A0A077Z0V8_TRITR Loading...

Splicing factor 3A subunit 2

Component of the 17S U2 SnRNP complex of the spliceosome, a large ribonucleoprotein complex that removes introns from transcribed pre-mRNAs. The 17S U2 SnRNP complex (1) directly participates in early spliceosome assembly and (2) mediates recognition of the intron branch site during pre-mRNA splicing by promoting the selection of the pre-mRNA branch-site adenosine, the nucleophile for the first step of splicing. Within the 17S U2 SnRNP complex, SF3A2 is part of the SF3A subcomplex that contributes to the assembly of the 17S U2 snRNP, and the subsequent assembly of the pre-spliceosome 'E' complex and the pre-catalytic spliceosome 'A' complex. Involved in pre-mRNA splicing as a component of pre-catalytic spliceosome 'B' complexes, including the Bact complex. Interacts directly with the duplex formed by U2 snRNA and the intron.

AlphaFold DB , UniProt , Accession A0A077Z0V8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

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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	54.3	Low	56.1	Low	221 Å²	221	151.1 Å²	151.1	100%	1.089	81%	0.807	S	S	*	*				0	123.3	0	-74.2	-168.7	178.2	0	0	107.1	F3	M1-F3 HydrophobicContact CB-CE2 4.41Å; M1-F3 WeakPolarHBondContact O-CD2 3.38Å; M1-F3 WeakPolarHBondContact O-CE2 3.35Å
2	D	46.9	Very low	56.8	Low	133 Å²	133	145.3 Å²	145.3	71%	0.711	81%	0.81	S	S	*	*			trans	-84.7	125.6	-171.2	-151.9	-21	0	0	0	111
3	F	60.3	Low	57.2	Low	181 Å²	181	138.6 Å²	138.6	79%	0.794	78%	0.779	S	S	*	*			trans	-103	-0.3	-171.7	-74.8	-86.7	0	0	0	113.2	M1 H5	M1-F3 HydrophobicContact CB-CE2 4.41Å; M1-F3 WeakPolarHBondContact O-CD2 3.38Å; M1-F3 WeakPolarHBondContact O-CE2 3.35Å; F3-H5 PolarHBondContact O-N 3.46Å
4	Q	64.8	Low	57.6	Low	162 Å²	162	134 Å²	134	76%	0.757	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-5.8	-165	-70.3	177.2	-4	0	0	115.7
5	H	58.1	Low	58	Low	179 Å²	179	130.1 Å²	130.1	83%	0.829	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	19.1	-175.6	-71.4	-63.8	0	0	0	115.9	F3 A7	F3-H5 PolarHBondContact O-N 3.46Å; H5-A7 PolarHBondContact O-N 3.12Å
6	R	54.4	Low	58.6	Low	228 Å²	228	130.6 Å²	130.6	86%	0.86	78%	0.781	S	S	*	*			trans	-89.8	99.6	176.7	-125.3	178.9	-176.2	102	-1.4	110.7	G8	R6-G8 PolarHBondContact O-N 3.45Å
7	A	55.6	Low	59.2	Low	116 Å²	116	126.5 Å²	126.5	96%	0.959	77%	0.765	S	S	*	*			trans	-66.3	77.4	162	0	0	0	0	0	108.9	H5	H5-A7 PolarHBondContact O-N 3.12Å
8	G	50.9	Low	60.4	Low	55 Å²	55	122.1 Å²	122.1	57%	0.567	74%	0.741	S	S	*	*			trans	-130.6	117	-174.9	0	0	0	0	0	109.8	R6	R6-G8 PolarHBondContact O-N 3.45Å
9	G	58.4	Low	61.5	Low	58 Å²	58	124.5 Å²	124.5	60%	0.598	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-49.5	147.1	173.4	0	0	0	0	0	111.9
10	K	59.9	Low	62.7	Low	173 Å²	173	123.2 Å²	123.2	75%	0.752	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.7	139.4	-179.8	-43.1	-178.4	-172.4	-177	0	107.8	G12 S13	K10-G12 PolarHBondContact O-N 2.81Å; K10-S13 PolarHBondContact N-OG 3.22Å; K10-S13 VanDerWaalsContact N-OG 3.11Å; K10-S13 PolarHBondContact O-N 3.29Å; K10-S13 PolarHBondContact O-OG 3.1Å
11	T	53.4	Low	63.8	Low	156 Å²	156	121.7 Å²	121.7	96%	0.957	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	117.8	170	-173.3	0	0	0	0	108.8
12	G	64.9	Low	65.3	Low	82 Å²	82	113.3 Å²	113.3	85%	0.845	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.5	-9.1	-172.8	0	0	0	0	0	116.9	K10 G14	K10-G12 PolarHBondContact O-N 2.81Å; G12-G14 PolarHBondContact O-N 3.34Å
13	S	61.7	Low	67.2	Low	58 Å²	58	109.9 Å²	109.9	41%	0.406	67%	0.67	S	S	.	*	S	Bend	trans	-82.8	114.1	168.1	71.2	0	0	0	0	108.6	K10 G15	K10-S13 PolarHBondContact N-OG 3.22Å; K10-S13 VanDerWaalsContact N-OG 3.11Å; K10-S13 PolarHBondContact O-N 3.29Å; K10-S13 PolarHBondContact O-OG 3.1Å; S13-G15 PolarHBondContact O-N 2.96Å
14	G	62.6	Low	68.3	Low	74 Å²	74	109.9 Å²	109.9	76%	0.763	67%	0.665	S	S	*	*			trans	-43.5	140.1	174.7	0	0	0	0	0	111.5	G12	G12-G14 PolarHBondContact O-N 3.34Å
15	G	63.5	Low	69.4	Low	75 Å²	75	107.3 Å²	107.3	77%	0.773	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-47.9	143.5	-170.6	0	0	0	0	0	113	S13 A17	S13-G15 PolarHBondContact O-N 2.96Å; G15-A17 PolarHBondContact O-N 3.18Å
16	V	68.3	Low	70.7	Confident	138 Å²	138	107 Å²	107	84%	0.836	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-54.9	116.7	175.4	-171.2	0	0	0	0	107.4	S18	V16-S18 PolarHBondContact O-N 2.98Å
17	A	68.7	Low	72.1	Confident	62 Å²	62	105.6 Å²	105.6	51%	0.512	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-50.8	132.7	-179.4	0	0	0	0	0	109.3	G15 D21	G15-A17 PolarHBondContact O-N 3.18Å; A17-D21 HydrophobicContact CB-CB 4.31Å
18	S	80.1	Confident	73.6	Confident	47 Å²	47	104.9 Å²	104.9	33%	0.329	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-56.8	150.5	176.9	72.5	0	0	0	0	109.3	V16 T20 D21 A22	V16-S18 PolarHBondContact O-N 2.98Å; S18-T20 PolarHBondContact O-N 3.01Å; S18-T20 PolarHBondContact OG-OG1 2.85Å; S18-D21 WeakPolarHBondContact CB-OD2 3.22Å; S18-D21 PolarHBondContact O-N 2.69Å; S18-D21 PolarHBondContact OG-N 2.66Å; S18-D21 PolarHBondContact OG-OD2 2.89Å; S18-A22 PolarHBondContact O-N 3.45Å
19	F	81.4	Confident	75.3	Confident	167 Å²	167	110.1 Å²	110.1	73%	0.732	62%	0.622	S	S	*	*	H	α-helix	trans	-53.3	-32	177.7	178.1	-103.8	0	0	0	112	N23	F19-N23 WeakPolarHBondContact CD1-ND2 3.43Å; F19-N23 WeakPolarHBondContact CE1-ND2 3.24Å; F19-N23 WeakPolarHBondContact CZ-ND2 3.3Å; F19-N23 WeakPolarHBondContact O-CB 3.32Å; F19-N23 VanDerWaalsContact O-CG 3.25Å; F19-N23 PolarHBondContact O-N 3.28Å; F19-N23 VanDerWaalsContact O-N 3.16Å; F19-N23 PolarHBondContact O-ND2 3.46Å
20	T	86.1	Confident	76.5	Confident	99 Å²	99	112.6 Å²	112.6	61%	0.607	62%	0.621	S	S	*	*	H	α-helix	trans	-67.1	-42.2	174.1	40.6	0	0	0	0	113.1	S18 N23 R24	S18-T20 PolarHBondContact O-N 3.01Å; S18-T20 PolarHBondContact OG-OG1 2.85Å; T20-N23 PolarHBondContact O-N 3.13Å; T20-R24 PolarHBondContact O-N 3.45Å
21	D	86.4	Confident	77.5	Confident	91 Å²	91	108.5 Å²	108.5	49%	0.487	60%	0.601	S	S	.	*	H	α-helix	trans	-70.3	-43.8	179.1	-62.5	-37.4	0	0	0	111.4	A17 S18 N23 R24 D25	A17-D21 HydrophobicContact CB-CB 4.31Å; S18-D21 WeakPolarHBondContact CB-OD2 3.22Å; S18-D21 PolarHBondContact O-N 2.69Å; S18-D21 PolarHBondContact OG-N 2.66Å; S18-D21 PolarHBondContact OG-OD2 2.89Å; D21-N23 VanDerWaalsContact C-N 3.28Å; D21-N23 PolarHBondContact O-N 2.83Å; D21-R24 WeakPolarHBondContact O-CB 3.07Å; D21-R24 PolarHBondContact O-N 2.87Å; D21-R24 VanDerWaalsContact O-N 3.12Å; D21-D25 PolarHBondContact O-N 2.79Å
22	A	85.2	Confident	79	Confident	46 Å²	46	106 Å²	106	38%	0.38	58%	0.578	S	S	.	*	H	α-helix	trans	-61.2	-37.5	176.8	0	0	0	0	0	112.2	S18 R26	S18-A22 PolarHBondContact O-N 3.45Å; A22-R26 WeakPolarHBondContact O-CB 3.15Å; A22-R26 PolarHBondContact O-N 3.37Å
23	N	86	Confident	80	Confident	61 Å²	61	106.1 Å²	106.1	33%	0.326	56%	0.559	S	S	.	*	H	α-helix	trans	-71.2	-33.7	175.3	-78.4	-32.9	0	0	0	113	F19 T20 D21 R27	F19-N23 WeakPolarHBondContact CD1-ND2 3.43Å; F19-N23 WeakPolarHBondContact CE1-ND2 3.24Å; F19-N23 WeakPolarHBondContact CZ-ND2 3.3Å; F19-N23 WeakPolarHBondContact O-CB 3.32Å; F19-N23 VanDerWaalsContact O-CG 3.25Å; F19-N23 PolarHBondContact O-N 3.28Å; F19-N23 VanDerWaalsContact O-N 3.16Å; F19-N23 PolarHBondContact O-ND2 3.46Å; T20-N23 PolarHBondContact O-N 3.13Å; D21-N23 VanDerWaalsContact C-N 3.28Å; D21-N23 PolarHBondContact O-N 2.83Å; N23-R27 WeakPolarHBondContact O-CB 3.25Å; N23-R27 PolarHBondContact O-N 3.5Å; N23-R27 VanDerWaalsContact O-N 3.09Å
24	R	84.6	Confident	80.9	Confident	181 Å²	181	104.6 Å²	104.6	68%	0.683	55%	0.549	S	S	*	.	H	α-helix	trans	-66.2	-49.1	175.2	-175.4	179.3	176.1	135.2	-0.4	110.7	T20 D21 R26 R27 E28	T20-R24 PolarHBondContact O-N 3.45Å; D21-R24 WeakPolarHBondContact O-CB 3.07Å; D21-R24 PolarHBondContact O-N 2.87Å; D21-R24 VanDerWaalsContact O-N 3.12Å; R24-R26 PolarHBondContact O-N 2.78Å; R24-R27 PolarHBondContact O-N 3.43Å; R24-E28 PolarHBondContact O-N 2.81Å
25	D	86.7	Confident	81.7	Confident	107 Å²	107	103.5 Å²	103.5	57%	0.572	53%	0.526	S	S	*	.	H	α-helix	trans	-58.8	-46.9	176.2	179.5	68.4	0	0	0	111.6	D21 R27 E28 R29	D21-D25 PolarHBondContact O-N 2.79Å; D25-R27 VanDerWaalsContact C-N 3.3Å; D25-R27 PolarHBondContact O-N 2.85Å; D25-E28 PolarHBondContact O-N 3.41Å; D25-R29 WeakPolarHBondContact O-CB 3.27Å; D25-R29 PolarHBondContact O-N 3.43Å
26	R	86.7	Confident	82.5	Confident	174 Å²	174	107.1 Å²	107.1	66%	0.657	52%	0.523	S	S	*	.	H	α-helix	trans	-56.5	-42.9	175.4	-178.8	-176.3	-84.3	-153.5	-2.9	112	A22 R24 L30	A22-R26 WeakPolarHBondContact O-CB 3.15Å; A22-R26 PolarHBondContact O-N 3.37Å; R24-R26 PolarHBondContact O-N 2.78Å; R26-L30 HydrophobicContact CG-CD1 4.33Å; R26-L30 WeakPolarHBondContact O-CG 3.13Å; R26-L30 PolarHBondContact O-N 3.5Å; R26-L30 VanDerWaalsContact O-N 3.08Å
27	R	84.2	Confident	83.1	Confident	198 Å²	198	106 Å²	106	75%	0.747	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-40.8	-179.9	-171.7	-178.9	-62.9	-175.4	0.5	111.8	N23 R24 D25 R31	N23-R27 WeakPolarHBondContact O-CB 3.25Å; N23-R27 PolarHBondContact O-N 3.5Å; N23-R27 VanDerWaalsContact O-N 3.09Å; R24-R27 PolarHBondContact O-N 3.43Å; D25-R27 VanDerWaalsContact C-N 3.3Å; D25-R27 PolarHBondContact O-N 2.85Å; R27-R31 PolarHBondContact O-N 2.69Å; R27-R31 VanDerWaalsContact O-N 3.14Å
28	E	85.5	Confident	83.6	Confident	101 Å²	101	106.5 Å²	106.5	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-41.5	178.3	-171.1	159.1	-168.7	0	0	111.6	R24 D25 R31 Q32	R24-E28 PolarHBondContact O-N 2.81Å; D25-E28 PolarHBondContact O-N 3.41Å; E28-R31 WeakPolarHBondContact O-CB 3.28Å; E28-R31 PolarHBondContact O-N 3.07Å; E28-Q32 WeakPolarHBondContact O-CG 3.28Å; E28-Q32 PolarHBondContact O-N 3.05Å
29	R	87.9	Confident	83.7	Confident	164 Å²	164	107.6 Å²	107.6	62%	0.619	51%	0.512	S	S	*	.	H	α-helix	trans	-62.3	-45.4	174.4	-173.6	177.5	178.4	-177.9	0.3	113.1	D25 R31 Q32 L33	D25-R29 WeakPolarHBondContact O-CB 3.27Å; D25-R29 PolarHBondContact O-N 3.43Å; R29-R31 PolarHBondContact O-N 2.96Å; R29-Q32 PolarHBondContact O-N 2.75Å; R29-L33 HydrophobicContact CG-CD1 4.47Å; R29-L33 WeakPolarHBondContact O-CG 3.26Å; R29-L33 PolarHBondContact O-N 2.93Å
30	L	83.7	Confident	83.8	Confident	111 Å²	111	100.1 Å²	100.1	58%	0.581	48%	0.479	S	S	*	.	H	α-helix	trans	-61.9	-35.1	176.3	-74.2	173	0	0	0	112.1	R26 A34	R26-L30 HydrophobicContact CG-CD1 4.33Å; R26-L30 WeakPolarHBondContact O-CG 3.13Å; R26-L30 PolarHBondContact O-N 3.5Å; R26-L30 VanDerWaalsContact O-N 3.08Å; L30-A34 WeakPolarHBondContact O-CB 3.43Å; L30-A34 PolarHBondContact O-N 3.2Å; L30-A34 VanDerWaalsContact O-N 3.1Å
31	R	80.7	Confident	83.7	Confident	87 Å²	87	101.5 Å²	101.5	33%	0.328	48%	0.483	S	S	.	.	H	α-helix	trans	-66.9	-41	175.3	-179.3	-174.2	174.1	120.4	-4.6	111.9	R27 E28 R29 A34 L35 N65 G67	R27-R31 PolarHBondContact O-N 2.69Å; R27-R31 VanDerWaalsContact O-N 3.14Å; E28-R31 WeakPolarHBondContact O-CB 3.28Å; E28-R31 PolarHBondContact O-N 3.07Å; R29-R31 PolarHBondContact O-N 2.96Å; R31-A34 PolarHBondContact O-N 3.29Å; R31-L35 HydrophobicContact CG-CD1 4.3Å; R31-L35 WeakPolarHBondContact O-CG 3.06Å; R31-L35 PolarHBondContact O-N 2.54Å; R31-L35 VanDerWaalsContact O-N 3.08Å; R31-N65 VanDerWaalsContact CZ-OD1 3.31Å; R31-N65 PolarHBondContact NH1-OD1 3.46Å; R31-N65 VanDerWaalsContact NH2-CB 3.34Å; R31-N65 PolarHBondContact NH2-OD1 3.32Å; R31-G67 VanDerWaalsContact NH1-CA 3.31Å
32	Q	83.5	Confident	83.7	Confident	104 Å²	104	105.2 Å²	105.2	49%	0.486	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-46.2	176.6	-71.2	173.3	7.6	0	0	111.5	E28 R29 A34 L35 E36	E28-Q32 WeakPolarHBondContact O-CG 3.28Å; E28-Q32 PolarHBondContact O-N 3.05Å; R29-Q32 PolarHBondContact O-N 2.75Å; Q32-A34 PolarHBondContact O-N 3.18Å; Q32-L35 PolarHBondContact O-N 3.14Å; Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 3.33Å
33	L	86	Confident	83.8	Confident	84 Å²	84	104.8 Å²	104.8	44%	0.44	49%	0.486	S	S	.	.	H	α-helix	trans	-58.2	-37	174.8	-69.3	170.2	0	0	0	112.5	R29 E36 T37	R29-L33 HydrophobicContact CG-CD1 4.47Å; R29-L33 WeakPolarHBondContact O-CG 3.26Å; R29-L33 PolarHBondContact O-N 2.93Å; L33-E36 PolarHBondContact O-N 2.85Å; L33-T37 WeakPolarHBondContact O-CG2 3.31Å; L33-T37 PolarHBondContact O-N 3.01Å; L33-T37 VanDerWaalsContact O-N 3.15Å; L33-T37 PolarHBondContact O-OG1 3.02Å
34	A	80.6	Confident	84.1	Confident	25 Å²	25	106.7 Å²	106.7	21%	0.207	50%	0.502	C	S	.	.	H	α-helix	trans	-68.1	-37.7	175.9	0	0	0	0	0	112.7	L30 R31 Q32 T37 I38 L70	L30-A34 WeakPolarHBondContact O-CB 3.43Å; L30-A34 PolarHBondContact O-N 3.2Å; L30-A34 VanDerWaalsContact O-N 3.1Å; R31-A34 PolarHBondContact O-N 3.29Å; Q32-A34 PolarHBondContact O-N 3.18Å; A34-T37 WeakPolarHBondContact CA-OG1 3.39Å; A34-T37 PolarHBondContact O-N 3.29Å; A34-T37 PolarHBondContact O-OG1 2.9Å; A34-T37 VanDerWaalsContact O-OG1 3.06Å; A34-I38 WeakPolarHBondContact O-CB 3.49Å; A34-I38 PolarHBondContact O-N 3.21Å; A34-L70 HydrophobicContact CB-CD1 4.35Å
35	L	80.2	Confident	84.4	Confident	51 Å²	51	100.4 Å²	100.4	27%	0.267	48%	0.478	S	S	.	.	H	α-helix	trans	-70.7	-31.9	175.5	-74.1	163.2	0	0	0	112.4	R31 Q32 L40 E66 L70	R31-L35 HydrophobicContact CG-CD1 4.3Å; R31-L35 WeakPolarHBondContact O-CG 3.06Å; R31-L35 PolarHBondContact O-N 2.54Å; R31-L35 VanDerWaalsContact O-N 3.08Å; Q32-L35 PolarHBondContact O-N 3.14Å; L35-L40 HydrophobicContact CD2-CD1 3.59Å; L35-L40 HydrophobicContact CD2-CG 4.24Å; L35-E66 HydrophobicContact CD2-CB 4.21Å; L35-L70 HydrophobicContact CD2-CD1 3.52Å; L35-L70 HydrophobicContact CG-CD1 3.75Å
36	E	80.8	Confident	84.8	Confident	151 Å²	151	96.6 Å²	96.6	71%	0.706	46%	0.457	S	S	*	.	H	α-helix	trans	-70	-35.2	174.9	-72.9	175.8	174.4	0	0	112.4	Q32 L33	Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 3.33Å; L33-E36 PolarHBondContact O-N 2.85Å
37	T	80.6	Confident	85	Confident	114 Å²	114	91.9 Å²	91.9	70%	0.699	44%	0.443	S	S	*	.	H	α-helix	trans	-82	-29.1	-179.7	45.3	0	0	0	0	113.2	L33 A34	L33-T37 WeakPolarHBondContact O-CG2 3.31Å; L33-T37 PolarHBondContact O-N 3.01Å; L33-T37 VanDerWaalsContact O-N 3.15Å; L33-T37 PolarHBondContact O-OG1 3.02Å; A34-T37 WeakPolarHBondContact CA-OG1 3.39Å; A34-T37 PolarHBondContact O-N 3.29Å; A34-T37 PolarHBondContact O-OG1 2.9Å; A34-T37 VanDerWaalsContact O-OG1 3.06Å
38	I	78.1	Confident	85.4	Confident	73 Å²	73	88 Å²	88	37%	0.374	43%	0.432	S	S	.	.	S	Bend	trans	-120	104.4	-176	-54.1	173	0	0	0	109.3	A34 L40 L70	A34-I38 WeakPolarHBondContact O-CB 3.49Å; A34-I38 PolarHBondContact O-N 3.21Å; I38-L40 PolarHBondContact O-N 3.31Å; I38-L70 HydrophobicContact CB-CD2 4.35Å; I38-L70 HydrophobicContact CD1-CD2 4.26Å; I38-L70 HydrophobicContact CG2-CD2 4.21Å
39	D	82.7	Confident	85.6	Confident	70 Å²	70	84.8 Å²	84.8	37%	0.374	42%	0.418	S	S	.	.			trans	-70.7	101.6	168.9	-177.6	0	0	0	0	109.8	N41 K42	D39-N41 PolarHBondContact O-N 3.4Å; D39-N41 VanDerWaalsContact O-N 3.13Å; D39-N41 WeakPolarHBondContact OD1-CB 3.45Å; D39-N41 PolarHBondContact OD1-N 3.37Å; D39-N41 VanDerWaalsContact OD1-N 3.1Å; D39-N41 PolarHBondContact OD1-ND2 3.03Å; D39-K42 HydrophobicContact CB-CD 3.98Å; D39-K42 HydrophobicContact CB-CG 4.14Å; D39-K42 WeakPolarHBondContact O-CB 3.27Å; D39-K42 PolarHBondContact O-N 2.77Å; D39-K42 WeakPolarHBondContact OD2-CE 3.12Å; D39-K42 IonicContact OD2-NZ 3.69Å
40	L	83.4	Confident	85.6	Confident	10 Å²	10	85.4 Å²	85.4	5%	0.052	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-55.7	-27.3	179.6	-74.3	176.4	0	0	0	113.3	L35 I38 K42 D43 F46 E66 Y69 L70	L35-L40 HydrophobicContact CD2-CD1 3.59Å; L35-L40 HydrophobicContact CD2-CG 4.24Å; I38-L40 PolarHBondContact O-N 3.31Å; L40-K42 PolarHBondContact O-N 3.17Å; L40-D43 PolarHBondContact O-N 2.88Å; L40-F46 HydrophobicContact CB-CD1 4.08Å; L40-F46 HydrophobicContact CB-CE1 3.92Å; L40-F46 HydrophobicContact CB-CG 4.44Å; L40-F46 HydrophobicContact CB-CZ 4.14Å; L40-F46 HydrophobicContact CD1-CE2 4.27Å; L40-F46 HydrophobicContact CD1-CZ 4.12Å; L40-F46 VanDerWaalsContact O-CD1 3.31Å; L40-F46 WeakPolarHBondContact O-CD1 3.13Å; L40-E66 HydrophobicContact CD1-CB 3.72Å; L40-E66 HydrophobicContact CD1-CG 4.01Å; L40-Y69 HydrophobicContact CD2-CD1 3.66Å; L40-Y69 HydrophobicContact CD2-CE1 3.81Å; L40-L70 HydrophobicContact CD2-CD2 3.42Å; L40-L70 VanDerWaalsContact CD2-CD2 3.42Å; L40-L70 HydrophobicContact CD2-CG 3.89Å; L40-L70 HydrophobicContact CG-CD2 4.28Å
41	N	84.2	Confident	85.9	Confident	128 Å²	128	87 Å²	87	68%	0.684	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.3	-179.8	-54.1	-66.8	0	0	0	112.7	D39	D39-N41 PolarHBondContact O-N 3.4Å; D39-N41 VanDerWaalsContact O-N 3.13Å; D39-N41 WeakPolarHBondContact OD1-CB 3.45Å; D39-N41 PolarHBondContact OD1-N 3.37Å; D39-N41 VanDerWaalsContact OD1-N 3.1Å; D39-N41 PolarHBondContact OD1-ND2 3.03Å
