	Very low	251 Å²	251	159.2 Å²	159.2	100%	1.173	80%	0.8	S	S	*	*				-61.2	0	122.1	-86.8	-179.8	-26.7	0	0	109.3

Retrieved 834 of 834 residues in 175.6 ms (Link to these results)

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