42	K	86.5	Confident	86.2	Confident	169 Å²	169	85.6 Å²	85.6	74%	0.735	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-85.3	-11.8	175.1	-66.2	178.5	-175.5	159.6	0	112.9	D39 L40 P44	D39-K42 HydrophobicContact CB-CD 3.98Å; D39-K42 HydrophobicContact CB-CG 4.14Å; D39-K42 WeakPolarHBondContact O-CB 3.27Å; D39-K42 PolarHBondContact O-N 2.77Å; D39-K42 WeakPolarHBondContact OD2-CE 3.12Å; D39-K42 IonicContact OD2-NZ 3.69Å; L40-K42 PolarHBondContact O-N 3.17Å; K42-P44 WeakPolarHBondContact O-CD 3.28Å
43	D	88.5	Confident	86.5	Confident	38 Å²	38	81.4 Å²	81.4	20%	0.203	43%	0.433	C	S	.	.			trans	-77.8	115	176.3	-175.8	-14.4	0	0	0	109.9	L40 Y45 F46 Y69	L40-D43 PolarHBondContact O-N 2.88Å; D43-Y45 PolarHBondContact O-N 2.62Å; D43-Y45 WeakPolarHBondContact OD1-CB 3.39Å; D43-Y45 WeakPolarHBondContact OD1-CD2 3.17Å; D43-Y45 PolarHBondContact OD1-N 3.28Å; D43-F46 HydrophobicContact CB-CB 3.98Å; D43-F46 PolarHBondContact O-N 2.73Å; D43-F46 VanDerWaalsContact O-N 3.17Å; D43-Y69 VanDerWaalsContact CG-OH 3.29Å; D43-Y69 PolarHBondContact OD2-OH 2.81Å
44	P	91	Very high	86.9	Confident	101 Å²	101	79.3 Å²	79.3	66%	0.656	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.3	-178.4	28.8	-36.3	0	0	0	113.6	K42	K42-P44 WeakPolarHBondContact O-CD 3.28Å
45	Y	92.3	Very high	87.5	Confident	48 Å²	48	80.7 Å²	80.7	19%	0.188	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-7.1	179.6	-52.7	-65.5	0	0	0	113.8	D43 K57 L58 L82 R85	D43-Y45 PolarHBondContact O-N 2.62Å; D43-Y45 WeakPolarHBondContact OD1-CB 3.39Å; D43-Y45 WeakPolarHBondContact OD1-CD2 3.17Å; D43-Y45 PolarHBondContact OD1-N 3.28Å; Y45-K57 WeakPolarHBondContact O-CB 3.26Å; Y45-K57 PolarHBondContact O-N 3.34Å; Y45-L58 HydrophobicContact CD1-CB 3.7Å; Y45-L58 HydrophobicContact CD2-CB 4.32Å; Y45-L58 HydrophobicContact CD2-CD2 4.27Å; Y45-L58 HydrophobicContact CE1-CB 4.24Å; Y45-L58 HydrophobicContact CE1-CD1 4.21Å; Y45-L58 HydrophobicContact CE2-CD2 4.27Å; Y45-L58 HydrophobicContact CG-CB 3.74Å; Y45-L58 HydrophobicContact CG-CD2 4.5Å; Y45-L82 HydrophobicContact CE2-CD1 4.25Å; Y45-R85 WeakPolarHBondContact OH-CD 3.3Å
46	F	93.4	Very high	88.2	Confident	28 Å²	28	78.3 Å²	78.3	12%	0.123	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.7	177.1	178.6	-111.9	0	0	0	110.6	L40 D43 K48 Y54 Y69	L40-F46 HydrophobicContact CB-CD1 4.08Å; L40-F46 HydrophobicContact CB-CE1 3.92Å; L40-F46 HydrophobicContact CB-CG 4.44Å; L40-F46 HydrophobicContact CB-CZ 4.14Å; L40-F46 HydrophobicContact CD1-CE2 4.27Å; L40-F46 HydrophobicContact CD1-CZ 4.12Å; L40-F46 VanDerWaalsContact O-CD1 3.31Å; L40-F46 WeakPolarHBondContact O-CD1 3.13Å; D43-F46 HydrophobicContact CB-CB 3.98Å; D43-F46 PolarHBondContact O-N 2.73Å; D43-F46 VanDerWaalsContact O-N 3.17Å; F46-K48 HydrophobicContact CE1-CG 4.44Å; F46-K48 HydrophobicContact CZ-CG 4.43Å; F46-Y54 AromaticContact CE2-CD1 3.46Å; F46-Y54 HydrophobicContact CE2-CD1 3.46Å; F46-Y54 VanDerWaalsContact CE2-CD1 3.46Å; F46-Y54 HydrophobicContact CE2-CE1 4.23Å; F46-Y54 HydrophobicContact CE2-CG 4.18Å; F46-Y54 AromaticContact CZ-CD1 3.39Å; F46-Y54 HydrophobicContact CZ-CD1 3.39Å; F46-Y54 AromaticContact CZ-CE1 3.75Å; F46-Y54 HydrophobicContact CZ-CE1 3.75Å; F46-Y54 HydrophobicContact CZ-CG 4.48Å; F46-Y69 WeakPolarHBondContact CA-OH 3.46Å; F46-Y69 HydrophobicContact CB-CE1 3.94Å; F46-Y69 HydrophobicContact CB-CE2 4.4Å; F46-Y69 AromaticContact CD2-CD1 3.57Å; F46-Y69 HydrophobicContact CD2-CD1 3.57Å; F46-Y69 AromaticContact CD2-CD2 3.97Å; F46-Y69 HydrophobicContact CD2-CD2 3.97Å; F46-Y69 AromaticContact CD2-CE1 3.5Å; F46-Y69 HydrophobicContact CD2-CE1 3.5Å; F46-Y69 VanDerWaalsContact CD2-CE1 3.5Å; F46-Y69 AromaticContact CD2-CE2 3.88Å; F46-Y69 HydrophobicContact CD2-CE2 3.88Å; F46-Y69 AromaticContact CD2-CG 3.84Å; F46-Y69 HydrophobicContact CD2-CG 3.84Å; F46-Y69 AromaticContact CD2-CZ 3.68Å; F46-Y69 HydrophobicContact CE2-CD1 4Å; F46-Y69 HydrophobicContact CE2-CE1 4.36Å; F46-Y69 HydrophobicContact CE2-CG 4.12Å; F46-Y69 HydrophobicContact CG-CE1 4.09Å; F46-Y69 PolarHBondContact N-OH 3.14Å
47	M	91.5	Very high	88.7	Confident	74 Å²	74	76.8 Å²	76.8	37%	0.365	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.6	173.8	-174.9	-179.2	-53.4	0	0	110.4	E55 K57	M47-E55 HydrophobicContact CB-CG 3.71Å; M47-E55 HydrophobicContact CG-CG 4.26Å; M47-E55 PolarHBondContact N-O 2.91Å; M47-E55 VanDerWaalsContact N-O 3.13Å; M47-E55 PolarHBondContact O-N 2.77Å; M47-K57 HydrophobicContact CE-CD 4.1Å
48	K	92.4	Very high	89.3	Confident	118 Å²	118	72.1 Å²	72.1	51%	0.513	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.2	168.9	-59.7	-172.5	-173	-165.1	0	108.1	F46 G53 Y54 E66	F46-K48 HydrophobicContact CE1-CG 4.44Å; F46-K48 HydrophobicContact CZ-CG 4.43Å; K48-G53 WeakPolarHBondContact CA-O 3.44Å; K48-Y54 HydrophobicContact CD-CE1 4.11Å; K48-Y54 HydrophobicContact CG-CD1 3.99Å; K48-Y54 HydrophobicContact CG-CE1 4Å; K48-E66 IonicContact NZ-OE1 3.24Å
49	N	89.7	Confident	90	Very high	32 Å²	32	69.3 Å²	69.3	17%	0.171	36%	0.357	C	S	.	.			trans	-75.6	168.1	177	73.4	25.3	0	0	0	110.7	L51 G52 G53	N49-L51 PolarHBondContact O-N 3.37Å; N49-L51 WeakPolarHBondContact OD1-CA 3.47Å; N49-L51 PolarHBondContact OD1-N 3.18Å; N49-G52 PolarHBondContact O-N 3.41Å; N49-G52 VanDerWaalsContact O-N 3.17Å; N49-G52 PolarHBondContact OD1-N 3.18Å; N49-G53 VanDerWaalsContact CG-O 3.29Å; N49-G53 PolarHBondContact N-O 3.15Å; N49-G53 WeakPolarHBondContact OD1-CA 3.35Å; N49-G53 PolarHBondContact OD1-N 2.91Å; N49-G53 PolarHBondContact OD1-O 2.73Å
50	H	88.7	Confident	90.5	Very high	178 Å²	178	73.3 Å²	73.3	82%	0.824	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.8	-179.6	58.8	-85.9	0	0	0	114
51	L	89.5	Confident	91	Very high	145 Å²	145	74.4 Å²	74.4	76%	0.759	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	2.4	176.9	-58.5	172.7	0	0	0	112.4	N49 G53	N49-L51 PolarHBondContact O-N 3.37Å; N49-L51 WeakPolarHBondContact OD1-CA 3.47Å; N49-L51 PolarHBondContact OD1-N 3.18Å; L51-G53 VanDerWaalsContact C-N 3.35Å
52	G	87.1	Confident	91.5	Very high	57 Å²	57	74.2 Å²	74.2	59%	0.588	38%	0.384	S	S	*	.	S	Bend	trans	82.4	4.4	-178	0	0	0	0	0	115.4	N49	N49-G52 PolarHBondContact O-N 3.41Å; N49-G52 VanDerWaalsContact O-N 3.17Å; N49-G52 PolarHBondContact OD1-N 3.18Å
53	G	90.5	Very high	91.8	Very high	16 Å²	16	66.8 Å²	66.8	17%	0.165	35%	0.352	C	S	.	.			trans	-80.9	167.9	168.3	0	0	0	0	0	112.8	K48 N49 L51	K48-G53 WeakPolarHBondContact CA-O 3.44Å; N49-G53 VanDerWaalsContact CG-O 3.29Å; N49-G53 PolarHBondContact N-O 3.15Å; N49-G53 WeakPolarHBondContact OD1-CA 3.35Å; N49-G53 PolarHBondContact OD1-N 2.91Å; N49-G53 PolarHBondContact OD1-O 2.73Å; L51-G53 VanDerWaalsContact C-N 3.35Å
54	Y	93.1	Very high	91.9	Very high	40 Å²	40	72.2 Å²	72.2	16%	0.157	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141.5	-179.3	-56.2	-85.2	0	0	0	110	F46 K48 L62 H63 E66	F46-Y54 AromaticContact CE2-CD1 3.46Å; F46-Y54 HydrophobicContact CE2-CD1 3.46Å; F46-Y54 VanDerWaalsContact CE2-CD1 3.46Å; F46-Y54 HydrophobicContact CE2-CE1 4.23Å; F46-Y54 HydrophobicContact CE2-CG 4.18Å; F46-Y54 AromaticContact CZ-CD1 3.39Å; F46-Y54 HydrophobicContact CZ-CD1 3.39Å; F46-Y54 AromaticContact CZ-CE1 3.75Å; F46-Y54 HydrophobicContact CZ-CE1 3.75Å; F46-Y54 HydrophobicContact CZ-CG 4.48Å; K48-Y54 HydrophobicContact CD-CE1 4.11Å; K48-Y54 HydrophobicContact CG-CD1 3.99Å; K48-Y54 HydrophobicContact CG-CE1 4Å; Y54-L62 CarbonylContact O-C 3.55Å; Y54-H63 PolarHBondContact N-O 2.79Å; Y54-H63 PolarHBondContact O-N 2.89Å; Y54-E66 HydrophobicContact CD1-CG 3.97Å; Y54-E66 HydrophobicContact CD2-CG 4.28Å; Y54-E66 HydrophobicContact CE1-CG 3.32Å; Y54-E66 VanDerWaalsContact CE1-OE1 3.29Å; Y54-E66 WeakPolarHBondContact CE1-OE1 3.11Å; Y54-E66 HydrophobicContact CE2-CG 3.74Å; Y54-E66 HydrophobicContact CG-CG 4.38Å; Y54-E66 VanDerWaalsContact CZ-OE1 3.31Å; Y54-E66 VanDerWaalsContact OH-CD 3.3Å; Y54-E66 VanDerWaalsContact OH-CG 3.26Å; Y54-E66 WeakPolarHBondContact OH-CG 3.44Å; Y54-E66 PolarHBondContact OH-OE1 3.36Å
55	E	93.1	Very high	91.8	Very high	54 Å²	54	70.5 Å²	70.5	25%	0.252	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.5	179.6	66.5	-179.5	-147	0	0	111.9	M47 T61 L62	M47-E55 HydrophobicContact CB-CG 3.71Å; M47-E55 HydrophobicContact CG-CG 4.26Å; M47-E55 PolarHBondContact N-O 2.91Å; M47-E55 VanDerWaalsContact N-O 3.13Å; M47-E55 PolarHBondContact O-N 2.77Å; E55-T61 CarbonylContact C-O 3.47Å; E55-T61 VanDerWaalsContact CA-O 3.31Å; E55-T61 WeakPolarHBondContact CA-O 3.18Å; E55-L62 HydrophobicContact CB-CD2 4.08Å
56	C	94.7	Very high	91.6	Very high	1 Å²	1	70.7 Å²	70.7	1%	0.007	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	106.3	170.3	-174.6	0	0	0	0	109.9	L58 C59 L60 T61 Y69 H78	C56-L58 PolarHBondContact O-N 2.88Å; C56-C59 HydrophobicContact CB-CB 4.3Å; C56-C59 PolarHBondContact O-N 3.25Å; C56-C59 VanDerWaalsContact O-N 3.15Å; C56-L60 WeakPolarHBondContact O-CA 3.22Å; C56-L60 PolarHBondContact O-N 2.83Å; C56-T61 PolarHBondContact N-O 2.9Å; C56-Y69 HydrophobicContact CB-CD2 4.15Å; C56-Y69 HydrophobicContact CB-CE2 3.61Å; C56-H78 PolarHBondContact SG-CE1 2.86Å; C56-H78 PolarHBondContact SG-ND1 2.85Å; C56-H78 VanDerWaalsContact SG-ND1 3.41Å
57	K	92.7	Very high	91.2	Very high	119 Å²	119	69.9 Å²	69.9	52%	0.517	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.6	179.3	-161.6	178	-160.3	176.8	0	113.1	Y45 M47	Y45-K57 WeakPolarHBondContact O-CB 3.26Å; Y45-K57 PolarHBondContact O-N 3.34Å; M47-K57 HydrophobicContact CE-CD 4.1Å
58	L	92.4	Very high	91.1	Very high	16 Å²	16	68.7 Å²	68.7	8%	0.084	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-40.5	177.6	-179.5	60.2	0	0	0	112.5	Y45 C56 N81 L82 R85	Y45-L58 HydrophobicContact CD1-CB 3.7Å; Y45-L58 HydrophobicContact CD2-CB 4.32Å; Y45-L58 HydrophobicContact CD2-CD2 4.27Å; Y45-L58 HydrophobicContact CE1-CB 4.24Å; Y45-L58 HydrophobicContact CE1-CD1 4.21Å; Y45-L58 HydrophobicContact CE2-CD2 4.27Å; Y45-L58 HydrophobicContact CG-CB 3.74Å; Y45-L58 HydrophobicContact CG-CD2 4.5Å; C56-L58 PolarHBondContact O-N 2.88Å; L58-N81 HydrophobicContact CD1-CB 4.19Å; L58-N81 HydrophobicContact CD2-CB 4.15Å; L58-N81 HydrophobicContact CG-CB 3.88Å; L58-L82 HydrophobicContact CD2-CB 3.84Å; L58-L82 HydrophobicContact CD2-CD1 4.34Å; L58-L82 HydrophobicContact CD2-CG 4.35Å; L58-R85 HydrophobicContact CD1-CB 4.12Å
59	C	93.6	Very high	91.1	Very high	13 Å²	13	63 Å²	63	9%	0.088	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-9.8	-172.7	-65.2	0	0	0	0	114.1	C56 T61 H72 N81	C56-C59 HydrophobicContact CB-CB 4.3Å; C56-C59 PolarHBondContact O-N 3.25Å; C56-C59 VanDerWaalsContact O-N 3.15Å; C59-T61 VanDerWaalsContact C-N 3.25Å; C59-T61 HydrophobicContact CB-CG2 3.99Å; C59-T61 PolarHBondContact O-N 2.92Å; C59-H72 WeakPolarHBondContact CB-NE2 3.41Å; C59-H72 PolarHBondContact SG-NE2 3.04Å; C59-H72 VanDerWaalsContact SG-NE2 3.36Å; C59-N81 PolarHBondContact SG-ND2 2.85Å
60	L	92.6	Very high	91.1	Very high	155 Å²	155	61.9 Å²	61.9	81%	0.812	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	43.6	-171.9	-53.3	177.5	0	0	0	111.7	C56	C56-L60 WeakPolarHBondContact O-CA 3.22Å; C56-L60 PolarHBondContact O-N 2.83Å
61	T	93.8	Very high	91.1	Very high	33 Å²	33	56.5 Å²	56.5	20%	0.202	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.4	178.9	52.4	0	0	0	0	110.9	E55 C56 C59 H63 H72	E55-T61 CarbonylContact C-O 3.47Å; E55-T61 VanDerWaalsContact CA-O 3.31Å; E55-T61 WeakPolarHBondContact CA-O 3.18Å; C56-T61 PolarHBondContact N-O 2.9Å; C59-T61 VanDerWaalsContact C-N 3.25Å; C59-T61 HydrophobicContact CB-CG2 3.99Å; C59-T61 PolarHBondContact O-N 2.92Å; T61-H63 PolarHBondContact OG1-NE2 3.09Å; T61-H72 PolarHBondContact OG1-CE1 2.98Å; T61-H72 PolarHBondContact OG1-NE2 2.95Å
62	L	93.8	Very high	91.2	Very high	124 Å²	124	51 Å²	51	65%	0.649	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	141.5	175.1	-65.1	165.5	0	0	0	110	Y54 E55	Y54-L62 CarbonylContact O-C 3.55Å; E55-L62 HydrophobicContact CB-CD2 4.08Å
63	H	93.1	Very high	91.5	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.06	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.7	-178.3	-61.4	-75	0	0	0	109.5	Y54 T61 N65 S68 Y69 H72	Y54-H63 PolarHBondContact N-O 2.79Å; Y54-H63 PolarHBondContact O-N 2.89Å; T61-H63 PolarHBondContact OG1-NE2 3.09Å; H63-N65 VanDerWaalsContact C-N 3.28Å; H63-N65 PolarHBondContact O-N 2.86Å; H63-S68 PolarHBondContact ND1-O 3.17Å; H63-S68 PolarHBondContact ND1-OG 3.24Å; H63-Y69 AromaticContact CD2-CD2 3.68Å; H63-H72 WeakPolarHBondContact CE1-CB 3.22Å; H63-H72 AromaticContact CE1-CD2 3.93Å; H63-H72 AromaticContact CE1-CG 3.36Å; H63-H72 AromaticContact CE1-ND1 3.86Å; H63-H72 AromaticContact NE2-CD2 3.56Å; H63-H72 AromaticContact NE2-CG 3.48Å
64	N	91.4	Very high	91.3	Very high	152 Å²	152	54.9 Å²	54.9	81%	0.813	29%	0.292	S	S	*	.	S	Bend	trans	-72.9	-24.2	-177.4	-61.6	-7	0	0	0	112.5
65	N	88.9	Confident	91.3	Very high	65 Å²	65	54.2 Å²	54.2	35%	0.348	30%	0.298	S	S	.	.	S	Bend	trans	-149.8	158.7	-177	65.3	52.1	0	0	0	110.9	R31 H63 G67 S68 Y69	R31-N65 VanDerWaalsContact CZ-OD1 3.31Å; R31-N65 PolarHBondContact NH1-OD1 3.46Å; R31-N65 VanDerWaalsContact NH2-CB 3.34Å; R31-N65 PolarHBondContact NH2-OD1 3.32Å; H63-N65 VanDerWaalsContact C-N 3.28Å; H63-N65 PolarHBondContact O-N 2.86Å; N65-G67 VanDerWaalsContact C-N 3.32Å; N65-G67 PolarHBondContact O-N 3.29Å; N65-G67 PolarHBondContact OD1-N 2.88Å; N65-S68 WeakPolarHBondContact O-CB 3.21Å; N65-S68 PolarHBondContact O-N 3.2Å; N65-S68 WeakPolarHBondContact OD1-CB 3.45Å; N65-S68 PolarHBondContact OD1-N 3.42Å; N65-Y69 PolarHBondContact O-N 3.19Å
66	E	87.6	Confident	91.4	Very high	52 Å²	52	60.9 Å²	60.9	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-38.8	-174.8	-67	179.5	175.6	0	0	113.7	L35 L40 K48 Y54 S68 Y69 L70	L35-E66 HydrophobicContact CD2-CB 4.21Å; L40-E66 HydrophobicContact CD1-CB 3.72Å; L40-E66 HydrophobicContact CD1-CG 4.01Å; K48-E66 IonicContact NZ-OE1 3.24Å; Y54-E66 HydrophobicContact CD1-CG 3.97Å; Y54-E66 HydrophobicContact CD2-CG 4.28Å; Y54-E66 HydrophobicContact CE1-CG 3.32Å; Y54-E66 VanDerWaalsContact CE1-OE1 3.29Å; Y54-E66 WeakPolarHBondContact CE1-OE1 3.11Å; Y54-E66 HydrophobicContact CE2-CG 3.74Å; Y54-E66 HydrophobicContact CG-CG 4.38Å; Y54-E66 VanDerWaalsContact CZ-OE1 3.31Å; Y54-E66 VanDerWaalsContact OH-CD 3.3Å; Y54-E66 VanDerWaalsContact OH-CG 3.26Å; Y54-E66 WeakPolarHBondContact OH-CG 3.44Å; Y54-E66 PolarHBondContact OH-OE1 3.36Å; E66-S68 VanDerWaalsContact C-N 3.35Å; E66-S68 PolarHBondContact O-N 2.83Å; E66-Y69 WeakPolarHBondContact O-CA 3.25Å; E66-Y69 VanDerWaalsContact O-CB 3.3Å; E66-Y69 WeakPolarHBondContact O-CB 3.48Å; E66-Y69 PolarHBondContact O-N 2.87Å; E66-Y69 VanDerWaalsContact O-N 3.17Å; E66-L70 PolarHBondContact O-N 2.93Å
67	G	86.2	Confident	91.4	Very high	11 Å²	11	67.1 Å²	67.1	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-72.4	-23.9	176.4	0	0	0	0	0	114.2	R31 N65 Y69 L70 A71	R31-G67 VanDerWaalsContact NH1-CA 3.31Å; N65-G67 VanDerWaalsContact C-N 3.32Å; N65-G67 PolarHBondContact O-N 3.29Å; N65-G67 PolarHBondContact OD1-N 2.88Å; G67-Y69 VanDerWaalsContact C-N 3.32Å; G67-L70 PolarHBondContact O-N 2.81Å; G67-A71 WeakPolarHBondContact O-CB 3.42Å; G67-A71 PolarHBondContact O-N 2.82Å
68	S	89.4	Confident	91.4	Very high	48 Å²	48	61.7 Å²	61.7	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-68	-37.6	168.4	176.7	0	0	0	0	110.2	H63 N65 E66 H72	H63-S68 PolarHBondContact ND1-O 3.17Å; H63-S68 PolarHBondContact ND1-OG 3.24Å; N65-S68 WeakPolarHBondContact O-CB 3.21Å; N65-S68 PolarHBondContact O-N 3.2Å; N65-S68 WeakPolarHBondContact OD1-CB 3.45Å; N65-S68 PolarHBondContact OD1-N 3.42Å; E66-S68 VanDerWaalsContact C-N 3.35Å; E66-S68 PolarHBondContact O-N 2.83Å; S68-H72 WeakPolarHBondContact O-CB 3.36Å; S68-H72 PolarHBondContact O-N 2.81Å; S68-H72 VanDerWaalsContact O-N 3.09Å
69	Y	91.9	Very high	91.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-47.7	171.1	177.1	-91.8	0	0	0	111.5	L40 D43 F46 C56 H63 N65 E66 G67 A71 H72 T73	L40-Y69 HydrophobicContact CD2-CD1 3.66Å; L40-Y69 HydrophobicContact CD2-CE1 3.81Å; D43-Y69 VanDerWaalsContact CG-OH 3.29Å; D43-Y69 PolarHBondContact OD2-OH 2.81Å; F46-Y69 WeakPolarHBondContact CA-OH 3.46Å; F46-Y69 HydrophobicContact CB-CE1 3.94Å; F46-Y69 HydrophobicContact CB-CE2 4.4Å; F46-Y69 AromaticContact CD2-CD1 3.57Å; F46-Y69 HydrophobicContact CD2-CD1 3.57Å; F46-Y69 AromaticContact CD2-CD2 3.97Å; F46-Y69 HydrophobicContact CD2-CD2 3.97Å; F46-Y69 AromaticContact CD2-CE1 3.5Å; F46-Y69 HydrophobicContact CD2-CE1 3.5Å; F46-Y69 VanDerWaalsContact CD2-CE1 3.5Å; F46-Y69 AromaticContact CD2-CE2 3.88Å; F46-Y69 HydrophobicContact CD2-CE2 3.88Å; F46-Y69 AromaticContact CD2-CG 3.84Å; F46-Y69 HydrophobicContact CD2-CG 3.84Å; F46-Y69 AromaticContact CD2-CZ 3.68Å; F46-Y69 HydrophobicContact CE2-CD1 4Å; F46-Y69 HydrophobicContact CE2-CE1 4.36Å; F46-Y69 HydrophobicContact CE2-CG 4.12Å; F46-Y69 HydrophobicContact CG-CE1 4.09Å; F46-Y69 PolarHBondContact N-OH 3.14Å; C56-Y69 HydrophobicContact CB-CD2 4.15Å; C56-Y69 HydrophobicContact CB-CE2 3.61Å; H63-Y69 AromaticContact CD2-CD2 3.68Å; N65-Y69 PolarHBondContact O-N 3.19Å; E66-Y69 WeakPolarHBondContact O-CA 3.25Å; E66-Y69 VanDerWaalsContact O-CB 3.3Å; E66-Y69 WeakPolarHBondContact O-CB 3.48Å; E66-Y69 PolarHBondContact O-N 2.87Å; E66-Y69 VanDerWaalsContact O-N 3.17Å; G67-Y69 VanDerWaalsContact C-N 3.32Å; Y69-A71 PolarHBondContact O-N 2.86Å; Y69-H72 WeakPolarHBondContact O-CA 3.4Å; Y69-H72 VanDerWaalsContact O-CB 3.29Å; Y69-H72 WeakPolarHBondContact O-CB 2.74Å; Y69-H72 PolarHBondContact O-N 3.44Å; Y69-T73 HydrophobicContact CD1-CG2 4.09Å; Y69-T73 HydrophobicContact CE1-CG2 3.55Å; Y69-T73 HydrophobicContact CE2-CG2 4.42Å; Y69-T73 PolarHBondContact O-N 3.38Å
70	L	89.1	Confident	91.5	Very high	8 Å²	8	67.2 Å²	67.2	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-59.9	-42.5	176.8	-74	172.7	0	0	0	113.2	A34 L35 I38 L40 E66 G67 H72 T73 Q74	A34-L70 HydrophobicContact CB-CD1 4.35Å; L35-L70 HydrophobicContact CD2-CD1 3.52Å; L35-L70 HydrophobicContact CG-CD1 3.75Å; I38-L70 HydrophobicContact CB-CD2 4.35Å; I38-L70 HydrophobicContact CD1-CD2 4.26Å; I38-L70 HydrophobicContact CG2-CD2 4.21Å; L40-L70 HydrophobicContact CD2-CD2 3.42Å; L40-L70 VanDerWaalsContact CD2-CD2 3.42Å; L40-L70 HydrophobicContact CD2-CG 3.89Å; L40-L70 HydrophobicContact CG-CD2 4.28Å; E66-L70 PolarHBondContact O-N 2.93Å; G67-L70 PolarHBondContact O-N 2.81Å; L70-H72 PolarHBondContact O-N 2.61Å; L70-T73 PolarHBondContact O-N 2.65Å; L70-T73 PolarHBondContact O-OG1 3.18Å; L70-Q74 PolarHBondContact O-N 3.22Å
71	A	89.4	Confident	91.6	Very high	64 Å²	64	61 Å²	61	53%	0.529	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-32.4	175.2	0	0	0	0	0	111.5	G67 Y69 G75	G67-A71 WeakPolarHBondContact O-CB 3.42Å; G67-A71 PolarHBondContact O-N 2.82Å; Y69-A71 PolarHBondContact O-N 2.86Å; A71-G75 PolarHBondContact O-N 3.42Å
72	H	92.1	Very high	91.6	Very high	31 Å²	31	62.6 Å²	62.6	14%	0.144	34%	0.336	C	S	.	.	H	α-helix	trans	-69.7	-39.8	175.9	166.2	80.8	0	0	0	113.1	C59 T61 H63 S68 Y69 L70 Q74 G75 H78	C59-H72 WeakPolarHBondContact CB-NE2 3.41Å; C59-H72 PolarHBondContact SG-NE2 3.04Å; C59-H72 VanDerWaalsContact SG-NE2 3.36Å; T61-H72 PolarHBondContact OG1-CE1 2.98Å; T61-H72 PolarHBondContact OG1-NE2 2.95Å; H63-H72 WeakPolarHBondContact CE1-CB 3.22Å; H63-H72 AromaticContact CE1-CD2 3.93Å; H63-H72 AromaticContact CE1-CG 3.36Å; H63-H72 AromaticContact CE1-ND1 3.86Å; H63-H72 AromaticContact NE2-CD2 3.56Å; H63-H72 AromaticContact NE2-CG 3.48Å; S68-H72 WeakPolarHBondContact O-CB 3.36Å; S68-H72 PolarHBondContact O-N 2.81Å; S68-H72 VanDerWaalsContact O-N 3.09Å; Y69-H72 WeakPolarHBondContact O-CA 3.4Å; Y69-H72 VanDerWaalsContact O-CB 3.29Å; Y69-H72 WeakPolarHBondContact O-CB 2.74Å; Y69-H72 PolarHBondContact O-N 3.44Å; L70-H72 PolarHBondContact O-N 2.61Å; H72-Q74 PolarHBondContact O-N 2.95Å; H72-G75 WeakPolarHBondContact O-CA 3.45Å; H72-G75 PolarHBondContact O-N 3.31Å; H72-H78 AromaticContact CD2-ND1 3.59Å; H72-H78 AromaticContact NE2-CG 3.9Å; H72-H78 AromaticContact NE2-ND1 3.21Å; H72-H78 PolarHBondContact NE2-ND1 3.25Å; H72-H78 VanDerWaalsContact O-CB 3.22Å; H72-H78 WeakPolarHBondContact O-CB 3.02Å
73	T	91.5	Very high	91.5	Very high	19 Å²	19	59.7 Å²	59.7	12%	0.117	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-31	178.7	61.4	0	0	0	0	112.3	Y69 L70 G75 H78 Q79	Y69-T73 HydrophobicContact CD1-CG2 4.09Å; Y69-T73 HydrophobicContact CE1-CG2 3.55Å; Y69-T73 HydrophobicContact CE2-CG2 4.42Å; Y69-T73 PolarHBondContact O-N 3.38Å; L70-T73 PolarHBondContact O-N 2.65Å; L70-T73 PolarHBondContact O-OG1 3.18Å; T73-G75 VanDerWaalsContact C-N 3.26Å; T73-G75 PolarHBondContact O-N 3.02Å; T73-H78 PolarHBondContact O-CD2 2.95Å; T73-Q79 PolarHBondContact O-NE2 3.49Å
74	Q	88.3	Confident	91.5	Very high	134 Å²	134	66.9 Å²	66.9	63%	0.626	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-10	173.3	-61.2	176.2	18.6	0	0	113.2	L70 H72	L70-Q74 PolarHBondContact O-N 3.22Å; H72-Q74 PolarHBondContact O-N 2.95Å
75	G	92.4	Very high	91.5	Very high	26 Å²	26	64.6 Å²	64.6	27%	0.268	34%	0.336	S	S	.	.	S	Bend	trans	-74.6	146	-178.4	0	0	0	0	0	113.6	A71 H72 T73 K77 H78 Q79	A71-G75 PolarHBondContact O-N 3.42Å; H72-G75 WeakPolarHBondContact O-CA 3.45Å; H72-G75 PolarHBondContact O-N 3.31Å; T73-G75 VanDerWaalsContact C-N 3.26Å; T73-G75 PolarHBondContact O-N 3.02Å; G75-K77 PolarHBondContact O-N 2.8Å; G75-K77 VanDerWaalsContact O-N 3.15Å; G75-H78 PolarHBondContact O-N 3.35Å; G75-Q79 PolarHBondContact O-N 2.91Å; G75-Q79 VanDerWaalsContact O-N 3.14Å
76	K	94.9	Very high	91.5	Very high	195 Å²	195	64 Å²	64	85%	0.848	34%	0.341	S	S	*	.	H	α-helix	trans	-53.4	-37.9	179.6	-67.5	-174.3	179.4	-177.6	0	113.6	Q79 A80	K76-Q79 PolarHBondContact O-N 3.11Å; K76-A80 WeakPolarHBondContact O-CB 3.24Å; K76-A80 PolarHBondContact O-N 3.18Å
77	K	94.2	Very high	91.6	Very high	131 Å²	131	64.5 Å²	64.5	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-63.8	-43.5	179.6	-174.1	-179	178.9	-175.4	0	111.6	G75 A80 N81	G75-K77 PolarHBondContact O-N 2.8Å; G75-K77 VanDerWaalsContact O-N 3.15Å; K77-A80 PolarHBondContact O-N 2.87Å; K77-N81 WeakPolarHBondContact O-CB 3.36Å; K77-N81 VanDerWaalsContact O-CG 3.32Å; K77-N81 PolarHBondContact O-N 2.79Å
78	H	94.2	Very high	91.6	Very high	5 Å²	5	70.2 Å²	70.2	2%	0.023	38%	0.375	C	S	.	.	H	α-helix	trans	-65.1	-46.6	178.1	-175.1	97.8	0	0	0	110.7	C56 H72 T73 G75 A80 N81 L82	C56-H78 PolarHBondContact SG-CE1 2.86Å; C56-H78 PolarHBondContact SG-ND1 2.85Å; C56-H78 VanDerWaalsContact SG-ND1 3.41Å; H72-H78 AromaticContact CD2-ND1 3.59Å; H72-H78 AromaticContact NE2-CG 3.9Å; H72-H78 AromaticContact NE2-ND1 3.21Å; H72-H78 PolarHBondContact NE2-ND1 3.25Å; H72-H78 VanDerWaalsContact O-CB 3.22Å; H72-H78 WeakPolarHBondContact O-CB 3.02Å; T73-H78 PolarHBondContact O-CD2 2.95Å; G75-H78 PolarHBondContact O-N 3.35Å; H78-A80 PolarHBondContact O-N 2.87Å; H78-N81 PolarHBondContact O-N 3.13Å; H78-L82 WeakPolarHBondContact O-CB 3.41Å; H78-L82 PolarHBondContact O-N 2.97Å
79	Q	93.6	Very high	91.4	Very high	100 Å²	100	71.2 Å²	71.2	47%	0.467	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.9	-64.2	-60.7	-33.6	0	0	112.7	T73 G75 K76 N81 L82 A83	T73-Q79 PolarHBondContact O-NE2 3.49Å; G75-Q79 PolarHBondContact O-N 2.91Å; G75-Q79 VanDerWaalsContact O-N 3.14Å; K76-Q79 PolarHBondContact O-N 3.11Å; Q79-N81 PolarHBondContact O-N 2.79Å; Q79-L82 PolarHBondContact O-N 2.87Å; Q79-A83 PolarHBondContact O-N 2.87Å
80	A	94.5	Very high	90.8	Very high	45 Å²	45	73.6 Å²	73.6	37%	0.372	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-36.9	175.8	0	0	0	0	0	112.9	K76 K77 H78 L82 R84	K76-A80 WeakPolarHBondContact O-CB 3.24Å; K76-A80 PolarHBondContact O-N 3.18Å; K77-A80 PolarHBondContact O-N 2.87Å; H78-A80 PolarHBondContact O-N 2.87Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-R84 WeakPolarHBondContact O-CG 3.36Å; A80-R84 PolarHBondContact O-N 2.68Å
81	N	94.2	Very high	90.1	Very high	26 Å²	26	79.7 Å²	79.7	14%	0.139	42%	0.423	C	S	.	.	H	α-helix	trans	-67.2	-36.9	173.8	-75.4	-8.5	0	0	0	111.8	L58 C59 K77 H78 Q79 R84 R85	L58-N81 HydrophobicContact CD1-CB 4.19Å; L58-N81 HydrophobicContact CD2-CB 4.15Å; L58-N81 HydrophobicContact CG-CB 3.88Å; C59-N81 PolarHBondContact SG-ND2 2.85Å; K77-N81 WeakPolarHBondContact O-CB 3.36Å; K77-N81 VanDerWaalsContact O-CG 3.32Å; K77-N81 PolarHBondContact O-N 2.79Å; H78-N81 PolarHBondContact O-N 3.13Å; Q79-N81 PolarHBondContact O-N 2.79Å; N81-R84 PolarHBondContact O-N 2.83Å; N81-R84 PolarHBondContact OD1-NH2 2.8Å; N81-R85 WeakPolarHBondContact O-CB 3.47Å; N81-R85 PolarHBondContact O-N 3.08Å
82	L	93.1	Very high	89.5	Confident	66 Å²	66	80.7 Å²	80.7	35%	0.346	42%	0.419	S	S	.	.	H	α-helix	trans	-66.1	-44.3	177.3	-163.9	144.7	0	0	0	110.5	Y45 L58 H78 Q79 A80 R84 R85 A86	Y45-L82 HydrophobicContact CE2-CD1 4.25Å; L58-L82 HydrophobicContact CD2-CB 3.84Å; L58-L82 HydrophobicContact CD2-CD1 4.34Å; L58-L82 HydrophobicContact CD2-CG 4.35Å; H78-L82 WeakPolarHBondContact O-CB 3.41Å; H78-L82 PolarHBondContact O-N 2.97Å; Q79-L82 PolarHBondContact O-N 2.87Å; A80-L82 VanDerWaalsContact C-N 3.33Å; L82-R84 PolarHBondContact O-N 2.73Å; L82-R85 PolarHBondContact O-N 2.91Å; L82-A86 WeakPolarHBondContact O-CB 3.33Å; L82-A86 PolarHBondContact O-N 2.93Å
83	A	92.3	Very high	88.2	Confident	62 Å²	62	85.8 Å²	85.8	51%	0.512	45%	0.446	S	S	.	.	H	α-helix	trans	-60.3	-42.9	173.1	0	0	0	0	0	112.3	Q79 A86 A87	Q79-A83 PolarHBondContact O-N 2.87Å; A83-A86 PolarHBondContact O-N 2.83Å; A83-A87 WeakPolarHBondContact O-CB 3.43Å; A83-A87 PolarHBondContact O-N 3.21Å
84	R	92.8	Very high	86.3	Confident	165 Å²	165	87.8 Å²	87.8	62%	0.623	46%	0.458	S	S	*	.	H	α-helix	trans	-64.1	-40.6	175.6	-78.1	-171.9	-77.4	-168.2	-4.9	112.8	A80 N81 L82 A87 K88	A80-R84 WeakPolarHBondContact O-CG 3.36Å; A80-R84 PolarHBondContact O-N 2.68Å; N81-R84 PolarHBondContact O-N 2.83Å; N81-R84 PolarHBondContact OD1-NH2 2.8Å; L82-R84 PolarHBondContact O-N 2.73Å; R84-A87 PolarHBondContact O-N 3.32Å; R84-K88 PolarHBondContact O-N 3.46Å
85	R	90.8	Very high	84.5	Confident	103 Å²	103	83.2 Å²	83.2	39%	0.389	45%	0.447	S	S	.	.	H	α-helix	trans	-66.2	-44.6	175.6	-177.7	169.9	-69.9	-88.8	3.4	111.2	Y45 L58 N81 L82 A87 K88 D89	Y45-R85 WeakPolarHBondContact OH-CD 3.3Å; L58-R85 HydrophobicContact CD1-CB 4.12Å; N81-R85 WeakPolarHBondContact O-CB 3.47Å; N81-R85 PolarHBondContact O-N 3.08Å; L82-R85 PolarHBondContact O-N 2.91Å; R85-A87 VanDerWaalsContact C-N 3.29Å; R85-A87 PolarHBondContact O-N 3.47Å; R85-K88 PolarHBondContact O-N 2.88Å; R85-K88 VanDerWaalsContact O-N 3.13Å; R85-D89 WeakPolarHBondContact O-CB 3.19Å; R85-D89 VanDerWaalsContact O-CG 3.28Å; R85-D89 PolarHBondContact O-N 3.38Å
86	A	89.4	Confident	82.6	Confident	54 Å²	54	86 Å²	86	45%	0.446	47%	0.468	S	S	.	.	H	α-helix	trans	-59.3	-40.1	174.8	0	0	0	0	0	112.1	L82 A83 A90	L82-A86 WeakPolarHBondContact O-CB 3.33Å; L82-A86 PolarHBondContact O-N 2.93Å; A83-A86 PolarHBondContact O-N 2.83Å; A86-A90 WeakPolarHBondContact O-CB 3.15Å; A86-A90 PolarHBondContact O-N 2.93Å
87	A	88.9	Confident	80.3	Confident	62 Å²	62	83.1 Å²	83.1	51%	0.512	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.7	0	0	0	0	0	112.4	A83 R84 R85 F91	A83-A87 WeakPolarHBondContact O-CB 3.43Å; A83-A87 PolarHBondContact O-N 3.21Å; R84-A87 PolarHBondContact O-N 3.32Å; R85-A87 VanDerWaalsContact C-N 3.29Å; R85-A87 PolarHBondContact O-N 3.47Å; A87-F91 WeakPolarHBondContact O-CB 3.32Å; A87-F91 PolarHBondContact O-N 2.61Å
88	K	87.4	Confident	77.6	Confident	130 Å²	130	82.6 Å²	82.6	57%	0.565	47%	0.473	S	S	*	.	H	α-helix	trans	-67.5	-45.3	175.5	-172.9	-179.9	176.5	-178.1	0	111.9	R84 R85 A90 F91 D92	R84-K88 PolarHBondContact O-N 3.46Å; R85-K88 PolarHBondContact O-N 2.88Å; R85-K88 VanDerWaalsContact O-N 3.13Å; K88-A90 VanDerWaalsContact C-N 3.3Å; K88-A90 PolarHBondContact O-N 3.42Å; K88-F91 CarbonylContact O-C 3.57Å; K88-F91 WeakPolarHBondContact O-CA 3.32Å; K88-F91 WeakPolarHBondContact O-CB 3.05Å; K88-F91 PolarHBondContact O-N 2.88Å; K88-F91 VanDerWaalsContact O-N 3.08Å; K88-D92 PolarHBondContact O-N 2.76Å
89	D	84.3	Confident	75.5	Confident	69 Å²	69	87.7 Å²	87.7	37%	0.369	50%	0.499	S	S	.	.	H	α-helix	trans	-65.7	-37.4	178.7	-65.3	-16.5	0	0	0	110.4	R85 F91 D92 I93	R85-D89 WeakPolarHBondContact O-CB 3.19Å; R85-D89 VanDerWaalsContact O-CG 3.28Å; R85-D89 PolarHBondContact O-N 3.38Å; D89-F91 VanDerWaalsContact C-N 3.33Å; D89-D92 PolarHBondContact O-N 2.72Å; D89-I93 WeakPolarHBondContact O-CB 3.43Å; D89-I93 WeakPolarHBondContact O-CD1 3.34Å; D89-I93 WeakPolarHBondContact O-CG1 3.31Å; D89-I93 PolarHBondContact O-N 2.69Å
90	A	79.1	Confident	73.5	Confident	50 Å²	50	88 Å²	88	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-43.4	170.2	0	0	0	0	0	111.2	A86 K88 I93 T94	A86-A90 WeakPolarHBondContact O-CB 3.15Å; A86-A90 PolarHBondContact O-N 2.93Å; K88-A90 VanDerWaalsContact C-N 3.3Å; K88-A90 PolarHBondContact O-N 3.42Å; A90-I93 PolarHBondContact O-N 3.06Å; A90-T94 WeakPolarHBondContact O-CB 3.26Å; A90-T94 WeakPolarHBondContact O-CG2 3.12Å; A90-T94 PolarHBondContact O-N 2.88Å; A90-T94 PolarHBondContact O-OG1 3.32Å
91	F	75.7	Confident	71.5	Confident	136 Å²	136	93.8 Å²	93.8	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-66.6	-37	174.5	-172.3	-90	0	0	0	112.8	A87 K88 D89 T94 G95	A87-F91 WeakPolarHBondContact O-CB 3.32Å; A87-F91 PolarHBondContact O-N 2.61Å; K88-F91 CarbonylContact O-C 3.57Å; K88-F91 WeakPolarHBondContact O-CA 3.32Å; K88-F91 WeakPolarHBondContact O-CB 3.05Å; K88-F91 PolarHBondContact O-N 2.88Å; K88-F91 VanDerWaalsContact O-N 3.08Å; D89-F91 VanDerWaalsContact C-N 3.33Å; F91-T94 PolarHBondContact O-N 2.94Å; F91-G95 WeakPolarHBondContact O-CA 3.37Å; F91-G95 PolarHBondContact O-N 3.05Å
92	D	75.2	Confident	69.7	Low	85 Å²	85	100.2 Å²	100.2	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-71.5	-35.5	178	-74	-21.5	0	0	0	110.8	K88 D89	K88-D92 PolarHBondContact O-N 2.76Å; D89-D92 PolarHBondContact O-N 2.72Å
93	I	65.5	Low	68	Low	138 Å²	138	102.2 Å²	102.2	71%	0.708	57%	0.572	S	S	*	*	H	α-helix	trans	-67	-38	173.2	-68.9	166.1	0	0	0	111.5	D89 A90	D89-I93 WeakPolarHBondContact O-CB 3.43Å; D89-I93 WeakPolarHBondContact O-CD1 3.34Å; D89-I93 WeakPolarHBondContact O-CG1 3.31Å; D89-I93 PolarHBondContact O-N 2.69Å; A90-I93 PolarHBondContact O-N 3.06Å
94	T	52.1	Low	66.4	Low	62 Å²	62	110.5 Å²	110.5	38%	0.38	59%	0.59	S	S	.	*	H	α-helix	trans	-100.6	-18.2	-173.6	57.2	0	0	0	0	114.6	A90 F91 L97	A90-T94 WeakPolarHBondContact O-CB 3.26Å; A90-T94 WeakPolarHBondContact O-CG2 3.12Å; A90-T94 PolarHBondContact O-N 2.88Å; A90-T94 PolarHBondContact O-OG1 3.32Å; F91-T94 PolarHBondContact O-N 2.94Å; T94-L97 CarbonylContact O-C 3.59Å
95	G	50.6	Low	65.1	Low	38 Å²	38	107.9 Å²	107.9	39%	0.392	59%	0.592	S	S	.	*	H	α-helix	trans	-108.1	-11.1	-168	0	0	0	0	0	114.5	F91 L97	F91-G95 WeakPolarHBondContact O-CA 3.37Å; F91-G95 PolarHBondContact O-N 3.05Å; G95-L97 PolarHBondContact O-N 2.79Å
96	A	52.4	Low	64.1	Low	84 Å²	84	110.9 Å²	110.9	69%	0.694	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-20.9	167	0	0	0	0	0	112.4
97	L	47.1	Very low	63.2	Low	135 Å²	135	113.9 Å²	113.9	71%	0.707	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.1	119.5	163.4	-70.9	176	0	0	0	106.1	T94 G95 M99	T94-L97 CarbonylContact O-C 3.59Å; G95-L97 PolarHBondContact O-N 2.79Å; L97-M99 HydrophobicContact CB-CG 4.2Å; L97-M99 PolarHBondContact O-N 3.13Å
98	S	37.2	Very low	62.5	Low	119 Å²	119	118.3 Å²	118.3	83%	0.832	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.9	86.4	164.2	170.3	0	0	0	0	109.8
99	M	49.6	Very low	62	Low	112 Å²	112	122.1 Å²	122.1	55%	0.552	65%	0.65	S	S	*	*			trans	-120.4	122.6	175.6	-83.7	-86.7	102.9	0	0	104.8	L97 E101	L97-M99 HydrophobicContact CB-CG 4.2Å; L97-M99 PolarHBondContact O-N 3.13Å; M99-E101 PolarHBondContact O-N 3.37Å
100	P	51.1	Low	62	Low	106 Å²	106	122.5 Å²	122.5	69%	0.688	65%	0.649	S	S	*	*			trans	-51.7	135.3	178.2	21.6	-31.8	0	0	0	108.8	K102	P100-K102 VanDerWaalsContact C-N 3.35Å; P100-K102 PolarHBondContact O-N 2.92Å
101	E	52.6	Low	62.5	Low	168 Å²	168	126.3 Å²	126.3	79%	0.785	67%	0.667	S	S	*	*			trans	-46.1	99.6	179	-163.1	175	-163	0	0	108.2	M99 P103	M99-E101 PolarHBondContact O-N 3.37Å; E101-P103 WeakPolarHBondContact O-CD 3.49Å; E101-P103 VanDerWaalsContact O-N 3.1Å
102	K	56.1	Low	63.3	Low	161 Å²	161	125.6 Å²	125.6	70%	0.7	66%	0.663	S	S	*	*			trans	-61.4	123.7	179.4	-75.6	172.3	-176.1	168.9	0	104.6	P100 R104	P100-K102 VanDerWaalsContact C-N 3.35Å; P100-K102 PolarHBondContact O-N 2.92Å; K102-R104 PolarHBondContact O-N 3.11Å
103	P	57.1	Low	64.2	Low	108 Å²	108	125.5 Å²	125.5	70%	0.701	66%	0.662	S	S	*	*			trans	-50.3	125.2	177.7	19.1	-30.5	0	0	0	106.9	E101 V105	E101-P103 WeakPolarHBondContact O-CD 3.49Å; E101-P103 VanDerWaalsContact O-N 3.1Å; P103-V105 HydrophobicContact CB-CG2 4.46Å; P103-V105 HydrophobicContact CG-CG2 4.42Å; P103-V105 PolarHBondContact O-N 3.16Å
104	R	60.2	Low	65.6	Low	235 Å²	235	120.1 Å²	120.1	89%	0.887	64%	0.64	S	S	*	*			trans	-66.6	82.1	172.8	-71.8	-177.9	-179.5	165.9	1.8	106.4	K102 E106	K102-R104 PolarHBondContact O-N 3.11Å; R104-E106 PolarHBondContact O-N 3.1Å; R104-E106 VanDerWaalsContact O-N 3.1Å
105	V	64	Low	67.6	Low	110 Å²	110	126.3 Å²	126.3	67%	0.667	66%	0.657	S	S	*	*			trans	-66.6	111.3	172.7	-180	0	0	0	0	105	P103	P103-V105 HydrophobicContact CB-CG2 4.46Å; P103-V105 HydrophobicContact CG-CG2 4.42Å; P103-V105 PolarHBondContact O-N 3.16Å
106	E	70.1	Confident	69.8	Low	166 Å²	166	124.8 Å²	124.8	78%	0.776	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-53.9	127.4	171.6	-66.7	-172.8	165.8	0	0	108	R104 K108	R104-E106 PolarHBondContact O-N 3.1Å; R104-E106 VanDerWaalsContact O-N 3.1Å; E106-K108 PolarHBondContact O-N 2.96Å
107	P	71.3	Confident	71.9	Confident	118 Å²	118	122.7 Å²	122.7	77%	0.766	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.2	-178.7	24	-32.1	0	0	0	108.4	K109	P107-K109 PolarHBondContact O-N 3.41Å
108	K	73.5	Confident	74.3	Confident	155 Å²	155	123 Å²	123	67%	0.674	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.8	174.3	-70.1	177.6	175.3	177.4	0	108.1	E106 F110	E106-K108 PolarHBondContact O-N 2.96Å; K108-F110 WeakPolarHBondContact O-CD1 3.29Å
109	K	77.9	Confident	77.2	Confident	210 Å²	210	123.4 Å²	123.4	91%	0.913	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-86.9	117.9	173.6	-65.4	-179.6	-177.5	175.6	0	107.9	P107	P107-K109 PolarHBondContact O-N 3.41Å
110	F	84.2	Confident	79.4	Confident	77 Å²	77	121 Å²	121	34%	0.338	60%	0.597	S	S	.	*			trans	-134	156.3	174.9	55.9	-89.4	0	0	0	109.7	K108 K112 E175 P176	K108-F110 WeakPolarHBondContact O-CD1 3.29Å; F110-K112 HydrophobicContact CD2-CG 4.31Å; F110-K112 HydrophobicContact CE2-CG 3.91Å; F110-E175 HydrophobicContact CD1-CB 4.41Å; F110-E175 HydrophobicContact CD1-CG 4.15Å; F110-E175 HydrophobicContact CD2-CB 4.48Å; F110-E175 HydrophobicContact CE1-CB 4.01Å; F110-E175 HydrophobicContact CE1-CG 3.42Å; F110-E175 VanDerWaalsContact CE1-CG 3.42Å; F110-E175 WeakPolarHBondContact CE1-OE1 3.21Å; F110-E175 HydrophobicContact CE2-CB 4.06Å; F110-E175 HydrophobicContact CE2-CG 4.23Å; F110-E175 HydrophobicContact CZ-CB 3.82Å; F110-E175 HydrophobicContact CZ-CG 3.47Å; F110-E175 VanDerWaalsContact CZ-CG 3.47Å; F110-P176 HydrophobicContact CD2-CB 3.95Å; F110-P176 HydrophobicContact CE2-CB 4.3Å
111	V	89.2	Confident	81.6	Confident	130 Å²	130	118.3 Å²	118.3	79%	0.788	58%	0.579	S	S	*	*			trans	-76.2	126.6	173.3	-178.8	0	0	0	0	108
112	K	92.4	Very high	83.7	Confident	121 Å²	121	118.8 Å²	118.8	53%	0.526	58%	0.579	S	S	.	*			trans	-82	135.4	178.1	-60.5	-175.5	-174.8	174.4	0	110.3	F110 P176 E178	F110-K112 HydrophobicContact CD2-CG 4.31Å; F110-K112 HydrophobicContact CE2-CG 3.91Å; K112-P176 WeakPolarHBondContact CA-O 3.31Å; K112-E178 HydrophobicContact CB-CG 4.25Å; K112-E178 HydrophobicContact CD-CG 3.93Å
113	I	93.2	Very high	85.4	Confident	82 Å²	82	114.7 Å²	114.7	42%	0.421	56%	0.562	S	S	.	*			trans	-89.9	-13.6	-176.9	62.9	170.5	0	0	0	113.8	E141 P176 Y177	I113-E141 HydrophobicContact CD1-CB 3.73Å; I113-P176 HydrophobicContact CD1-CG 3.77Å; I113-P176 HydrophobicContact CG1-CB 4.48Å; I113-P176 HydrophobicContact CG1-CG 3.92Å; I113-P176 HydrophobicContact CG2-CB 4.25Å; I113-P176 HydrophobicContact CG2-CG 3.96Å; I113-P176 PolarHBondContact N-O 2.84Å; I113-P176 VanDerWaalsContact N-O 3.13Å; I113-Y177 HydrophobicContact CD1-CD1 4.07Å; I113-Y177 HydrophobicContact CD1-CD2 4.22Å; I113-Y177 HydrophobicContact CD1-CE1 3.67Å; I113-Y177 HydrophobicContact CD1-CE2 3.86Å; I113-Y177 HydrophobicContact CD1-CG 4.35Å; I113-Y177 HydrophobicContact CG1-CD1 4.02Å; I113-Y177 HydrophobicContact CG1-CE1 4.06Å; I113-Y177 HydrophobicContact CG1-CG 4.31Å
114	G	95.1	Very high	87.1	Confident	25 Å²	25	117.6 Å²	117.6	26%	0.258	56%	0.559	S	S	.	*			trans	131.7	-163.9	-178.3	0	0	0	0	0	112.7	Y177 E178	G114-Y177 WeakPolarHBondContact O-CA 3.47Å; G114-Y177 WeakPolarHBondContact O-CD1 3.35Å; G114-E178 PolarHBondContact O-N 2.96Å
115	R	95.6	Very high	88.4	Confident	193 Å²	193	109 Å²	109	73%	0.728	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-90.9	139.5	-178.4	-62.9	179.1	-178	-178.4	0.7	111.1	E178 I180	R115-E178 HydrophobicContact CG-CB 4.21Å; R115-E178 VanDerWaalsContact CG-OE2 3.29Å; R115-E178 WeakPolarHBondContact CG-OE2 3.48Å; R115-E178 IonicContact NE-OE2 3.94Å; R115-E178 PolarHBondContact NE-OE2 3.13Å; R115-I180 HydrophobicContact CB-CG2 4.38Å; R115-I180 HydrophobicContact CG-CG2 4.49Å
116	P	96.3	Very high	89.5	Confident	5 Å²	5	110 Å²	110	3%	0.032	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-72.8	156.7	176.1	33.8	-36.2	0	0	0	111.5	I137 D138 Y139 Y177 I180	P116-I137 HydrophobicContact CB-CG2 3.86Å; P116-I137 HydrophobicContact CG-CG2 3.89Å; P116-D138 WeakPolarHBondContact CB-O 3.43Å; P116-Y139 HydrophobicContact CB-CD1 3.61Å; P116-Y139 HydrophobicContact CB-CE1 3.42Å; P116-Y139 VanDerWaalsContact CB-CE1 3.42Å; P116-Y139 HydrophobicContact CG-CD1 4.26Å; P116-Y139 HydrophobicContact CG-CE1 3.54Å; P116-Y177 HydrophobicContact CB-CD1 3.81Å; P116-Y177 HydrophobicContact CB-CE1 4.17Å; P116-Y177 HydrophobicContact CB-CG 4.13Å; P116-Y177 HydrophobicContact CG-CD1 4.46Å; P116-I180 HydrophobicContact CG-CD1 3.92Å; P116-I180 HydrophobicContact CG-CG1 4.25Å; P116-I180 HydrophobicContact CG-CG2 4.01Å
117	G	96.7	Very high	90.2	Very high	40 Å²	40	107.2 Å²	107.2	41%	0.412	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	146.2	170.4	0	0	0	0	0	110.8	I137 D138	G117-I137 WeakPolarHBondContact O-CA 3.37Å; G117-I137 WeakPolarHBondContact O-CG2 3.4Å; G117-D138 PolarHBondContact O-N 3.46Å
118	Y	97	Very high	90.9	Very high	143 Å²	143	103.8 Å²	103.8	56%	0.561	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.7	179.2	63.7	-95.1	0	0	0	112.9	V120 Q136 I180 F182	Y118-V120 HydrophobicContact CD2-CG2 4.16Å; Y118-Q136 CarbonylContact C-O 3.56Å; Y118-Q136 VanDerWaalsContact CA-O 3.26Å; Y118-Q136 WeakPolarHBondContact CA-O 3.41Å; Y118-I180 HydrophobicContact CD1-CD1 4.32Å; Y118-F182 HydrophobicContact CD1-CZ 4.21Å; Y118-F182 AromaticContact CD2-CE1 3.6Å; Y118-F182 HydrophobicContact CD2-CE1 3.6Å; Y118-F182 AromaticContact CD2-CZ 3.68Å; Y118-F182 HydrophobicContact CD2-CZ 3.68Å; Y118-F182 AromaticContact CE2-CE1 3.68Å; Y118-F182 HydrophobicContact CE2-CE1 3.68Å; Y118-F182 HydrophobicContact CE2-CZ 4.18Å; Y118-F182 HydrophobicContact CG-CE1 4.07Å; Y118-F182 AromaticContact CG-CZ 3.7Å; Y118-F182 HydrophobicContact CG-CZ 3.7Å
119	K	97.5	Very high	91.5	Very high	126 Å²	126	97.4 Å²	97.4	55%	0.548	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.2	171.2	-177.9	178.8	-179.9	-179.4	0	109.2	Q136	K119-Q136 HydrophobicContact CB-CB 4.32Å; K119-Q136 PolarHBondContact N-O 2.89Å; K119-Q136 PolarHBondContact O-N 2.92Å
120	V	97	Very high	92	Very high	61 Å²	61	87.9 Å²	87.9	37%	0.37	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.2	178.9	-172.2	0	0	0	0	108.9	Y118 L134 F135 F182	Y118-V120 HydrophobicContact CD2-CG2 4.16Å; V120-L134 WeakPolarHBondContact CA-O 3.39Å; V120-F135 HydrophobicContact CB-CD1 4.46Å; V120-F135 HydrophobicContact CB-CE1 4.34Å; V120-F135 HydrophobicContact CG1-CD1 4.15Å; V120-F135 HydrophobicContact CG1-CE1 3.74Å; V120-F135 HydrophobicContact CG1-CE2 4.48Å; V120-F135 HydrophobicContact CG1-CZ 3.94Å; V120-F135 HydrophobicContact CG2-CD1 3.66Å; V120-F135 HydrophobicContact CG2-CE1 3.61Å; V120-F182 HydrophobicContact CG2-CD1 4.22Å; V120-F182 HydrophobicContact CG2-CE1 3.77Å; V120-F182 HydrophobicContact CG2-CZ 4.22Å
121	T	96.9	Very high	92.5	Very high	51 Å²	51	89 Å²	89	31%	0.313	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.3	178.4	-51	0	0	0	0	109	Q123 L134	T121-Q123 HydrophobicContact CG2-CG 4.08Å; T121-L134 PolarHBondContact N-O 3.23Å; T121-L134 PolarHBondContact O-N 2.74Å
122	K	95.5	Very high	92.7	Very high	178 Å²	178	83.4 Å²	83.4	77%	0.774	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.5	170.2	-63.6	172.6	-177.7	-81.2	0	108.1	L133	K122-L133 HydrophobicContact CB-CD2 4.26Å; K122-L133 HydrophobicContact CG-CD2 3.64Å
123	Q	93.4	Very high	92.9	Very high	75 Å²	75	78.3 Å²	78.3	35%	0.35	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	154.2	-178.3	-74.1	176.3	-27.1	0	0	109.5	T121 S132	T121-Q123 HydrophobicContact CG2-CG 4.08Å; Q123-S132 WeakPolarHBondContact CB-OG 3.43Å; Q123-S132 PolarHBondContact N-O 3.19Å; Q123-S132 PolarHBondContact O-N 3.13Å
124	R	91.8	Very high	93	Very high	168 Å²	168	75.9 Å²	75.9	63%	0.634	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	122.9	172.3	-169.7	178.7	-172.4	-169.7	-3.7	107.1	P126 G129 Q130	R124-P126 WeakPolarHBondContact O-CD 3.35Å; R124-G129 WeakPolarHBondContact CG-O 3.33Å; R124-G129 PolarHBondContact NE-O 3.23Å; R124-Q130 WeakPolarHBondContact CA-O 3.43Å
125	D	87.4	Confident	93.2	Very high	56 Å²	56	74.8 Å²	74.8	30%	0.299	38%	0.381	S	S	.	.			trans	-65	122.6	174.2	172.2	13.7	0	0	0	108.8	S127 S128 G129 Q130	D125-S127 VanDerWaalsContact CG-OG 3.29Å; D125-S127 PolarHBondContact O-N 2.71Å; D125-S127 PolarHBondContact OD1-N 3.04Å; D125-S127 PolarHBondContact OD1-OG 3.35Å; D125-S127 PolarHBondContact OD2-OG 3.13Å; D125-S128 WeakPolarHBondContact CB-OG 3.45Å; D125-S128 VanDerWaalsContact CG-OG 3.29Å; D125-S128 VanDerWaalsContact OD2-CB 3.28Å; D125-S128 WeakPolarHBondContact OD2-CB 3.5Å; D125-S128 PolarHBondContact OD2-N 3.43Å; D125-S128 PolarHBondContact OD2-OG 3.43Å; D125-G129 WeakPolarHBondContact O-CA 3.34Å; D125-G129 PolarHBondContact O-N 2.68Å; D125-Q130 PolarHBondContact N-O 2.88Å
126	P	87.2	Confident	93.3	Very high	131 Å²	131	67.6 Å²	67.6	85%	0.851	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.1	-178.7	25.5	-35.1	0	0	0	113.2	R124	R124-P126 WeakPolarHBondContact O-CD 3.35Å
127	S	85.6	Confident	93.3	Very high	106 Å²	106	67.4 Å²	67.4	74%	0.741	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-50.1	-176	66.3	0	0	0	0	112.5	D125	D125-S127 VanDerWaalsContact CG-OG 3.29Å; D125-S127 PolarHBondContact O-N 2.71Å; D125-S127 PolarHBondContact OD1-N 3.04Å; D125-S127 PolarHBondContact OD1-OG 3.35Å; D125-S127 PolarHBondContact OD2-OG 3.13Å
128	S	85.3	Confident	93.4	Very high	46 Å²	46	67.9 Å²	67.9	32%	0.322	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-12.1	-178	67.6	0	0	0	0	114.1	D125 Q130	D125-S128 WeakPolarHBondContact CB-OG 3.45Å; D125-S128 VanDerWaalsContact CG-OG 3.29Å; D125-S128 VanDerWaalsContact OD2-CB 3.28Å; D125-S128 WeakPolarHBondContact OD2-CB 3.5Å; D125-S128 PolarHBondContact OD2-N 3.43Å; D125-S128 PolarHBondContact OD2-OG 3.43Å; S128-Q130 PolarHBondContact O-N 3.38Å; S128-Q130 VanDerWaalsContact O-N 3.14Å; S128-Q130 WeakPolarHBondContact OG-CB 3.41Å; S128-Q130 PolarHBondContact OG-N 2.81Å
129	G	86.7	Confident	93.3	Very high	22 Å²	22	61 Å²	61	23%	0.227	32%	0.321	C	S	.	.			trans	67	4.2	-170.4	0	0	0	0	0	114.1	R124 D125	R124-G129 WeakPolarHBondContact CG-O 3.33Å; R124-G129 PolarHBondContact NE-O 3.23Å; D125-G129 WeakPolarHBondContact O-CA 3.34Å; D125-G129 PolarHBondContact O-N 2.68Å
130	Q	88.9	Confident	93.2	Very high	9 Å²	9	58.6 Å²	58.6	4%	0.042	32%	0.318	C	S	.	.			trans	-66.4	132.9	-175.5	-169.2	172.6	27	0	0	110.8	R124 D125 S128 D190 K195 A212 F213 T215	R124-Q130 WeakPolarHBondContact CA-O 3.43Å; D125-Q130 PolarHBondContact N-O 2.88Å; S128-Q130 PolarHBondContact O-N 3.38Å; S128-Q130 VanDerWaalsContact O-N 3.14Å; S128-Q130 WeakPolarHBondContact OG-CB 3.41Å; S128-Q130 PolarHBondContact OG-N 2.81Å; Q130-D190 PolarHBondContact NE2-OD2 3.28Å; Q130-D190 VanDerWaalsContact NE2-OD2 3.14Å; Q130-K195 VanDerWaalsContact OE1-CE 3.26Å; Q130-A212 HydrophobicContact CG-CB 4.06Å; Q130-F213 WeakPolarHBondContact CG-O 3.48Å; Q130-F213 PolarHBondContact NE2-O 3.35Å; Q130-T215 WeakPolarHBondContact CG-OG1 3.47Å
131	Q	93.2	Very high	93.1	Very high	101 Å²	101	61.8 Å²	61.8	47%	0.472	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.7	177.8	-66.9	179	-22.9	0	0	110.6	F213	Q131-F213 HydrophobicContact CB-CD2 4.33Å; Q131-F213 PolarHBondContact O-N 2.9Å
132	S	94.2	Very high	92.9	Very high	13 Å²	13	60.1 Å²	60.1	9%	0.091	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	159.1	176	56.6	0	0	0	0	111.9	Q123 F211	Q123-S132 WeakPolarHBondContact CB-OG 3.43Å; Q123-S132 PolarHBondContact N-O 3.19Å; Q123-S132 PolarHBondContact O-N 3.13Å; S132-F211 CarbonylContact C-O 3.56Å; S132-F211 VanDerWaalsContact CA-O 3.22Å; S132-F211 WeakPolarHBondContact CA-O 3.39Å; S132-F211 WeakPolarHBondContact CB-O 3.49Å
133	L	96.3	Very high	92.7	Very high	13 Å²	13	55.1 Å²	55.1	7%	0.068	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.2	174.7	-63.4	176	0	0	0	108.8	K122 F135 I184 Q210 F211 F213	K122-L133 HydrophobicContact CB-CD2 4.26Å; K122-L133 HydrophobicContact CG-CD2 3.64Å; L133-F135 HydrophobicContact CB-CD2 4.3Å; L133-F135 HydrophobicContact CB-CE2 3.63Å; L133-F135 HydrophobicContact CB-CZ 4.4Å; L133-F135 HydrophobicContact CD1-CE2 4.14Å; L133-F135 HydrophobicContact CD1-CZ 4.27Å; L133-F135 HydrophobicContact CG-CE2 4.5Å; L133-I184 HydrophobicContact CD1-CG2 3.98Å; L133-Q210 WeakPolarHBondContact O-CA 3.34Å; L133-F211 HydrophobicContact CB-CE1 4.15Å; L133-F211 HydrophobicContact CB-CZ 4.11Å; L133-F211 HydrophobicContact CD1-CE2 4.29Å; L133-F211 HydrophobicContact CD1-CZ 3.8Å; L133-F211 HydrophobicContact CG-CZ 4.41Å; L133-F211 PolarHBondContact N-O 3.37Å; L133-F211 PolarHBondContact O-N 3.44Å; L133-F211 VanDerWaalsContact O-N 3.09Å; L133-F213 HydrophobicContact CD1-CE2 3.79Å; L133-F213 HydrophobicContact CD1-CZ 3.78Å; L133-F213 HydrophobicContact CG-CE2 3.95Å; L133-F213 HydrophobicContact CG-CZ 4.41Å
134	L	96.5	Very high	92.5	Very high	31 Å²	31	60.6 Å²	60.6	16%	0.162	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	121.8	171	173	66	0	0	0	108.8	V120 T121 W197 F208 Q210	V120-L134 WeakPolarHBondContact CA-O 3.39Å; T121-L134 PolarHBondContact N-O 3.23Å; T121-L134 PolarHBondContact O-N 2.74Å; L134-W197 HydrophobicContact CD1-CH2 4.08Å; L134-W197 HydrophobicContact CD1-CZ2 4.27Å; L134-F208 HydrophobicContact CD1-CD1 4.47Å; L134-Q210 HydrophobicContact CB-CG 4.5Å; L134-Q210 HydrophobicContact CD1-CB 3.94Å; L134-Q210 HydrophobicContact CD1-CG 4.5Å
135	F	97.8	Very high	92.3	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.013	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.6	173.7	-68.2	-94.7	0	0	0	108.9	V120 L133 L170 F172 F182 I184 F208 L209 F211	V120-F135 HydrophobicContact CB-CD1 4.46Å; V120-F135 HydrophobicContact CB-CE1 4.34Å; V120-F135 HydrophobicContact CG1-CD1 4.15Å; V120-F135 HydrophobicContact CG1-CE1 3.74Å; V120-F135 HydrophobicContact CG1-CE2 4.48Å; V120-F135 HydrophobicContact CG1-CZ 3.94Å; V120-F135 HydrophobicContact CG2-CD1 3.66Å; V120-F135 HydrophobicContact CG2-CE1 3.61Å; L133-F135 HydrophobicContact CB-CD2 4.3Å; L133-F135 HydrophobicContact CB-CE2 3.63Å; L133-F135 HydrophobicContact CB-CZ 4.4Å; L133-F135 HydrophobicContact CD1-CE2 4.14Å; L133-F135 HydrophobicContact CD1-CZ 4.27Å; L133-F135 HydrophobicContact CG-CE2 4.5Å; F135-L170 HydrophobicContact CD2-CD2 3.95Å; F135-L170 HydrophobicContact CE2-CD2 3.71Å; F135-L170 HydrophobicContact CG-CD2 4.48Å; F135-L170 HydrophobicContact CZ-CD2 4.04Å; F135-F172 HydrophobicContact CB-CE1 4.49Å; F135-F172 HydrophobicContact CB-CE2 4.3Å; F135-F172 HydrophobicContact CB-CZ 3.7Å; F135-F172 AromaticContact CD1-CE2 3.95Å; F135-F172 HydrophobicContact CD1-CE2 3.95Å; F135-F172 HydrophobicContact CD1-CZ 4.17Å; F135-F172 HydrophobicContact CD2-CZ 4.35Å; F135-F172 HydrophobicContact CG-CE2 4.07Å; F135-F172 AromaticContact CG-CZ 3.81Å; F135-F172 HydrophobicContact CG-CZ 3.81Å; F135-F182 HydrophobicContact CD1-CD1 4.46Å; F135-F182 AromaticContact CD1-CD2 3.76Å; F135-F182 HydrophobicContact CD1-CD2 3.76Å; F135-F182 HydrophobicContact CD1-CE1 4.44Å; F135-F182 AromaticContact CD1-CE2 3.72Å; F135-F182 HydrophobicContact CD1-CE2 3.72Å; F135-F182 HydrophobicContact CD1-CG 4.12Å; F135-F182 HydrophobicContact CD1-CZ 4.08Å; F135-F182 HydrophobicContact CE1-CB 3.81Å; F135-F182 AromaticContact CE1-CD1 3.79Å; F135-F182 HydrophobicContact CE1-CD1 3.79Å; F135-F182 AromaticContact CE1-CD2 3.49Å; F135-F182 HydrophobicContact CE1-CD2 3.49Å; F135-F182 VanDerWaalsContact CE1-CD2 3.49Å; F135-F182 HydrophobicContact CE1-CE1 4.18Å; F135-F182 AromaticContact CE1-CE2 3.9Å; F135-F182 HydrophobicContact CE1-CE2 3.9Å; F135-F182 AromaticContact CE1-CG 3.41Å; F135-F182 HydrophobicContact CE1-CG 3.41Å; F135-F182 VanDerWaalsContact CE1-CG 3.41Å; F135-F182 HydrophobicContact CE1-CZ 4.22Å; F135-F182 HydrophobicContact CZ-CB 4.19Å; F135-F182 HydrophobicContact CZ-CD2 4.48Å; F135-F182 HydrophobicContact CZ-CG 4.28Å; F135-I184 HydrophobicContact CZ-CG2 4.36Å; F135-F208 VanDerWaalsContact O-CA 3.3Å; F135-F208 WeakPolarHBondContact O-CA 3.42Å; F135-L209 HydrophobicContact CD2-CD2 4.09Å; F135-L209 PolarHBondContact N-O 3.01Å; F135-L209 PolarHBondContact O-N 3.05Å; F135-F211 HydrophobicContact CD2-CE1 4.08Å; F135-F211 AromaticContact CE2-CE1 3.58Å; F135-F211 HydrophobicContact CE2-CE1 3.58Å; F135-F211 HydrophobicContact CE2-CZ 4.16Å
136	Q	97.5	Very high	92.5	Very high	42 Å²	42	55.9 Å²	55.9	20%	0.196	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.7	168	175	-174.2	-14.9	0	0	107.4	Y118 K119 D138 F207 F208	Y118-Q136 CarbonylContact C-O 3.56Å; Y118-Q136 VanDerWaalsContact CA-O 3.26Å; Y118-Q136 WeakPolarHBondContact CA-O 3.41Å; K119-Q136 HydrophobicContact CB-CB 4.32Å; K119-Q136 PolarHBondContact N-O 2.89Å; K119-Q136 PolarHBondContact O-N 2.92Å; Q136-D138 PolarHBondContact NE2-OD1 3.5Å; Q136-F207 CarbonylContact C-O 3.57Å; Q136-F207 WeakPolarHBondContact CA-O 3.29Å; Q136-F208 HydrophobicContact CB-CD1 4.03Å; Q136-F208 HydrophobicContact CB-CE1 3.87Å; Q136-F208 HydrophobicContact CG-CD1 4.16Å; Q136-F208 HydrophobicContact CG-CE1 3.59Å; Q136-F208 HydrophobicContact CG-CZ 4.03Å
137	I	97.7	Very high	92.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.9	-179.3	-55.6	165	0	0	0	108.3	P116 G117 Y139 F172 I180 Q206 F207	P116-I137 HydrophobicContact CB-CG2 3.86Å; P116-I137 HydrophobicContact CG-CG2 3.89Å; G117-I137 WeakPolarHBondContact O-CA 3.37Å; G117-I137 WeakPolarHBondContact O-CG2 3.4Å; I137-Y139 HydrophobicContact CB-CD2 4.43Å; I137-Y139 HydrophobicContact CB-CE2 3.96Å; I137-Y139 HydrophobicContact CG2-CD1 4.49Å; I137-Y139 HydrophobicContact CG2-CD2 3.88Å; I137-Y139 HydrophobicContact CG2-CE1 4.07Å; I137-Y139 HydrophobicContact CG2-CE2 3.36Å; I137-Y139 HydrophobicContact CG2-CG 4.43Å; I137-Y139 VanDerWaalsContact CG2-CZ 3.47Å; I137-F172 HydrophobicContact CD1-CB 3.52Å; I137-F172 HydrophobicContact CD1-CD1 3.17Å; I137-F172 HydrophobicContact CD1-CD2 3.47Å; I137-F172 VanDerWaalsContact CD1-CD2 3.47Å; I137-F172 HydrophobicContact CD1-CE1 3.54Å; I137-F172 HydrophobicContact CD1-CE2 3.82Å; I137-F172 HydrophobicContact CD1-CG 3.1Å; I137-F172 HydrophobicContact CD1-CZ 3.84Å; I137-I180 HydrophobicContact CD1-CD1 4.06Å; I137-I180 HydrophobicContact CG1-CD1 4.3Å; I137-I180 HydrophobicContact CG2-CD1 4.25Å; I137-Q206 WeakPolarHBondContact O-CA 3.48Å; I137-F207 HydrophobicContact CB-CB 4.48Å; I137-F207 HydrophobicContact CD1-CD1 4.47Å; I137-F207 PolarHBondContact N-O 3.02Å; I137-F207 PolarHBondContact O-N 3.01Å
138	D	97.1	Very high	93.4	Very high	50 Å²	50	48.5 Å²	48.5	27%	0.267	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.4	-178.5	-58.4	-44.7	0	0	0	109.3	P116 G117 Q136 P140 Q206	P116-D138 WeakPolarHBondContact CB-O 3.43Å; G117-D138 PolarHBondContact O-N 3.46Å; Q136-D138 PolarHBondContact NE2-OD1 3.5Å; D138-P140 WeakPolarHBondContact O-CD 3.15Å; D138-Q206 VanDerWaalsContact OD1-CG 3.29Å; D138-Q206 WeakPolarHBondContact OD1-CG 3.45Å; D138-Q206 PolarHBondContact OD1-NE2 3.41Å
139	Y	96.7	Very high	93.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.305	C	S	.	.			trans	-121.9	58.7	-178.7	-72.7	-65.9	0	0	0	111.9	P116 I137 E141 V142 P148 A174 Y177 W200 K205 F207	P116-Y139 HydrophobicContact CB-CD1 3.61Å; P116-Y139 HydrophobicContact CB-CE1 3.42Å; P116-Y139 VanDerWaalsContact CB-CE1 3.42Å; P116-Y139 HydrophobicContact CG-CD1 4.26Å; P116-Y139 HydrophobicContact CG-CE1 3.54Å; I137-Y139 HydrophobicContact CB-CD2 4.43Å; I137-Y139 HydrophobicContact CB-CE2 3.96Å; I137-Y139 HydrophobicContact CG2-CD1 4.49Å; I137-Y139 HydrophobicContact CG2-CD2 3.88Å; I137-Y139 HydrophobicContact CG2-CE1 4.07Å; I137-Y139 HydrophobicContact CG2-CE2 3.36Å; I137-Y139 HydrophobicContact CG2-CG 4.43Å; I137-Y139 VanDerWaalsContact CG2-CZ 3.47Å; Y139-E141 PolarHBondContact O-N 3.26Å; Y139-E141 VanDerWaalsContact O-N 3.1Å; Y139-V142 WeakPolarHBondContact O-CG1 3.48Å; Y139-V142 PolarHBondContact O-N 2.95Å; Y139-V142 VanDerWaalsContact O-N 3.16Å; Y139-P148 HydrophobicContact CD2-CB 4.19Å; Y139-P148 HydrophobicContact CD2-CG 3.71Å; Y139-P148 HydrophobicContact CE2-CB 3.8Å; Y139-P148 HydrophobicContact CE2-CG 3.86Å; Y139-A174 HydrophobicContact CD1-CB 4.02Å; Y139-A174 HydrophobicContact CD2-CB 4.37Å; Y139-A174 HydrophobicContact CE1-CB 3.71Å; Y139-A174 HydrophobicContact CE2-CB 4.11Å; Y139-A174 HydrophobicContact CG-CB 4.32Å; Y139-Y177 AromaticContact CD1-CD2 3.38Å; Y139-Y177 HydrophobicContact CD1-CD2 3.38Å; Y139-Y177 AromaticContact CD1-CE2 3.74Å; Y139-Y177 HydrophobicContact CD1-CE2 3.74Å; Y139-Y177 AromaticContact CD1-CG 3.81Å; Y139-Y177 HydrophobicContact CD1-CG 3.81Å; Y139-Y177 AromaticContact CE1-CD2 3.96Å; Y139-Y177 HydrophobicContact CE1-CD2 3.96Å; Y139-Y177 AromaticContact CE1-CG 3.98Å; Y139-Y177 HydrophobicContact CE1-CG 3.98Å; Y139-Y177 HydrophobicContact CG-CD2 4.44Å; Y139-W200 HydrophobicContact CD2-CZ3 4.18Å; Y139-K205 PolarHBondContact N-O 3.47Å; Y139-K205 WeakPolarHBondContact O-CB 3.27Å; Y139-F207 HydrophobicContact CD2-CB 4.19Å; Y139-F207 HydrophobicContact CE2-CB 4.16Å
140	P	95.3	Very high	94.3	Very high	74 Å²	74	57.5 Å²	57.5	48%	0.481	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.7	-172.2	22.8	-33.5	0	0	0	114.3	D138 Y177 K205	D138-P140 WeakPolarHBondContact O-CD 3.15Å; P140-Y177 VanDerWaalsContact CD-OH 3.27Å; P140-Y177 WeakPolarHBondContact CD-OH 3.45Å; P140-Y177 WeakPolarHBondContact CG-OH 3.44Å; P140-K205 WeakPolarHBondContact O-CD 3.34Å; P140-K205 WeakPolarHBondContact O-CE 3.37Å; P140-K205 PolarHBondContact O-NZ 2.85Å
141	E	93.4	Very high	94.6	Very high	129 Å²	129	63.9 Å²	63.9	60%	0.603	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	28.4	-178.9	-62	178.1	-139.8	0	0	113.4	I113 Y139 P176 Y177	I113-E141 HydrophobicContact CD1-CB 3.73Å; Y139-E141 PolarHBondContact O-N 3.26Å; Y139-E141 VanDerWaalsContact O-N 3.1Å; E141-P176 WeakPolarHBondContact O-CD 3.4Å; E141-Y177 HydrophobicContact CB-CE2 4.35Å; E141-Y177 PolarHBondContact N-OH 2.71Å; E141-Y177 VanDerWaalsContact N-OH 3.11Å
142	V	93.2	Very high	94.6	Very high	16 Å²	16	61.8 Å²	61.8	10%	0.097	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-63.2	142.4	174.7	67.4	0	0	0	0	111.9	Y139 V146 A174 E175 W200 K205	Y139-V142 WeakPolarHBondContact O-CG1 3.48Å; Y139-V142 PolarHBondContact O-N 2.95Å; Y139-V142 VanDerWaalsContact O-N 3.16Å; V142-V146 HydrophobicContact CG2-CB 4.17Å; V142-V146 HydrophobicContact CG2-CG1 4.36Å; V142-A174 HydrophobicContact CG2-CB 4.3Å; V142-E175 WeakPolarHBondContact CG2-O 3.33Å; V142-W200 HydrophobicContact CG1-CH2 4.01Å; V142-W200 HydrophobicContact CG1-CZ2 3.9Å; V142-K205 HydrophobicContact CG1-CD 4.26Å; V142-K205 HydrophobicContact CG1-CG 4.39Å
143	V	91.1	Very high	94.6	Very high	72 Å²	72	62.4 Å²	62.4	44%	0.436	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-64.1	137.8	174.8	-179.6	0	0	0	0	110.2	G145 V146 E175 P176	V143-G145 PolarHBondContact O-N 2.9Å; V143-V146 HydrophobicContact CB-CB 4.5Å; V143-V146 HydrophobicContact CB-CG2 3.89Å; V143-V146 HydrophobicContact CG1-CG2 4.22Å; V143-V146 WeakPolarHBondContact O-CB 3.38Å; V143-V146 PolarHBondContact O-N 3.02Å; V143-V146 VanDerWaalsContact O-N 3.13Å; V143-E175 PolarHBondContact N-O 3.29Å; V143-P176 HydrophobicContact CG2-CG 4.49Å
144	E	89.1	Confident	94.4	Very high	191 Å²	191	63.8 Å²	63.8	89%	0.893	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	135.6	177.1	-64.3	-174.8	178.5	0	0	111.7	V146	E144-V146 VanDerWaalsContact C-N 3.26Å; E144-V146 PolarHBondContact O-N 3.1Å
145	G	89.3	Confident	94.1	Very high	85 Å²	85	62.4 Å²	62.4	88%	0.876	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-10.9	-177.4	0	0	0	0	0	115.3	V143	V143-G145 PolarHBondContact O-N 2.9Å
146	V	91.3	Very high	93.6	Very high	39 Å²	39	68.8 Å²	68.8	24%	0.236	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-82.6	125.4	174.1	179	0	0	0	0	110	V142 V143 E144	V142-V146 HydrophobicContact CG2-CB 4.17Å; V142-V146 HydrophobicContact CG2-CG1 4.36Å; V143-V146 HydrophobicContact CB-CB 4.5Å; V143-V146 HydrophobicContact CB-CG2 3.89Å; V143-V146 HydrophobicContact CG1-CG2 4.22Å; V143-V146 WeakPolarHBondContact O-CB 3.38Å; V143-V146 PolarHBondContact O-N 3.02Å; V143-V146 VanDerWaalsContact O-N 3.13Å; E144-V146 VanDerWaalsContact C-N 3.26Å; E144-V146 PolarHBondContact O-N 3.1Å
147	V	94.4	Very high	93.2	Very high	77 Å²	77	70.9 Å²	70.9	47%	0.467	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-101.2	125.9	172.3	-179.3	0	0	0	0	108.5	W200	V147-W200 HydrophobicContact CG1-CB 4.26Å; V147-W200 HydrophobicContact CG1-CG 4.19Å
148	P	96.2	Very high	92.5	Very high	5 Å²	5	72 Å²	72	3%	0.032	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-55.7	143.4	176.2	-26.2	35.2	0	0	0	112.3	Y139 A173 A174 W200 F207	Y139-P148 HydrophobicContact CD2-CB 4.19Å; Y139-P148 HydrophobicContact CD2-CG 3.71Å; Y139-P148 HydrophobicContact CE2-CB 3.8Å; Y139-P148 HydrophobicContact CE2-CG 3.86Å; P148-A173 WeakPolarHBondContact CA-O 3.32Å; P148-A174 HydrophobicContact CB-CB 3.98Å; P148-A174 HydrophobicContact CG-CB 3.93Å; P148-W200 HydrophobicContact CG-CD2 3.99Å; P148-W200 HydrophobicContact CG-CE3 3.66Å; P148-W200 HydrophobicContact CG-CH2 4.01Å; P148-W200 HydrophobicContact CG-CZ2 4.33Å; P148-W200 HydrophobicContact CG-CZ3 3.66Å; P148-F207 HydrophobicContact CB-CB 4.16Å; P148-F207 HydrophobicContact CB-CD1 4.24Å; P148-F207 HydrophobicContact CB-CD2 3.92Å; P148-F207 HydrophobicContact CB-CE2 4.39Å; P148-F207 HydrophobicContact CB-CG 3.84Å; P148-F207 HydrophobicContact CG-CB 4.21Å; P148-F207 HydrophobicContact CG-CD2 4.3Å; P148-F207 HydrophobicContact CG-CG 4.32Å
149	R	95.8	Very high	92	Very high	196 Å²	196	79.6 Å²	79.6	74%	0.74	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	153.7	-180	-57.7	-170.8	72.9	-170.3	4.1	110.4	F172 A173	R149-F172 CarbonylContact O-C 3.6Å; R149-F172 WeakPolarHBondContact O-CA 3.18Å; R149-A173 PolarHBondContact N-O 3.2Å; R149-A173 PolarHBondContact O-N 2.95Å
150	H	96	Very high	91.4	Very high	61 Å²	61	87.8 Å²	87.8	28%	0.282	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158	174.8	69.8	-81.8	0	0	0	110.9	L170 L171 F172 F196 F207 L209	H150-L170 HydrophobicContact CB-CD1 4.48Å; H150-L171 CarbonylContact C-O 3.54Å; H150-L171 WeakPolarHBondContact CA-O 3.45Å; H150-L171 WeakPolarHBondContact CB-O 3.46Å; H150-F172 HydrophobicContact CB-CD1 3.86Å; H150-F172 HydrophobicContact CB-CE1 4Å; H150-F196 AromaticContact NE2-CZ 3.66Å; H150-F207 HydrophobicContact CB-CE1 4.46Å; H150-L209 HydrophobicContact CB-CD1 3.74Å; H150-L209 WeakPolarHBondContact CD2-CD1 3.36Å
151	R	94.9	Very high	91	Very high	143 Å²	143	88.1 Å²	88.1	54%	0.54	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	133.9	173.5	179.5	174.1	177.1	-155	-7.9	110.7	E157 L171	R151-E157 IonicContact CZ-OE2 3.91Å; R151-E157 IonicContact NH1-OE2 3.38Å; R151-E157 IonicContact NH2-OE2 3.49Å; R151-E157 PolarHBondContact NH2-OE2 2.76Å; R151-L171 PolarHBondContact N-O 3.17Å; R151-L171 PolarHBondContact O-N 2.97Å
152	F	94	Very high	90.9	Very high	57 Å²	57	87.3 Å²	87.3	25%	0.25	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.6	163.2	-68.5	-96.1	0	0	0	108.8	L170 I184 V189 F196 F211	F152-L170 HydrophobicContact CD1-CD1 4.22Å; F152-L170 HydrophobicContact CD2-CD1 4.06Å; F152-L170 HydrophobicContact CE1-CD1 4.04Å; F152-L170 HydrophobicContact CE2-CD1 3.86Å; F152-L170 HydrophobicContact CG-CD1 4.23Å; F152-L170 HydrophobicContact CZ-CD1 3.86Å; F152-I184 HydrophobicContact CD1-CD1 3.8Å; F152-I184 HydrophobicContact CE1-CD1 3.51Å; F152-V189 HydrophobicContact CE1-CG2 3.9Å; F152-V189 HydrophobicContact CZ-CG2 4.07Å; F152-F196 AromaticContact CE2-CE2 3.84Å; F152-F196 HydrophobicContact CE2-CE2 3.84Å; F152-F196 HydrophobicContact CE2-CZ 4.25Å; F152-F196 HydrophobicContact CZ-CE2 4.19Å; F152-F211 HydrophobicContact CE1-CE1 4.42Å; F152-F211 HydrophobicContact CE1-CE2 4.39Å; F152-F211 HydrophobicContact CE1-CZ 4.19Å; F152-F211 HydrophobicContact CZ-CD1 4.18Å; F152-F211 HydrophobicContact CZ-CE1 4.17Å; F152-F211 HydrophobicContact CZ-CG 4.35Å; F152-F211 HydrophobicContact CZ-CZ 4.34Å
153	M	92.8	Very high	90.6	Very high	27 Å²	27	90 Å²	90	13%	0.133	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.1	-178.7	-176.8	177.5	60.8	0	0	108.8	E157 Q158 Y169 L171	M153-E157 HydrophobicContact CG-CB 3.55Å; M153-E157 HydrophobicContact CG-CG 4.33Å; M153-E157 HydrophobicContact SD-CB 3.93Å; M153-Q158 HydrophobicContact CE-CB 3.75Å; M153-Q158 HydrophobicContact SD-CB 4.47Å; M153-Y169 PolarHBondContact N-O 2.91Å; M153-Y169 PolarHBondContact O-N 3.07Å; M153-L171 HydrophobicContact CB-CD1 4.16Å; M153-L171 HydrophobicContact CB-CG 4.3Å; M153-L171 HydrophobicContact CE-CD1 3.74Å; M153-L171 HydrophobicContact CE-CD2 3.9Å; M153-L171 HydrophobicContact CE-CG 4.03Å; M153-L171 HydrophobicContact SD-CD1 3.77Å
154	S	92.2	Very high	90.7	Very high	41 Å²	41	88.5 Å²	88.5	29%	0.287	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	156.6	176.5	67.8	0	0	0	0	111.5	Y156 E157	S154-Y156 PolarHBondContact O-N 2.97Å; S154-Y156 VanDerWaalsContact O-N 3.11Å; S154-E157 PolarHBondContact N-OE1 3.34Å; S154-E157 VanDerWaalsContact N-OE1 3.13Å; S154-E157 PolarHBondContact O-N 2.82Å; S154-E157 WeakPolarHBondContact OG-CG 3.4Å; S154-E157 PolarHBondContact OG-OE1 3.4Å
155	A	90.8	Very high	90.7	Very high	3 Å²	3	86.6 Å²	86.6	3%	0.025	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.1	177	0	0	0	0	0	114.1	Q158 D164 Y169	A155-Q158 WeakPolarHBondContact O-CG 3.44Å; A155-Q158 PolarHBondContact O-NE2 3.15Å; A155-D164 WeakPolarHBondContact CB-O 3.21Å; A155-Y169 HydrophobicContact CB-CE2 4.11Å
156	Y	87.6	Confident	90.9	Very high	137 Å²	137	91 Å²	91	54%	0.537	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-22	177.5	-68.8	-70.2	0	0	0	114.3	S154 P163 K165	S154-Y156 PolarHBondContact O-N 2.97Å; S154-Y156 VanDerWaalsContact O-N 3.11Å; Y156-P163 HydrophobicContact CD1-CB 3.67Å; Y156-P163 HydrophobicContact CD1-CG 4.18Å; Y156-P163 HydrophobicContact CE1-CB 3.73Å; Y156-P163 HydrophobicContact CG-CB 4.41Å; Y156-K165 HydrophobicContact CE2-CG 3.88Å; Y156-K165 WeakPolarHBondContact OH-CD 3.44Å; Y156-K165 WeakPolarHBondContact OH-CE 3.46Å; Y156-K165 WeakPolarHBondContact OH-CG 3.45Å
157	E	87.7	Confident	90.9	Very high	86 Å²	86	93.3 Å²	93.3	40%	0.402	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-24.7	-178.1	-74.3	169.3	-107.1	0	0	112.6	R151 M153 S154	R151-E157 IonicContact CZ-OE2 3.91Å; R151-E157 IonicContact NH1-OE2 3.38Å; R151-E157 IonicContact NH2-OE2 3.49Å; R151-E157 PolarHBondContact NH2-OE2 2.76Å; M153-E157 HydrophobicContact CG-CB 3.55Å; M153-E157 HydrophobicContact CG-CG 4.33Å; M153-E157 HydrophobicContact SD-CB 3.93Å; S154-E157 PolarHBondContact N-OE1 3.34Å; S154-E157 VanDerWaalsContact N-OE1 3.13Å; S154-E157 PolarHBondContact O-N 2.82Å; S154-E157 WeakPolarHBondContact OG-CG 3.4Å; S154-E157 PolarHBondContact OG-OE1 3.4Å
158	Q	84.1	Confident	90.9	Very high	24 Å²	24	92.2 Å²	92.2	11%	0.112	42%	0.419	C	S	.	.			trans	-83.1	153.6	178.4	67.8	74.6	39.8	0	0	111.5	M153 A155 E161 Y169	M153-Q158 HydrophobicContact CE-CB 3.75Å; M153-Q158 HydrophobicContact SD-CB 4.47Å; A155-Q158 WeakPolarHBondContact O-CG 3.44Å; A155-Q158 PolarHBondContact O-NE2 3.15Å; Q158-E161 PolarHBondContact NE2-O 3.19Å; Q158-Y169 HydrophobicContact CG-CD2 4.12Å; Q158-Y169 HydrophobicContact CG-CE2 3.87Å
159	K	85.5	Confident	90.9	Very high	209 Å²	209	93.1 Å²	93.1	91%	0.909	42%	0.422	S	S	*	.	S	Bend	trans	-119.9	7.7	-175.7	-60.5	-178.5	179.7	-179.7	0	113.7
160	M	85.1	Confident	90.9	Very high	171 Å²	171	83.8 Å²	83.8	84%	0.842	39%	0.387	S	S	*	.	S	Bend	trans	-89.8	-48.6	-174.9	-174.3	-163.9	-75.3	0	0	111.6
161	E	87.2	Confident	90.9	Very high	81 Å²	81	82.7 Å²	82.7	38%	0.379	38%	0.383	S	S	.	.	S	Bend	trans	-108.6	159.8	-179.4	-63.8	-174.9	166.6	0	0	110.7	Q158 Y169 K183	Q158-E161 PolarHBondContact NE2-O 3.19Å; E161-Y169 PolarHBondContact OE2-OH 3.28Å; E161-K183 IonicContact OE2-NZ 3.17Å; E161-K183 PolarHBondContact OE2-NZ 3.33Å
162	P	90	Very high	91	Very high	113 Å²	113	75.9 Å²	75.9	73%	0.734	36%	0.357	S	S	*	.			trans	-58.1	135.2	165.7	-23.6	34.5	0	0	0	111.1	D164	P162-D164 PolarHBondContact O-N 3.44Å
163	P	88.9	Confident	91.1	Very high	73 Å²	73	74.9 Å²	74.9	47%	0.474	36%	0.359	S	S	.	.			trans	-62.5	121	-179.4	-24.1	33.9	0	0	0	112.9	Y156	Y156-P163 HydrophobicContact CD1-CB 3.67Å; Y156-P163 HydrophobicContact CD1-CG 4.18Å; Y156-P163 HydrophobicContact CE1-CB 3.73Å; Y156-P163 HydrophobicContact CG-CB 4.41Å
164	D	91.2	Very high	91.2	Very high	40 Å²	40	74 Å²	74	21%	0.214	36%	0.356	C	S	.	.			trans	-118	117.5	171.8	-176.7	-9.9	0	0	0	110.4	A155 P162 R166 W167	A155-D164 WeakPolarHBondContact CB-O 3.21Å; P162-D164 PolarHBondContact O-N 3.44Å; D164-R166 PolarHBondContact O-N 3.36Å; D164-R166 WeakPolarHBondContact OD1-CB 3.05Å; D164-R166 WeakPolarHBondContact OD1-CG 3.29Å; D164-R166 PolarHBondContact OD1-N 3.41Å; D164-R166 IonicContact OD1-NE 3.56Å; D164-R166 PolarHBondContact OD1-NE 3.15Å; D164-R166 IonicContact OD2-CZ 3.47Å; D164-R166 IonicContact OD2-NE 2.79Å; D164-R166 PolarHBondContact OD2-NE 3.42Å; D164-R166 VanDerWaalsContact OD2-NE 3.17Å; D164-R166 IonicContact OD2-NH2 3.43Å; D164-R166 PolarHBondContact OD2-NH2 3.49Å; D164-W167 PolarHBondContact O-N 2.89Å; D164-W167 VanDerWaalsContact OD2-CD1 3.26Å; D164-W167 PolarHBondContact OD2-NE1 2.91Å
165	K	91	Very high	91.2	Very high	150 Å²	150	74.9 Å²	74.9	65%	0.652	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.2	-178.9	-66.9	-174.1	179.8	-177.9	0	114.1	Y156 W167 S186	Y156-K165 HydrophobicContact CE2-CG 3.88Å; Y156-K165 WeakPolarHBondContact OH-CD 3.44Å; Y156-K165 WeakPolarHBondContact OH-CE 3.46Å; Y156-K165 WeakPolarHBondContact OH-CG 3.45Å; K165-W167 PolarHBondContact O-N 3.45Å; K165-S186 VanDerWaalsContact O-CB 3.24Å; K165-S186 WeakPolarHBondContact O-CB 3.38Å; K165-S186 PolarHBondContact O-OG 3.21Å
166	R	91.6	Very high	91.4	Very high	178 Å²	178	75.6 Å²	75.6	67%	0.672	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-14.2	-179.1	-63	177.4	-62.9	178	3.9	112.3	D164 S186	D164-R166 PolarHBondContact O-N 3.36Å; D164-R166 WeakPolarHBondContact OD1-CB 3.05Å; D164-R166 WeakPolarHBondContact OD1-CG 3.29Å; D164-R166 PolarHBondContact OD1-N 3.41Å; D164-R166 IonicContact OD1-NE 3.56Å; D164-R166 PolarHBondContact OD1-NE 3.15Å; D164-R166 IonicContact OD2-CZ 3.47Å; D164-R166 IonicContact OD2-NE 2.79Å; D164-R166 PolarHBondContact OD2-NE 3.42Å; D164-R166 VanDerWaalsContact OD2-NE 3.17Å; D164-R166 IonicContact OD2-NH2 3.43Å; D164-R166 PolarHBondContact OD2-NH2 3.49Å; R166-S186 WeakPolarHBondContact O-CB 3.4Å; R166-S186 PolarHBondContact O-N 3.32Å
167	W	93	Very high	91.8	Very high	88 Å²	88	69.9 Å²	69.9	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	151.4	-175.2	-54.6	102	0	0	0	111.8	D164 K165 K183 I184 P185	D164-W167 PolarHBondContact O-N 2.89Å; D164-W167 VanDerWaalsContact OD2-CD1 3.26Å; D164-W167 PolarHBondContact OD2-NE1 2.91Å; K165-W167 PolarHBondContact O-N 3.45Å; W167-K183 HydrophobicContact CB-CD 4.44Å; W167-K183 HydrophobicContact CB-CG 3.9Å; W167-K183 VanDerWaalsContact CD1-CE 3.44Å; W167-K183 HydrophobicContact CD2-CD 4.33Å; W167-K183 HydrophobicContact CD2-CG 4.06Å; W167-K183 HydrophobicContact CE3-CG 4Å; W167-K183 HydrophobicContact CG-CD 4.21Å; W167-K183 HydrophobicContact CG-CG 4.01Å; W167-I184 CarbonylContact C-O 3.51Å; W167-I184 WeakPolarHBondContact CA-O 3.47Å; W167-P185 HydrophobicContact CZ3-CG 4.02Å
168	Q	93.8	Very high	92.1	Very high	53 Å²	53	69.2 Å²	69.2	25%	0.248	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	163	166.7	-69.3	177.4	2.8	0	0	108.2	I184 S186	Q168-I184 HydrophobicContact CB-CG1 4.16Å; Q168-I184 PolarHBondContact N-O 3.14Å; Q168-I184 WeakPolarHBondContact O-CG1 3.47Å; Q168-I184 PolarHBondContact O-N 2.62Å; Q168-I184 VanDerWaalsContact O-O 3.12Å; Q168-S186 PolarHBondContact NE2-OG 3.43Å
169	Y	94.8	Very high	92.7	Very high	24 Å²	24	71.8 Å²	71.8	9%	0.094	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.2	178.6	-64.3	-93.1	0	0	0	109.4	M153 A155 Q158 E161 F182 K183	M153-Y169 PolarHBondContact N-O 2.91Å; M153-Y169 PolarHBondContact O-N 3.07Å; A155-Y169 HydrophobicContact CB-CE2 4.11Å; Q158-Y169 HydrophobicContact CG-CD2 4.12Å; Q158-Y169 HydrophobicContact CG-CE2 3.87Å; E161-Y169 PolarHBondContact OE2-OH 3.28Å; Y169-F182 CarbonylContact C-O 3.55Å; Y169-F182 WeakPolarHBondContact CA-O 3.47Å; Y169-K183 HydrophobicContact CD1-CB 4.18Å; Y169-K183 HydrophobicContact CD1-CG 4.49Å; Y169-K183 HydrophobicContact CE1-CB 3.88Å; Y169-K183 HydrophobicContact CE1-CD 4.18Å; Y169-K183 HydrophobicContact CE1-CG 3.91Å
170	L	95.9	Very high	93.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.2	170.7	176.4	61.4	0	0	0	108.9	F135 H150 F152 F172 G181 F182 I184 L209 F211	F135-L170 HydrophobicContact CD2-CD2 3.95Å; F135-L170 HydrophobicContact CE2-CD2 3.71Å; F135-L170 HydrophobicContact CG-CD2 4.48Å; F135-L170 HydrophobicContact CZ-CD2 4.04Å; H150-L170 HydrophobicContact CB-CD1 4.48Å; F152-L170 HydrophobicContact CD1-CD1 4.22Å; F152-L170 HydrophobicContact CD2-CD1 4.06Å; F152-L170 HydrophobicContact CE1-CD1 4.04Å; F152-L170 HydrophobicContact CE2-CD1 3.86Å; F152-L170 HydrophobicContact CG-CD1 4.23Å; F152-L170 HydrophobicContact CZ-CD1 3.86Å; L170-F172 HydrophobicContact CD2-CE2 3.69Å; L170-F172 HydrophobicContact CD2-CZ 3.73Å; L170-F172 HydrophobicContact CG-CD2 4.34Å; L170-F172 HydrophobicContact CG-CE2 3.62Å; L170-F172 HydrophobicContact CG-CZ 3.97Å; L170-G181 CarbonylContact O-C 3.44Å; L170-G181 WeakPolarHBondContact O-CA 3.49Å; L170-F182 PolarHBondContact N-O 3.22Å; L170-F182 PolarHBondContact O-N 3.07Å; L170-I184 HydrophobicContact CB-CD1 4.06Å; L170-L209 HydrophobicContact CD2-CD2 3.79Å; L170-F211 HydrophobicContact CD2-CE1 3.62Å; L170-F211 HydrophobicContact CD2-CZ 4.3Å
171	L	96.6	Very high	93.6	Very high	38 Å²	38	56.5 Å²	56.5	20%	0.199	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	145.9	-179.4	-59.8	-176.1	0	0	0	111.4	H150 R151 M153 T179 I180	H150-L171 CarbonylContact C-O 3.54Å; H150-L171 WeakPolarHBondContact CA-O 3.45Å; H150-L171 WeakPolarHBondContact CB-O 3.46Å; R151-L171 PolarHBondContact N-O 3.17Å; R151-L171 PolarHBondContact O-N 2.97Å; M153-L171 HydrophobicContact CB-CD1 4.16Å; M153-L171 HydrophobicContact CB-CG 4.3Å; M153-L171 HydrophobicContact CE-CD1 3.74Å; M153-L171 HydrophobicContact CE-CD2 3.9Å; M153-L171 HydrophobicContact CE-CG 4.03Å; M153-L171 HydrophobicContact SD-CD1 3.77Å; L171-T179 HydrophobicContact CB-CG2 4.29Å; L171-T179 HydrophobicContact CD2-CG2 4.48Å; L171-I180 CarbonylContact C-O 3.59Å; L171-I180 VanDerWaalsContact CA-O 3.31Å; L171-I180 WeakPolarHBondContact CA-O 3.19Å
172	F	97.6	Very high	94.1	Very high	1 Å²	1	54 Å²	54	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.3	169	-62.2	-95.1	0	0	0	110.3	F135 I137 R149 H150 L170 T179 I180 F182 F207 L209	F135-F172 HydrophobicContact CB-CE1 4.49Å; F135-F172 HydrophobicContact CB-CE2 4.3Å; F135-F172 HydrophobicContact CB-CZ 3.7Å; F135-F172 AromaticContact CD1-CE2 3.95Å; F135-F172 HydrophobicContact CD1-CE2 3.95Å; F135-F172 HydrophobicContact CD1-CZ 4.17Å; F135-F172 HydrophobicContact CD2-CZ 4.35Å; F135-F172 HydrophobicContact CG-CE2 4.07Å; F135-F172 AromaticContact CG-CZ 3.81Å; F135-F172 HydrophobicContact CG-CZ 3.81Å; I137-F172 HydrophobicContact CD1-CB 3.52Å; I137-F172 HydrophobicContact CD1-CD1 3.17Å; I137-F172 HydrophobicContact CD1-CD2 3.47Å; I137-F172 VanDerWaalsContact CD1-CD2 3.47Å; I137-F172 HydrophobicContact CD1-CE1 3.54Å; I137-F172 HydrophobicContact CD1-CE2 3.82Å; I137-F172 HydrophobicContact CD1-CG 3.1Å; I137-F172 HydrophobicContact CD1-CZ 3.84Å; R149-F172 CarbonylContact O-C 3.6Å; R149-F172 WeakPolarHBondContact O-CA 3.18Å; H150-F172 HydrophobicContact CB-CD1 3.86Å; H150-F172 HydrophobicContact CB-CE1 4Å; L170-F172 HydrophobicContact CD2-CE2 3.69Å; L170-F172 HydrophobicContact CD2-CZ 3.73Å; L170-F172 HydrophobicContact CG-CD2 4.34Å; L170-F172 HydrophobicContact CG-CE2 3.62Å; L170-F172 HydrophobicContact CG-CZ 3.97Å; F172-T179 WeakPolarHBondContact O-CA 3.37Å; F172-T179 WeakPolarHBondContact O-CG2 3.22Å; F172-I180 HydrophobicContact CB-CD1 4.47Å; F172-I180 HydrophobicContact CB-CG1 3.94Å; F172-I180 PolarHBondContact N-O 3.17Å; F172-I180 PolarHBondContact O-N 2.85Å; F172-F182 AromaticContact CD2-CD2 3.8Å; F172-F182 HydrophobicContact CD2-CD2 3.8Å; F172-F182 AromaticContact CD2-CE2 3.69Å; F172-F182 HydrophobicContact CD2-CE2 3.69Å; F172-F182 AromaticContact CE2-CD2 3.62Å; F172-F182 HydrophobicContact CE2-CD2 3.62Å; F172-F182 AromaticContact CE2-CE2 3.69Å; F172-F182 HydrophobicContact CE2-CE2 3.69Å; F172-F207 AromaticContact CD1-CD1 3.76Å; F172-F207 HydrophobicContact CD1-CD1 3.76Å; F172-F207 AromaticContact CD1-CE1 3.65Å; F172-F207 HydrophobicContact CD1-CE1 3.65Å; F172-F207 AromaticContact CE1-CD1 3.88Å; F172-F207 HydrophobicContact CE1-CD1 3.88Å; F172-F207 AromaticContact CE1-CE1 3.65Å; F172-F207 HydrophobicContact CE1-CE1 3.65Å; F172-L209 HydrophobicContact CE1-CB 3.8Å; F172-L209 HydrophobicContact CE1-CD1 3.95Å; F172-L209 HydrophobicContact CE1-CD2 4.44Å; F172-L209 HydrophobicContact CE1-CG 4.3Å; F172-L209 HydrophobicContact CZ-CB 4.08Å; F172-L209 HydrophobicContact CZ-CD1 4.29Å; F172-L209 HydrophobicContact CZ-CD2 4.05Å; F172-L209 HydrophobicContact CZ-CG 4.39Å
173	A	95.7	Very high	94.3	Very high	36 Å²	36	53 Å²	53	30%	0.298	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	132.1	-176.8	0	0	0	0	0	111.4	P148 R149 T179	P148-A173 WeakPolarHBondContact CA-O 3.32Å; R149-A173 PolarHBondContact N-O 3.2Å; R149-A173 PolarHBondContact O-N 2.95Å; A173-T179 HydrophobicContact CB-CG2 4.23Å
174	A	94.9	Very high	94.5	Very high	7 Å²	7	49.8 Å²	49.8	6%	0.058	24%	0.244	C	C	.	.			trans	-151.1	136.1	169.7	0	0	0	0	0	108.6	Y139 V142 P148 Y177	Y139-A174 HydrophobicContact CD1-CB 4.02Å; Y139-A174 HydrophobicContact CD2-CB 4.37Å; Y139-A174 HydrophobicContact CE1-CB 3.71Å; Y139-A174 HydrophobicContact CE2-CB 4.11Å; Y139-A174 HydrophobicContact CG-CB 4.32Å; V142-A174 HydrophobicContact CG2-CB 4.3Å; P148-A174 HydrophobicContact CB-CB 3.98Å; P148-A174 HydrophobicContact CG-CB 3.93Å; A174-Y177 WeakPolarHBondContact O-CA 3.39Å; A174-Y177 WeakPolarHBondContact O-CB 3.2Å; A174-Y177 PolarHBondContact O-N 2.74Å
175	E	92.7	Very high	94.6	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.28	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	136.2	175.8	-48.2	-173.6	165.4	0	0	109.3	F110 V142 V143	F110-E175 HydrophobicContact CD1-CB 4.41Å; F110-E175 HydrophobicContact CD1-CG 4.15Å; F110-E175 HydrophobicContact CD2-CB 4.48Å; F110-E175 HydrophobicContact CE1-CB 4.01Å; F110-E175 HydrophobicContact CE1-CG 3.42Å; F110-E175 VanDerWaalsContact CE1-CG 3.42Å; F110-E175 WeakPolarHBondContact CE1-OE1 3.21Å; F110-E175 HydrophobicContact CE2-CB 4.06Å; F110-E175 HydrophobicContact CE2-CG 4.23Å; F110-E175 HydrophobicContact CZ-CB 3.82Å; F110-E175 HydrophobicContact CZ-CG 3.47Å; F110-E175 VanDerWaalsContact CZ-CG 3.47Å; V142-E175 WeakPolarHBondContact CG2-O 3.33Å; V143-E175 PolarHBondContact N-O 3.29Å
176	P	94.5	Very high	94.7	Very high	18 Å²	18	45.5 Å²	45.5	12%	0.117	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	cis	-100.4	17.8	9.6	36.4	-27.8	0	0	0	113.9	F110 K112 I113 E141 V143	F110-P176 HydrophobicContact CD2-CB 3.95Å; F110-P176 HydrophobicContact CE2-CB 4.3Å; K112-P176 WeakPolarHBondContact CA-O 3.31Å; I113-P176 HydrophobicContact CD1-CG 3.77Å; I113-P176 HydrophobicContact CG1-CB 4.48Å; I113-P176 HydrophobicContact CG1-CG 3.92Å; I113-P176 HydrophobicContact CG2-CB 4.25Å; I113-P176 HydrophobicContact CG2-CG 3.96Å; I113-P176 PolarHBondContact N-O 2.84Å; I113-P176 VanDerWaalsContact N-O 3.13Å; E141-P176 WeakPolarHBondContact O-CD 3.4Å; V143-P176 HydrophobicContact CG2-CG 4.49Å
177	Y	95.8	Very high	94.6	Very high	18 Å²	18	39.8 Å²	39.8	7%	0.071	21%	0.214	C	C	.	.	S	Bend	trans	-74.6	158.3	-177.9	-72	-87.5	0	0	0	112.8	I113 G114 P116 Y139 P140 E141 A174	I113-Y177 HydrophobicContact CD1-CD1 4.07Å; I113-Y177 HydrophobicContact CD1-CD2 4.22Å; I113-Y177 HydrophobicContact CD1-CE1 3.67Å; I113-Y177 HydrophobicContact CD1-CE2 3.86Å; I113-Y177 HydrophobicContact CD1-CG 4.35Å; I113-Y177 HydrophobicContact CG1-CD1 4.02Å; I113-Y177 HydrophobicContact CG1-CE1 4.06Å; I113-Y177 HydrophobicContact CG1-CG 4.31Å; G114-Y177 WeakPolarHBondContact O-CA 3.47Å; G114-Y177 WeakPolarHBondContact O-CD1 3.35Å; P116-Y177 HydrophobicContact CB-CD1 3.81Å; P116-Y177 HydrophobicContact CB-CE1 4.17Å; P116-Y177 HydrophobicContact CB-CG 4.13Å; P116-Y177 HydrophobicContact CG-CD1 4.46Å; Y139-Y177 AromaticContact CD1-CD2 3.38Å; Y139-Y177 HydrophobicContact CD1-CD2 3.38Å; Y139-Y177 AromaticContact CD1-CE2 3.74Å; Y139-Y177 HydrophobicContact CD1-CE2 3.74Å; Y139-Y177 AromaticContact CD1-CG 3.81Å; Y139-Y177 HydrophobicContact CD1-CG 3.81Å; Y139-Y177 AromaticContact CE1-CD2 3.96Å; Y139-Y177 HydrophobicContact CE1-CD2 3.96Å; Y139-Y177 AromaticContact CE1-CG 3.98Å; Y139-Y177 HydrophobicContact CE1-CG 3.98Å; Y139-Y177 HydrophobicContact CG-CD2 4.44Å; P140-Y177 VanDerWaalsContact CD-OH 3.27Å; P140-Y177 WeakPolarHBondContact CD-OH 3.45Å; P140-Y177 WeakPolarHBondContact CG-OH 3.44Å; E141-Y177 HydrophobicContact CB-CE2 4.35Å; E141-Y177 PolarHBondContact N-OH 2.71Å; E141-Y177 VanDerWaalsContact N-OH 3.11Å; A174-Y177 WeakPolarHBondContact O-CA 3.39Å; A174-Y177 WeakPolarHBondContact O-CB 3.2Å; A174-Y177 PolarHBondContact O-N 2.74Å
178	E	94.9	Very high	94.5	Very high	71 Å²	71	41 Å²	41	33%	0.332	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-65.7	142.9	165.9	-65.6	-167.9	155.1	0	0	111	K112 G114 R115 I180	K112-E178 HydrophobicContact CB-CG 4.25Å; K112-E178 HydrophobicContact CD-CG 3.93Å; G114-E178 PolarHBondContact O-N 2.96Å; R115-E178 HydrophobicContact CG-CB 4.21Å; R115-E178 VanDerWaalsContact CG-OE2 3.29Å; R115-E178 WeakPolarHBondContact CG-OE2 3.48Å; R115-E178 IonicContact NE-OE2 3.94Å; R115-E178 PolarHBondContact NE-OE2 3.13Å; E178-I180 PolarHBondContact O-N 3.32Å
179	T	95.3	Very high	94.3	Very high	79 Å²	79	39.9 Å²	39.9	49%	0.485	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-64.6	124.7	169.4	-55.2	0	0	0	0	109.3	L171 F172 A173	L171-T179 HydrophobicContact CB-CG2 4.29Å; L171-T179 HydrophobicContact CD2-CG2 4.48Å; F172-T179 WeakPolarHBondContact O-CA 3.37Å; F172-T179 WeakPolarHBondContact O-CG2 3.22Å; A173-T179 HydrophobicContact CB-CG2 4.23Å
180	I	95.9	Very high	94.1	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.072	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	150.9	173	59	168	0	0	0	110.1	R115 P116 Y118 I137 L171 F172 E178 F182	R115-I180 HydrophobicContact CB-CG2 4.38Å; R115-I180 HydrophobicContact CG-CG2 4.49Å; P116-I180 HydrophobicContact CG-CD1 3.92Å; P116-I180 HydrophobicContact CG-CG1 4.25Å; P116-I180 HydrophobicContact CG-CG2 4.01Å; Y118-I180 HydrophobicContact CD1-CD1 4.32Å; I137-I180 HydrophobicContact CD1-CD1 4.06Å; I137-I180 HydrophobicContact CG1-CD1 4.3Å; I137-I180 HydrophobicContact CG2-CD1 4.25Å; L171-I180 CarbonylContact C-O 3.59Å; L171-I180 VanDerWaalsContact CA-O 3.31Å; L171-I180 WeakPolarHBondContact CA-O 3.19Å; F172-I180 HydrophobicContact CB-CD1 4.47Å; F172-I180 HydrophobicContact CB-CG1 3.94Å; F172-I180 PolarHBondContact N-O 3.17Å; F172-I180 PolarHBondContact O-N 2.85Å; E178-I180 PolarHBondContact O-N 3.32Å; I180-F182 HydrophobicContact CD1-CE2 3.66Å; I180-F182 HydrophobicContact CD1-CZ 3.8Å; I180-F182 HydrophobicContact CG1-CE2 4.24Å
181	G	95.3	Very high	93.8	Very high	44 Å²	44	48.6 Å²	48.6	45%	0.454	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.1	179.8	0	0	0	0	0	111.6	L170	L170-G181 CarbonylContact O-C 3.44Å; L170-G181 WeakPolarHBondContact O-CA 3.49Å
182	F	95.8	Very high	93.4	Very high	29 Å²	29	49 Å²	49	13%	0.127	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.5	176.9	-61.8	-84.4	0	0	0	110.5	Y118 V120 F135 Y169 L170 F172 I180 I184	Y118-F182 HydrophobicContact CD1-CZ 4.21Å; Y118-F182 AromaticContact CD2-CE1 3.6Å; Y118-F182 HydrophobicContact CD2-CE1 3.6Å; Y118-F182 AromaticContact CD2-CZ 3.68Å; Y118-F182 HydrophobicContact CD2-CZ 3.68Å; Y118-F182 AromaticContact CE2-CE1 3.68Å; Y118-F182 HydrophobicContact CE2-CE1 3.68Å; Y118-F182 HydrophobicContact CE2-CZ 4.18Å; Y118-F182 HydrophobicContact CG-CE1 4.07Å; Y118-F182 AromaticContact CG-CZ 3.7Å; Y118-F182 HydrophobicContact CG-CZ 3.7Å; V120-F182 HydrophobicContact CG2-CD1 4.22Å; V120-F182 HydrophobicContact CG2-CE1 3.77Å; V120-F182 HydrophobicContact CG2-CZ 4.22Å; F135-F182 HydrophobicContact CD1-CD1 4.46Å; F135-F182 AromaticContact CD1-CD2 3.76Å; F135-F182 HydrophobicContact CD1-CD2 3.76Å; F135-F182 HydrophobicContact CD1-CE1 4.44Å; F135-F182 AromaticContact CD1-CE2 3.72Å; F135-F182 HydrophobicContact CD1-CE2 3.72Å; F135-F182 HydrophobicContact CD1-CG 4.12Å; F135-F182 HydrophobicContact CD1-CZ 4.08Å; F135-F182 HydrophobicContact CE1-CB 3.81Å; F135-F182 AromaticContact CE1-CD1 3.79Å; F135-F182 HydrophobicContact CE1-CD1 3.79Å; F135-F182 AromaticContact CE1-CD2 3.49Å; F135-F182 HydrophobicContact CE1-CD2 3.49Å; F135-F182 VanDerWaalsContact CE1-CD2 3.49Å; F135-F182 HydrophobicContact CE1-CE1 4.18Å; F135-F182 AromaticContact CE1-CE2 3.9Å; F135-F182 HydrophobicContact CE1-CE2 3.9Å; F135-F182 AromaticContact CE1-CG 3.41Å; F135-F182 HydrophobicContact CE1-CG 3.41Å; F135-F182 VanDerWaalsContact CE1-CG 3.41Å; F135-F182 HydrophobicContact CE1-CZ 4.22Å; F135-F182 HydrophobicContact CZ-CB 4.19Å; F135-F182 HydrophobicContact CZ-CD2 4.48Å; F135-F182 HydrophobicContact CZ-CG 4.28Å; Y169-F182 CarbonylContact C-O 3.55Å; Y169-F182 WeakPolarHBondContact CA-O 3.47Å; L170-F182 PolarHBondContact N-O 3.22Å; L170-F182 PolarHBondContact O-N 3.07Å; F172-F182 AromaticContact CD2-CD2 3.8Å; F172-F182 HydrophobicContact CD2-CD2 3.8Å; F172-F182 AromaticContact CD2-CE2 3.69Å; F172-F182 HydrophobicContact CD2-CE2 3.69Å; F172-F182 AromaticContact CE2-CD2 3.62Å; F172-F182 HydrophobicContact CE2-CD2 3.62Å; F172-F182 AromaticContact CE2-CE2 3.69Å; F172-F182 HydrophobicContact CE2-CE2 3.69Å; I180-F182 HydrophobicContact CD1-CE2 3.66Å; I180-F182 HydrophobicContact CD1-CZ 3.8Å; I180-F182 HydrophobicContact CG1-CE2 4.24Å; F182-I184 PolarHBondContact O-N 3.38Å
183	K	94.6	Very high	92.8	Very high	93 Å²	93	58.3 Å²	58.3	40%	0.404	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	118.7	173.6	-166.3	172.1	-169.3	159.3	0	109.3	E161 W167 Y169	E161-K183 IonicContact OE2-NZ 3.17Å; E161-K183 PolarHBondContact OE2-NZ 3.33Å; W167-K183 HydrophobicContact CB-CD 4.44Å; W167-K183 HydrophobicContact CB-CG 3.9Å; W167-K183 VanDerWaalsContact CD1-CE 3.44Å; W167-K183 HydrophobicContact CD2-CD 4.33Å; W167-K183 HydrophobicContact CD2-CG 4.06Å; W167-K183 HydrophobicContact CE3-CG 4Å; W167-K183 HydrophobicContact CG-CD 4.21Å; W167-K183 HydrophobicContact CG-CG 4.01Å; Y169-K183 HydrophobicContact CD1-CB 4.18Å; Y169-K183 HydrophobicContact CD1-CG 4.49Å; Y169-K183 HydrophobicContact CE1-CB 3.88Å; Y169-K183 HydrophobicContact CE1-CD 4.18Å; Y169-K183 HydrophobicContact CE1-CG 3.91Å
184	I	94	Very high	92.3	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.7	-178.2	58	167	0	0	0	110.3	L133 F135 F152 W167 Q168 L170 F182 F211	L133-I184 HydrophobicContact CD1-CG2 3.98Å; F135-I184 HydrophobicContact CZ-CG2 4.36Å; F152-I184 HydrophobicContact CD1-CD1 3.8Å; F152-I184 HydrophobicContact CE1-CD1 3.51Å; W167-I184 CarbonylContact C-O 3.51Å; W167-I184 WeakPolarHBondContact CA-O 3.47Å; Q168-I184 HydrophobicContact CB-CG1 4.16Å; Q168-I184 PolarHBondContact N-O 3.14Å; Q168-I184 WeakPolarHBondContact O-CG1 3.47Å; Q168-I184 PolarHBondContact O-N 2.62Å; Q168-I184 VanDerWaalsContact O-O 3.12Å; L170-I184 HydrophobicContact CB-CD1 4.06Å; F182-I184 PolarHBondContact O-N 3.38Å; I184-F211 HydrophobicContact CD1-CE2 4.38Å; I184-F211 HydrophobicContact CD1-CZ 3.9Å
185	P	93.7	Very high	92.1	Very high	49 Å²	49	62.1 Å²	62.1	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	141	174.8	-24.3	34.2	0	0	0	111.3	W167 R187 F213	W167-P185 HydrophobicContact CZ3-CG 4.02Å; P185-R187 HydrophobicContact CB-CG 4.13Å; P185-R187 PolarHBondContact O-N 3.47Å; P185-F213 HydrophobicContact CG-CZ 4.49Å
186	S	91.4	Very high	92.1	Very high	51 Å²	51	62 Å²	62	36%	0.357	33%	0.333	S	S	.	.			trans	-74.4	38.7	177.3	-173.4	0	0	0	0	113.1	K165 R166 Q168	K165-S186 VanDerWaalsContact O-CB 3.24Å; K165-S186 WeakPolarHBondContact O-CB 3.38Å; K165-S186 PolarHBondContact O-OG 3.21Å; R166-S186 WeakPolarHBondContact O-CB 3.4Å; R166-S186 PolarHBondContact O-N 3.32Å; Q168-S186 PolarHBondContact NE2-OG 3.43Å
187	R	90.9	Very high	92.1	Very high	58 Å²	58	65.3 Å²	65.3	22%	0.219	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-81.7	148.7	174.3	-68.1	177.1	69.5	151	17.2	109.5	P185 F213 R214 E219	P185-R187 HydrophobicContact CB-CG 4.13Å; P185-R187 PolarHBondContact O-N 3.47Å; R187-F213 HydrophobicContact CB-CB 4.36Å; R187-F213 HydrophobicContact CB-CD1 3.54Å; R187-F213 HydrophobicContact CB-CE1 4.12Å; R187-F213 HydrophobicContact CB-CG 4.2Å; R187-F213 HydrophobicContact CG-CD1 4.49Å; R187-R214 PolarHBondContact NH2-O 2.85Å; R187-E219 IonicContact CZ-OE2 2.8Å; R187-E219 IonicContact NH1-OE2 2.68Å; R187-E219 IonicContact NH2-OE2 2.91Å; R187-E219 PolarHBondContact NH2-OE2 3.23Å
188	E	89.6	Confident	92.1	Very high	114 Å²	114	67.5 Å²	67.5	53%	0.533	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-63.4	139.7	175	-68.7	-173.5	-137.7	0	0	110.9	F213 R214	E188-F213 CarbonylContact O-C 3.57Å; E188-R214 HydrophobicContact CB-CB 4.19Å; E188-R214 PolarHBondContact O-N 2.83Å; E188-R214 IonicContact OE1-CZ 3.49Å; E188-R214 IonicContact OE1-NH1 3.62Å; E188-R214 IonicContact OE1-NH2 2.77Å; E188-R214 PolarHBondContact OE1-NH2 3.07Å; E188-R214 IonicContact OE2-CZ 3Å; E188-R214 IonicContact OE2-NE 3.87Å; E188-R214 IonicContact OE2-NH1 2.62Å; E188-R214 PolarHBondContact OE2-NH1 3.48Å; E188-R214 IonicContact OE2-NH2 3.17Å; E188-R214 PolarHBondContact OE2-NH2 3.08Å; E188-R214 VanDerWaalsContact OE2-NH2 3.17Å
189	V	91.3	Very high	92.2	Very high	30 Å²	30	68.7 Å²	68.7	18%	0.182	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.3	178.1	177	0	0	0	0	109.1	F152 K191 F196 F211	F152-V189 HydrophobicContact CE1-CG2 3.9Å; F152-V189 HydrophobicContact CZ-CG2 4.07Å; V189-K191 PolarHBondContact O-N 3.35Å; V189-F196 HydrophobicContact CG1-CD2 3.71Å; V189-F196 HydrophobicContact CG1-CE2 4.21Å; V189-F211 HydrophobicContact CB-CD2 4.42Å; V189-F211 HydrophobicContact CG1-CB 3.66Å; V189-F211 HydrophobicContact CG1-CD2 3.82Å; V189-F211 HydrophobicContact CG1-CG 4.05Å; V189-F211 HydrophobicContact CG2-CD2 3.76Å; V189-F211 HydrophobicContact CG2-CE2 4.05Å
190	D	90.2	Very high	92.3	Very high	32 Å²	32	67 Å²	67	17%	0.171	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	111.4	177	-165.1	-11.9	0	0	0	109.9	Q130 S192 K195 A212	Q130-D190 PolarHBondContact NE2-OD2 3.28Å; Q130-D190 VanDerWaalsContact NE2-OD2 3.14Å; D190-S192 WeakPolarHBondContact OD1-CB 3.5Å; D190-S192 PolarHBondContact OD1-N 2.91Å; D190-S192 PolarHBondContact OD1-OG 3.24Å; D190-K195 HydrophobicContact CB-CD 4.05Å; D190-K195 WeakPolarHBondContact OD2-CD 3.31Å; D190-K195 WeakPolarHBondContact OD2-CE 3.47Å; D190-K195 IonicContact OD2-NZ 2.73Å; D190-K195 PolarHBondContact OD2-NZ 3.33Å; D190-A212 PolarHBondContact N-O 2.71Å
191	K	88.9	Confident	92.2	Very high	175 Å²	175	68.8 Å²	68.8	76%	0.761	36%	0.361	S	S	*	.			trans	-95.5	14.2	-178.1	-62.4	-177.2	-178	178.5	0	112.9	V189	V189-K191 PolarHBondContact O-N 3.35Å
192	S	88.3	Confident	92.2	Very high	47 Å²	47	73.9 Å²	73.9	33%	0.329	37%	0.371	S	S	.	.	S	Bend	trans	-61.3	156.4	173	75.1	0	0	0	0	111	D190 G194 K195	D190-S192 WeakPolarHBondContact OD1-CB 3.5Å; D190-S192 PolarHBondContact OD1-N 2.91Å; D190-S192 PolarHBondContact OD1-OG 3.24Å; S192-G194 PolarHBondContact O-N 3Å; S192-K195 PolarHBondContact O-N 3.28Å; S192-K195 VanDerWaalsContact OG-CD 3.26Å; S192-K195 WeakPolarHBondContact OG-CD 3.46Å; S192-K195 WeakPolarHBondContact OG-CG 3.21Å
193	E	85.5	Confident	92.1	Very high	196 Å²	196	79.8 Å²	79.8	92%	0.916	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	135.3	176.7	-167.2	174.9	-176.5	0	0	111.2	K195	E193-K195 PolarHBondContact O-N 3.42Å; E193-K195 VanDerWaalsContact O-N 3.15Å
194	G	85.9	Confident	92.1	Very high	56 Å²	56	79 Å²	79	58%	0.577	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-20.7	-179.9	0	0	0	0	0	116.3	S192	S192-G194 PolarHBondContact O-N 3Å
195	K	89.4	Confident	92.2	Very high	67 Å²	67	82.4 Å²	82.4	29%	0.291	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-30.1	179.5	-67.3	-169	-167.7	-178.1	0	113.8	Q130 D190 S192 E193 F211 A212	Q130-K195 VanDerWaalsContact OE1-CE 3.26Å; D190-K195 HydrophobicContact CB-CD 4.05Å; D190-K195 WeakPolarHBondContact OD2-CD 3.31Å; D190-K195 WeakPolarHBondContact OD2-CE 3.47Å; D190-K195 IonicContact OD2-NZ 2.73Å; D190-K195 PolarHBondContact OD2-NZ 3.33Å; S192-K195 PolarHBondContact O-N 3.28Å; S192-K195 VanDerWaalsContact OG-CD 3.26Å; S192-K195 WeakPolarHBondContact OG-CD 3.46Å; S192-K195 WeakPolarHBondContact OG-CG 3.21Å; E193-K195 PolarHBondContact O-N 3.42Å; E193-K195 VanDerWaalsContact O-N 3.15Å; K195-F211 CarbonylContact O-C 3.51Å; K195-F211 WeakPolarHBondContact O-CA 3.3Å; K195-A212 HydrophobicContact CB-CB 4.13Å; K195-A212 HydrophobicContact CD-CB 4.2Å; K195-A212 HydrophobicContact CG-CB 4.45Å; K195-A212 PolarHBondContact O-N 2.88Å
196	F	93.7	Very high	92.3	Very high	58 Å²	58	82.5 Å²	82.5	25%	0.254	42%	0.417	S	S	.	.	S	Bend	trans	-119	116.8	175.1	-173.7	-82.5	0	0	0	109.4	H150 F152 V189 Q210 F211	H150-F196 AromaticContact NE2-CZ 3.66Å; F152-F196 AromaticContact CE2-CE2 3.84Å; F152-F196 HydrophobicContact CE2-CE2 3.84Å; F152-F196 HydrophobicContact CE2-CZ 4.25Å; F152-F196 HydrophobicContact CZ-CE2 4.19Å; V189-F196 HydrophobicContact CG1-CD2 3.71Å; V189-F196 HydrophobicContact CG1-CE2 4.21Å; F196-Q210 WeakPolarHBondContact CA-O 3.29Å; F196-F211 HydrophobicContact CD2-CB 3.57Å; F196-F211 HydrophobicContact CE2-CB 4.05Å
197	W	94.4	Very high	92.6	Very high	86 Å²	86	80.4 Å²	80.4	33%	0.326	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	157.2	177.1	60.7	-97.6	0	0	0	111.8	L134 L199 F208 Q210	L134-W197 HydrophobicContact CD1-CH2 4.08Å; L134-W197 HydrophobicContact CD1-CZ2 4.27Å; W197-L199 HydrophobicContact CE3-CB 4.2Å; W197-L199 HydrophobicContact CZ3-CB 3.87Å; W197-F208 HydrophobicContact CH2-CB 4.06Å; W197-F208 HydrophobicContact CZ3-CB 3.68Å; W197-Q210 HydrophobicContact CD2-CB 4.06Å; W197-Q210 VanDerWaalsContact CE2-CB 3.45Å; W197-Q210 HydrophobicContact CG-CB 4.46Å; W197-Q210 HydrophobicContact CH2-CB 4.36Å; W197-Q210 HydrophobicContact CZ2-CB 3.64Å; W197-Q210 HydrophobicContact CZ2-CG 4.43Å; W197-Q210 PolarHBondContact N-O 3.01Å; W197-Q210 PolarHBondContact O-N 3.05Å
198	T	95.9	Very high	92.9	Very high	65 Å²	65	79.4 Å²	79.4	40%	0.399	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.3	175.5	60.9	0	0	0	0	110.2	F207 F208 L209	T198-F207 HydrophobicContact CG2-CZ 4.29Å; T198-F208 CarbonylContact C-O 3.58Å; T198-F208 VanDerWaalsContact CA-O 3.25Å; T198-F208 WeakPolarHBondContact CA-O 3.34Å; T198-L209 HydrophobicContact CG2-CB 4.13Å; T198-L209 HydrophobicContact CG2-CD1 3.55Å; T198-L209 HydrophobicContact CG2-CG 3.85Å
199	L	96.1	Very high	93.3	Very high	96 Å²	96	74 Å²	74	50%	0.503	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	129	178.5	-179.9	70.4	0	0	0	109.4	W197 F208	W197-L199 HydrophobicContact CE3-CB 4.2Å; W197-L199 HydrophobicContact CZ3-CB 3.87Å; L199-F208 HydrophobicContact CB-CB 4.26Å; L199-F208 HydrophobicContact CD2-CD2 4.45Å; L199-F208 PolarHBondContact N-O 2.97Å; L199-F208 PolarHBondContact O-N 3.41Å
200	W	96.8	Very high	93.5	Very high	42 Å²	42	74.4 Å²	74.4	16%	0.159	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	111.3	170.4	173.2	-126.3	0	0	0	109.1	Y139 V142 V147 P148 K205 Q206 F207	Y139-W200 HydrophobicContact CD2-CZ3 4.18Å; V142-W200 HydrophobicContact CG1-CH2 4.01Å; V142-W200 HydrophobicContact CG1-CZ2 3.9Å; V147-W200 HydrophobicContact CG1-CB 4.26Å; V147-W200 HydrophobicContact CG1-CG 4.19Å; P148-W200 HydrophobicContact CG-CD2 3.99Å; P148-W200 HydrophobicContact CG-CE3 3.66Å; P148-W200 HydrophobicContact CG-CH2 4.01Å; P148-W200 HydrophobicContact CG-CZ2 4.33Å; P148-W200 HydrophobicContact CG-CZ3 3.66Å; W200-K205 VanDerWaalsContact CH2-C 3.44Å; W200-K205 VanDerWaalsContact CH2-CA 3.42Å; W200-K205 HydrophobicContact CH2-CB 3.89Å; W200-K205 WeakPolarHBondContact CZ3-O 3.42Å; W200-Q206 VanDerWaalsContact CE3-C 3.49Å; W200-Q206 VanDerWaalsContact CE3-O 3.27Å; W200-Q206 VanDerWaalsContact CZ3-C 3.47Å; W200-F207 HydrophobicContact CB-CD2 3.99Å; W200-F207 HydrophobicContact CB-CE2 4.37Å; W200-F207 HydrophobicContact CE3-CB 3.79Å; W200-F207 HydrophobicContact CE3-CD2 4.11Å; W200-F207 HydrophobicContact CE3-CG 4.45Å; W200-F207 HydrophobicContact CZ3-CB 4.07Å
201	N	95.5	Very high	93.7	Very high	52 Å²	52	72.9 Å²	72.9	28%	0.278	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	108.7	172.8	-173.1	-25.8	0	0	0	108.9	D203 T204 K205 Q206	N201-D203 VanDerWaalsContact C-N 3.31Å; N201-D203 PolarHBondContact O-N 3.25Å; N201-D203 PolarHBondContact OD1-N 3.17Å; N201-T204 WeakPolarHBondContact CB-OG1 3.38Å; N201-T204 PolarHBondContact ND2-OG1 3.09Å; N201-T204 PolarHBondContact OD1-N 3.13Å; N201-T204 PolarHBondContact OD1-OG1 2.78Å; N201-K205 WeakPolarHBondContact O-CA 3.16Å; N201-K205 PolarHBondContact O-N 3.1Å; N201-Q206 PolarHBondContact N-O 2.87Å; N201-Q206 PolarHBondContact O-N 2.92Å
202	K	93.9	Very high	94	Very high	151 Å²	151	64.9 Å²	64.9	66%	0.657	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-29.6	-178	-68.6	179.7	-179.6	-177.7	0	112.9
203	D	94	Very high	94.2	Very high	154 Å²	154	63 Å²	63	82%	0.824	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-47.3	-174	-54.8	-42.8	0	0	0	110.9	N201 K205	N201-D203 VanDerWaalsContact C-N 3.31Å; N201-D203 PolarHBondContact O-N 3.25Å; N201-D203 PolarHBondContact OD1-N 3.17Å; D203-K205 VanDerWaalsContact C-N 3.31Å
204	T	95.1	Very high	94.4	Very high	75 Å²	75	58.6 Å²	58.6	46%	0.46	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-11	176.7	60.9	0	0	0	0	112.9	N201 Q206	N201-T204 WeakPolarHBondContact CB-OG1 3.38Å; N201-T204 PolarHBondContact ND2-OG1 3.09Å; N201-T204 PolarHBondContact OD1-N 3.13Å; N201-T204 PolarHBondContact OD1-OG1 2.78Å; T204-Q206 VanDerWaalsContact C-N 3.27Å; T204-Q206 PolarHBondContact O-N 3.48Å
205	K	95.2	Very high	94.2	Very high	77 Å²	77	57.6 Å²	57.6	34%	0.335	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	40.5	-174	-59.4	177.1	171.8	176.9	0	112.8	Y139 P140 V142 W200 N201 D203	Y139-K205 PolarHBondContact N-O 3.47Å; Y139-K205 WeakPolarHBondContact O-CB 3.27Å; P140-K205 WeakPolarHBondContact O-CD 3.34Å; P140-K205 WeakPolarHBondContact O-CE 3.37Å; P140-K205 PolarHBondContact O-NZ 2.85Å; V142-K205 HydrophobicContact CG1-CD 4.26Å; V142-K205 HydrophobicContact CG1-CG 4.39Å; W200-K205 VanDerWaalsContact CH2-C 3.44Å; W200-K205 VanDerWaalsContact CH2-CA 3.42Å; W200-K205 HydrophobicContact CH2-CB 3.89Å; W200-K205 WeakPolarHBondContact CZ3-O 3.42Å; N201-K205 WeakPolarHBondContact O-CA 3.16Å; N201-K205 PolarHBondContact O-N 3.1Å; D203-K205 VanDerWaalsContact C-N 3.31Å
206	Q	96.6	Very high	93.2	Very high	50 Å²	50	57.8 Å²	57.8	23%	0.234	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.2	-180	-61.5	-172.5	-30.9	0	0	111.2	I137 D138 W200 N201 T204 F208	I137-Q206 WeakPolarHBondContact O-CA 3.48Å; D138-Q206 VanDerWaalsContact OD1-CG 3.29Å; D138-Q206 WeakPolarHBondContact OD1-CG 3.45Å; D138-Q206 PolarHBondContact OD1-NE2 3.41Å; W200-Q206 VanDerWaalsContact CE3-C 3.49Å; W200-Q206 VanDerWaalsContact CE3-O 3.27Å; W200-Q206 VanDerWaalsContact CZ3-C 3.47Å; N201-Q206 PolarHBondContact N-O 2.87Å; N201-Q206 PolarHBondContact O-N 2.92Å; T204-Q206 VanDerWaalsContact C-N 3.27Å; T204-Q206 PolarHBondContact O-N 3.48Å; Q206-F208 HydrophobicContact CB-CD2 4.39Å; Q206-F208 HydrophobicContact CB-CE2 3.6Å; Q206-F208 HydrophobicContact CB-CZ 4.01Å
207	F	97.8	Very high	91.7	Very high	7 Å²	7	60 Å²	60	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.7	174	-170.4	-113.5	0	0	0	110.4	Q136 I137 Y139 P148 H150 F172 T198 W200 L209	Q136-F207 CarbonylContact C-O 3.57Å; Q136-F207 WeakPolarHBondContact CA-O 3.29Å; I137-F207 HydrophobicContact CB-CB 4.48Å; I137-F207 HydrophobicContact CD1-CD1 4.47Å; I137-F207 PolarHBondContact N-O 3.02Å; I137-F207 PolarHBondContact O-N 3.01Å; Y139-F207 HydrophobicContact CD2-CB 4.19Å; Y139-F207 HydrophobicContact CE2-CB 4.16Å; P148-F207 HydrophobicContact CB-CB 4.16Å; P148-F207 HydrophobicContact CB-CD1 4.24Å; P148-F207 HydrophobicContact CB-CD2 3.92Å; P148-F207 HydrophobicContact CB-CE2 4.39Å; P148-F207 HydrophobicContact CB-CG 3.84Å; P148-F207 HydrophobicContact CG-CB 4.21Å; P148-F207 HydrophobicContact CG-CD2 4.3Å; P148-F207 HydrophobicContact CG-CG 4.32Å; H150-F207 HydrophobicContact CB-CE1 4.46Å; F172-F207 AromaticContact CD1-CD1 3.76Å; F172-F207 HydrophobicContact CD1-CD1 3.76Å; F172-F207 AromaticContact CD1-CE1 3.65Å; F172-F207 HydrophobicContact CD1-CE1 3.65Å; F172-F207 AromaticContact CE1-CD1 3.88Å; F172-F207 HydrophobicContact CE1-CD1 3.88Å; F172-F207 AromaticContact CE1-CE1 3.65Å; F172-F207 HydrophobicContact CE1-CE1 3.65Å; T198-F207 HydrophobicContact CG2-CZ 4.29Å; W200-F207 HydrophobicContact CB-CD2 3.99Å; W200-F207 HydrophobicContact CB-CE2 4.37Å; W200-F207 HydrophobicContact CE3-CB 3.79Å; W200-F207 HydrophobicContact CE3-CD2 4.11Å; W200-F207 HydrophobicContact CE3-CG 4.45Å; W200-F207 HydrophobicContact CZ3-CB 4.07Å; F207-L209 HydrophobicContact CE1-CB 4.27Å
208	F	97.6	Very high	89.8	Confident	37 Å²	37	66 Å²	66	16%	0.162	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138	177	-62	-90	0	0	0	110.3	L134 F135 Q136 W197 T198 L199 Q206	L134-F208 HydrophobicContact CD1-CD1 4.47Å; F135-F208 VanDerWaalsContact O-CA 3.3Å; F135-F208 WeakPolarHBondContact O-CA 3.42Å; Q136-F208 HydrophobicContact CB-CD1 4.03Å; Q136-F208 HydrophobicContact CB-CE1 3.87Å; Q136-F208 HydrophobicContact CG-CD1 4.16Å; Q136-F208 HydrophobicContact CG-CE1 3.59Å; Q136-F208 HydrophobicContact CG-CZ 4.03Å; W197-F208 HydrophobicContact CH2-CB 4.06Å; W197-F208 HydrophobicContact CZ3-CB 3.68Å; T198-F208 CarbonylContact C-O 3.58Å; T198-F208 VanDerWaalsContact CA-O 3.25Å; T198-F208 WeakPolarHBondContact CA-O 3.34Å; L199-F208 HydrophobicContact CB-CB 4.26Å; L199-F208 HydrophobicContact CD2-CD2 4.45Å; L199-F208 PolarHBondContact N-O 2.97Å; L199-F208 PolarHBondContact O-N 3.41Å; Q206-F208 HydrophobicContact CB-CD2 4.39Å; Q206-F208 HydrophobicContact CB-CE2 3.6Å; Q206-F208 HydrophobicContact CB-CZ 4.01Å
209	L	96.8	Very high	87.8	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	123.2	170.6	178	145.6	0	0	0	108.9	F135 H150 L170 F172 T198 F207 F211	F135-L209 HydrophobicContact CD2-CD2 4.09Å; F135-L209 PolarHBondContact N-O 3.01Å; F135-L209 PolarHBondContact O-N 3.05Å; H150-L209 HydrophobicContact CB-CD1 3.74Å; H150-L209 WeakPolarHBondContact CD2-CD1 3.36Å; L170-L209 HydrophobicContact CD2-CD2 3.79Å; F172-L209 HydrophobicContact CE1-CB 3.8Å; F172-L209 HydrophobicContact CE1-CD1 3.95Å; F172-L209 HydrophobicContact CE1-CD2 4.44Å; F172-L209 HydrophobicContact CE1-CG 4.3Å; F172-L209 HydrophobicContact CZ-CB 4.08Å; F172-L209 HydrophobicContact CZ-CD1 4.29Å; F172-L209 HydrophobicContact CZ-CD2 4.05Å; F172-L209 HydrophobicContact CZ-CG 4.39Å; T198-L209 HydrophobicContact CG2-CB 4.13Å; T198-L209 HydrophobicContact CG2-CD1 3.55Å; T198-L209 HydrophobicContact CG2-CG 3.85Å; F207-L209 HydrophobicContact CE1-CB 4.27Å; L209-F211 HydrophobicContact CD2-CD1 3.56Å; L209-F211 HydrophobicContact CD2-CE1 3.92Å
210	Q	95.3	Very high	85.8	Confident	39 Å²	39	65.1 Å²	65.1	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.1	174.5	-172.5	178.5	-42.2	0	0	109.8	L133 L134 F196 W197	L133-Q210 WeakPolarHBondContact O-CA 3.34Å; L134-Q210 HydrophobicContact CB-CG 4.5Å; L134-Q210 HydrophobicContact CD1-CB 3.94Å; L134-Q210 HydrophobicContact CD1-CG 4.5Å; F196-Q210 WeakPolarHBondContact CA-O 3.29Å; W197-Q210 HydrophobicContact CD2-CB 4.06Å; W197-Q210 VanDerWaalsContact CE2-CB 3.45Å; W197-Q210 HydrophobicContact CG-CB 4.46Å; W197-Q210 HydrophobicContact CH2-CB 4.36Å; W197-Q210 HydrophobicContact CZ2-CB 3.64Å; W197-Q210 HydrophobicContact CZ2-CG 4.43Å; W197-Q210 PolarHBondContact N-O 3.01Å; W197-Q210 PolarHBondContact O-N 3.05Å
211	F	95.1	Very high	83.9	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.6	167.7	65.9	-85.3	0	0	0	111.9	S132 L133 F135 F152 L170 I184 V189 K195 F196 L209 F213	S132-F211 CarbonylContact C-O 3.56Å; S132-F211 VanDerWaalsContact CA-O 3.22Å; S132-F211 WeakPolarHBondContact CA-O 3.39Å; S132-F211 WeakPolarHBondContact CB-O 3.49Å; L133-F211 HydrophobicContact CB-CE1 4.15Å; L133-F211 HydrophobicContact CB-CZ 4.11Å; L133-F211 HydrophobicContact CD1-CE2 4.29Å; L133-F211 HydrophobicContact CD1-CZ 3.8Å; L133-F211 HydrophobicContact CG-CZ 4.41Å; L133-F211 PolarHBondContact N-O 3.37Å; L133-F211 PolarHBondContact O-N 3.44Å; L133-F211 VanDerWaalsContact O-N 3.09Å; F135-F211 HydrophobicContact CD2-CE1 4.08Å; F135-F211 AromaticContact CE2-CE1 3.58Å; F135-F211 HydrophobicContact CE2-CE1 3.58Å; F135-F211 HydrophobicContact CE2-CZ 4.16Å; F152-F211 HydrophobicContact CE1-CE1 4.42Å; F152-F211 HydrophobicContact CE1-CE2 4.39Å; F152-F211 HydrophobicContact CE1-CZ 4.19Å; F152-F211 HydrophobicContact CZ-CD1 4.18Å; F152-F211 HydrophobicContact CZ-CE1 4.17Å; F152-F211 HydrophobicContact CZ-CG 4.35Å; F152-F211 HydrophobicContact CZ-CZ 4.34Å; L170-F211 HydrophobicContact CD2-CE1 3.62Å; L170-F211 HydrophobicContact CD2-CZ 4.3Å; I184-F211 HydrophobicContact CD1-CE2 4.38Å; I184-F211 HydrophobicContact CD1-CZ 3.9Å; V189-F211 HydrophobicContact CB-CD2 4.42Å; V189-F211 HydrophobicContact CG1-CB 3.66Å; V189-F211 HydrophobicContact CG1-CD2 3.82Å; V189-F211 HydrophobicContact CG1-CG 4.05Å; V189-F211 HydrophobicContact CG2-CD2 3.76Å; V189-F211 HydrophobicContact CG2-CE2 4.05Å; K195-F211 CarbonylContact O-C 3.51Å; K195-F211 WeakPolarHBondContact O-CA 3.3Å; F196-F211 HydrophobicContact CD2-CB 3.57Å; F196-F211 HydrophobicContact CE2-CB 4.05Å; L209-F211 HydrophobicContact CD2-CD1 3.56Å; L209-F211 HydrophobicContact CD2-CE1 3.92Å; F211-F213 HydrophobicContact CD2-CE1 4.48Å; F211-F213 HydrophobicContact CE2-CD1 4.23Å; F211-F213 AromaticContact CE2-CE1 3.65Å; F211-F213 HydrophobicContact CE2-CE1 3.65Å; F211-F213 HydrophobicContact CE2-CE2 4.2Å; F211-F213 AromaticContact CE2-CZ 3.62Å; F211-F213 HydrophobicContact CE2-CZ 3.62Å; F211-F213 HydrophobicContact CZ-CZ 4.26Å
212	A	94.1	Very high	82.2	Confident	7 Å²	7	72.1 Å²	72.1	6%	0.058	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	142.9	170	0	0	0	0	0	110.6	Q130 D190 K195	Q130-A212 HydrophobicContact CG-CB 4.06Å; D190-A212 PolarHBondContact N-O 2.71Å; K195-A212 HydrophobicContact CB-CB 4.13Å; K195-A212 HydrophobicContact CD-CB 4.2Å; K195-A212 HydrophobicContact CG-CB 4.45Å; K195-A212 PolarHBondContact O-N 2.88Å
213	F	93.3	Very high	80.7	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.035	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139.7	170.1	-66.4	-71.4	0	0	0	109.7	Q130 Q131 L133 P185 R187 E188 F211 T215	Q130-F213 WeakPolarHBondContact CG-O 3.48Å; Q130-F213 PolarHBondContact NE2-O 3.35Å; Q131-F213 HydrophobicContact CB-CD2 4.33Å; Q131-F213 PolarHBondContact O-N 2.9Å; L133-F213 HydrophobicContact CD1-CE2 3.79Å; L133-F213 HydrophobicContact CD1-CZ 3.78Å; L133-F213 HydrophobicContact CG-CE2 3.95Å; L133-F213 HydrophobicContact CG-CZ 4.41Å; P185-F213 HydrophobicContact CG-CZ 4.49Å; R187-F213 HydrophobicContact CB-CB 4.36Å; R187-F213 HydrophobicContact CB-CD1 3.54Å; R187-F213 HydrophobicContact CB-CE1 4.12Å; R187-F213 HydrophobicContact CB-CG 4.2Å; R187-F213 HydrophobicContact CG-CD1 4.49Å; E188-F213 CarbonylContact O-C 3.57Å; F211-F213 HydrophobicContact CD2-CE1 4.48Å; F211-F213 HydrophobicContact CE2-CD1 4.23Å; F211-F213 AromaticContact CE2-CE1 3.65Å; F211-F213 HydrophobicContact CE2-CE1 3.65Å; F211-F213 HydrophobicContact CE2-CE2 4.2Å; F211-F213 AromaticContact CE2-CZ 3.62Å; F211-F213 HydrophobicContact CE2-CZ 3.62Å; F211-F213 HydrophobicContact CZ-CZ 4.26Å; F213-T215 PolarHBondContact O-N 3.05Å
214	R	89.4	Confident	79.2	Confident	104 Å²	104	65.8 Å²	65.8	39%	0.392	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-59.7	129.2	172.7	-164.2	176.6	74.9	-162.1	-9.4	109	R187 E188 D216	R187-R214 PolarHBondContact NH2-O 2.85Å; E188-R214 HydrophobicContact CB-CB 4.19Å; E188-R214 PolarHBondContact O-N 2.83Å; E188-R214 IonicContact OE1-CZ 3.49Å; E188-R214 IonicContact OE1-NH1 3.62Å; E188-R214 IonicContact OE1-NH2 2.77Å; E188-R214 PolarHBondContact OE1-NH2 3.07Å; E188-R214 IonicContact OE2-CZ 3Å; E188-R214 IonicContact OE2-NE 3.87Å; E188-R214 IonicContact OE2-NH1 2.62Å; E188-R214 PolarHBondContact OE2-NH1 3.48Å; E188-R214 IonicContact OE2-NH2 3.17Å; E188-R214 PolarHBondContact OE2-NH2 3.08Å; E188-R214 VanDerWaalsContact OE2-NH2 3.17Å; R214-D216 PolarHBondContact O-N 3.06Å
215	T	82.5	Confident	78	Confident	34 Å²	34	66.8 Å²	66.8	21%	0.209	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-76	118.4	174	-48.9	0	0	0	0	108.2	Q130 F213 T217 N220	Q130-T215 WeakPolarHBondContact CG-OG1 3.47Å; F213-T215 PolarHBondContact O-N 3.05Å; T215-T217 PolarHBondContact O-N 3.5Å; T215-N220 HydrophobicContact CG2-CB 4.37Å; T215-N220 VanDerWaalsContact CG2-ND2 3.27Å; T215-N220 WeakPolarHBondContact CG2-ND2 3.26Å; T215-N220 WeakPolarHBondContact CG2-OD1 3.48Å
216	D	68.8	Low	76.6	Confident	71 Å²	71	68.6 Å²	68.6	38%	0.38	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.4	123.3	171.3	-76.3	-35.1	0	0	0	107.6	R214 R218 E219 N220	R214-D216 PolarHBondContact O-N 3.06Å; D216-R218 PolarHBondContact O-N 2.88Å; D216-E219 HydrophobicContact CB-CG 4.31Å; D216-E219 PolarHBondContact O-N 3.22Å; D216-N220 PolarHBondContact O-N 2.94Å
217	T	60.4	Low	75.4	Confident	105 Å²	105	69.5 Å²	69.5	64%	0.644	34%	0.342	S	S	*	.	H	α-helix	trans	-55.7	-21	177.3	-18.4	0	0	0	0	111.6	T215 K221	T215-T217 PolarHBondContact O-N 3.5Å; T217-K221 WeakPolarHBondContact O-CB 3.48Å; T217-K221 VanDerWaalsContact O-CG 3.28Å; T217-K221 WeakPolarHBondContact O-CG 3.49Å; T217-K221 PolarHBondContact O-N 3.27Å
218	R	54.8	Low	74.1	Confident	213 Å²	213	71.9 Å²	71.9	80%	0.804	36%	0.362	S	S	*	.	H	α-helix	trans	-72.4	-41	173.6	-67.7	-174.7	127.2	152.2	-0.4	113.2	D216 K221 L222	D216-R218 PolarHBondContact O-N 2.88Å; R218-K221 PolarHBondContact O-N 3.15Å; R218-L222 WeakPolarHBondContact O-CG 3.47Å; R218-L222 PolarHBondContact O-N 3.02Å; R218-L222 VanDerWaalsContact O-N 3.07Å
219	E	55	Low	72.8	Confident	85 Å²	85	74 Å²	74	40%	0.397	37%	0.374	S	S	.	.	H	α-helix	trans	-68.3	-40.7	175.9	-72.5	-173.2	153	0	0	110.7	R187 D216 L222 N223	R187-E219 IonicContact CZ-OE2 2.8Å; R187-E219 IonicContact NH1-OE2 2.68Å; R187-E219 IonicContact NH2-OE2 2.91Å; R187-E219 PolarHBondContact NH2-OE2 3.23Å; D216-E219 HydrophobicContact CB-CG 4.31Å; D216-E219 PolarHBondContact O-N 3.22Å; E219-L222 PolarHBondContact O-N 3.14Å; E219-N223 WeakPolarHBondContact O-CB 3.46Å; E219-N223 PolarHBondContact O-N 3.03Å; E219-N223 PolarHBondContact O-ND2 3.35Å
220	N	54.8	Low	71.6	Confident	56 Å²	56	80.2 Å²	80.2	30%	0.299	41%	0.407	S	S	.	.	H	α-helix	trans	-62.9	-46.4	174.4	-84.8	5.2	0	0	0	111.7	T215 D216 L222 N223 D224	T215-N220 HydrophobicContact CG2-CB 4.37Å; T215-N220 VanDerWaalsContact CG2-ND2 3.27Å; T215-N220 WeakPolarHBondContact CG2-ND2 3.26Å; T215-N220 WeakPolarHBondContact CG2-OD1 3.48Å; D216-N220 PolarHBondContact O-N 2.94Å; N220-L222 VanDerWaalsContact C-N 3.29Å; N220-L222 PolarHBondContact O-N 3.36Å; N220-N223 PolarHBondContact O-N 3.05Å; N220-D224 VanDerWaalsContact O-CB 3.26Å; N220-D224 WeakPolarHBondContact O-CB 3.44Å; N220-D224 PolarHBondContact O-N 3.47Å
221	K	55.1	Low	70.4	Confident	136 Å²	136	81.4 Å²	81.4	59%	0.591	42%	0.423	S	S	*	.	H	α-helix	trans	-59.6	-38.2	176.4	-77.8	-179.5	-178.2	-172.2	0	112.8	T217 R218 I225	T217-K221 WeakPolarHBondContact O-CB 3.48Å; T217-K221 VanDerWaalsContact O-CG 3.28Å; T217-K221 WeakPolarHBondContact O-CG 3.49Å; T217-K221 PolarHBondContact O-N 3.27Å; R218-K221 PolarHBondContact O-N 3.15Å; K221-I225 VanDerWaalsContact O-CB 3.27Å; K221-I225 WeakPolarHBondContact O-CB 3.48Å; K221-I225 VanDerWaalsContact O-CD1 3.3Å; K221-I225 WeakPolarHBondContact O-CD1 3.41Å; K221-I225 WeakPolarHBondContact O-CG1 3.47Å; K221-I225 PolarHBondContact O-N 3.5Å
222	L	60.5	Low	69	Low	106 Å²	106	85.4 Å²	85.4	56%	0.555	45%	0.452	S	S	*	.	H	α-helix	trans	-68.2	-43	176.9	-74	170.7	0	0	0	112	R218 E219 N220 I225 Q226	R218-L222 WeakPolarHBondContact O-CG 3.47Å; R218-L222 PolarHBondContact O-N 3.02Å; R218-L222 VanDerWaalsContact O-N 3.07Å; E219-L222 PolarHBondContact O-N 3.14Å; N220-L222 VanDerWaalsContact C-N 3.29Å; N220-L222 PolarHBondContact O-N 3.36Å; L222-I225 PolarHBondContact O-N 3.2Å; L222-Q226 WeakPolarHBondContact O-CB 3.42Å; L222-Q226 VanDerWaalsContact O-CG 3.31Å; L222-Q226 WeakPolarHBondContact O-CG 3.39Å; L222-Q226 PolarHBondContact O-N 3.1Å
223	N	61.9	Low	67.3	Low	72 Å²	72	91.9 Å²	91.9	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-68.1	-37.6	176.5	-70	-22.6	0	0	0	111.9	E219 N220 Q226 S227	E219-N223 WeakPolarHBondContact O-CB 3.46Å; E219-N223 PolarHBondContact O-N 3.03Å; E219-N223 PolarHBondContact O-ND2 3.35Å; N220-N223 PolarHBondContact O-N 3.05Å; N223-Q226 PolarHBondContact O-N 3.28Å; N223-S227 VanDerWaalsContact O-CB 3.25Å; N223-S227 WeakPolarHBondContact O-CB 3.45Å; N223-S227 PolarHBondContact O-N 3.17Å; N223-S227 PolarHBondContact O-OG 3.09Å
224	D	64	Low	65.2	Low	100 Å²	100	97.5 Å²	97.5	54%	0.535	51%	0.51	S	S	.	.	H	α-helix	trans	-67.2	-42.1	175.5	-68.9	-25.4	0	0	0	110.5	N220 S227 A228	N220-D224 VanDerWaalsContact O-CB 3.26Å; N220-D224 WeakPolarHBondContact O-CB 3.44Å; N220-D224 PolarHBondContact O-N 3.47Å; D224-S227 PolarHBondContact O-N 3.12Å; D224-A228 WeakPolarHBondContact O-CB 3.35Å; D224-A228 PolarHBondContact O-N 3.49Å
225	I	68.4	Low	63.1	Low	96 Å²	96	97.2 Å²	97.2	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-64.8	-43.9	173.6	-69.8	163.4	0	0	0	110.4	K221 L222 S227 A228 I229	K221-I225 VanDerWaalsContact O-CB 3.27Å; K221-I225 WeakPolarHBondContact O-CB 3.48Å; K221-I225 VanDerWaalsContact O-CD1 3.3Å; K221-I225 WeakPolarHBondContact O-CD1 3.41Å; K221-I225 WeakPolarHBondContact O-CG1 3.47Å; K221-I225 PolarHBondContact O-N 3.5Å; L222-I225 PolarHBondContact O-N 3.2Å; I225-S227 PolarHBondContact O-N 2.99Å; I225-A228 PolarHBondContact O-N 3.01Å; I225-I229 HydrophobicContact CG2-CD1 3.63Å; I225-I229 HydrophobicContact CG2-CG1 4.24Å; I225-I229 WeakPolarHBondContact O-CB 3.02Å; I225-I229 WeakPolarHBondContact O-CG1 3.14Å; I225-I229 PolarHBondContact O-N 2.89Å
226	Q	66.7	Low	61.4	Low	115 Å²	115	98.8 Å²	98.8	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-63	-42.3	176.2	-77.6	178.1	3.4	0	0	111.9	L222 N223 I229 L230	L222-Q226 WeakPolarHBondContact O-CB 3.42Å; L222-Q226 VanDerWaalsContact O-CG 3.31Å; L222-Q226 WeakPolarHBondContact O-CG 3.39Å; L222-Q226 PolarHBondContact O-N 3.1Å; N223-Q226 PolarHBondContact O-N 3.28Å; Q226-I229 PolarHBondContact O-N 2.93Å; Q226-L230 WeakPolarHBondContact O-CB 3.37Å; Q226-L230 VanDerWaalsContact O-CG 3.28Å; Q226-L230 WeakPolarHBondContact O-CG 3.36Å; Q226-L230 PolarHBondContact O-N 3.01Å
227	S	70.6	Confident	60.1	Low	69 Å²	69	99 Å²	99	48%	0.483	56%	0.564	S	S	.	*	H	α-helix	trans	-68.3	-38.3	177.4	-55	0	0	0	0	111.4	N223 D224 I225 L230 A231	N223-S227 VanDerWaalsContact O-CB 3.25Å; N223-S227 WeakPolarHBondContact O-CB 3.45Å; N223-S227 PolarHBondContact O-N 3.17Å; N223-S227 PolarHBondContact O-OG 3.09Å; D224-S227 PolarHBondContact O-N 3.12Å; I225-S227 PolarHBondContact O-N 2.99Å; S227-L230 PolarHBondContact O-N 2.59Å; S227-A231 VanDerWaalsContact O-CB 3.22Å; S227-A231 WeakPolarHBondContact O-CB 3.49Å; S227-A231 PolarHBondContact O-N 2.77Å
228	A	70.8	Confident	59.4	Low	56 Å²	56	103.3 Å²	103.3	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-69.8	-36.7	175	0	0	0	0	0	112.2	D224 I225 A231 S232	D224-A228 WeakPolarHBondContact O-CB 3.35Å; D224-A228 PolarHBondContact O-N 3.49Å; I225-A228 PolarHBondContact O-N 3.01Å; A228-A231 PolarHBondContact O-N 3.05Å; A228-S232 VanDerWaalsContact O-CB 3.24Å; A228-S232 WeakPolarHBondContact O-CB 3.33Å; A228-S232 PolarHBondContact O-N 3.18Å; A228-S232 PolarHBondContact O-OG 3.16Å
229	I	71.3	Confident	59.3	Low	82 Å²	82	97.9 Å²	97.9	42%	0.421	56%	0.564	S	S	.	*	H	α-helix	trans	-62.7	-52.1	171.1	-72.3	168.9	0	0	0	108.8	I225 Q226 A231 S232 H233	I225-I229 HydrophobicContact CG2-CD1 3.63Å; I225-I229 HydrophobicContact CG2-CG1 4.24Å; I225-I229 WeakPolarHBondContact O-CB 3.02Å; I225-I229 WeakPolarHBondContact O-CG1 3.14Å; I225-I229 PolarHBondContact O-N 2.89Å; Q226-I229 PolarHBondContact O-N 2.93Å; I229-A231 VanDerWaalsContact C-N 3.28Å; I229-A231 PolarHBondContact O-N 3.08Å; I229-S232 WeakPolarHBondContact CA-OG 3.37Å; I229-S232 PolarHBondContact O-N 3.35Å; I229-S232 VanDerWaalsContact O-N 3.13Å; I229-S232 PolarHBondContact O-OG 2.99Å; I229-H233 PolarHBondContact O-N 2.9Å; I229-H233 PolarHBondContact O-ND1 3.3Å
230	L	70.9	Confident	59	Low	130 Å²	130	101.3 Å²	101.3	68%	0.681	59%	0.585	S	S	*	*	H	α-helix	trans	-59.3	-37.8	177.5	-71.9	166.1	0	0	0	112.7	Q226 S227	Q226-L230 WeakPolarHBondContact O-CB 3.37Å; Q226-L230 VanDerWaalsContact O-CG 3.28Å; Q226-L230 WeakPolarHBondContact O-CG 3.36Å; Q226-L230 PolarHBondContact O-N 3.01Å; S227-L230 PolarHBondContact O-N 2.59Å
231	A	70.2	Confident	59	Low	64 Å²	64	106.9 Å²	106.9	53%	0.529	61%	0.609	S	S	.	*	H	α-helix	trans	-72.7	-32.2	176.8	0	0	0	0	0	113.4	S227 A228 I229	S227-A231 VanDerWaalsContact O-CB 3.22Å; S227-A231 WeakPolarHBondContact O-CB 3.49Å; S227-A231 PolarHBondContact O-N 2.77Å; A228-A231 PolarHBondContact O-N 3.05Å; I229-A231 VanDerWaalsContact C-N 3.28Å; I229-A231 PolarHBondContact O-N 3.08Å
232	S	65.4	Low	59.2	Low	85 Å²	85	108.7 Å²	108.7	59%	0.594	62%	0.622	S	S	*	*	H	α-helix	trans	-82.7	-14.3	178.3	52.3	0	0	0	0	113.8	A228 I229 L234	A228-S232 VanDerWaalsContact O-CB 3.24Å; A228-S232 WeakPolarHBondContact O-CB 3.33Å; A228-S232 PolarHBondContact O-N 3.18Å; A228-S232 PolarHBondContact O-OG 3.16Å; I229-S232 WeakPolarHBondContact CA-OG 3.37Å; I229-S232 PolarHBondContact O-N 3.35Å; I229-S232 VanDerWaalsContact O-N 3.13Å; I229-S232 PolarHBondContact O-OG 2.99Å; S232-L234 VanDerWaalsContact C-N 3.34Å
233	H	57.7	Low	59.2	Low	142 Å²	142	109.4 Å²	109.4	66%	0.657	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	5.9	174.6	-65.3	50.8	0	0	0	112.4	I229 P235	I229-H233 PolarHBondContact O-N 2.9Å; I229-H233 PolarHBondContact O-ND1 3.3Å; H233-P235 WeakPolarHBondContact O-CD 3.17Å
234	L	50.2	Low	59.4	Low	126 Å²	126	110 Å²	110	66%	0.66	65%	0.648	S	S	*	*	S	Bend	trans	-73.9	119.7	162.6	-79.2	157.1	0	0	0	108.1	S232 G236	S232-L234 VanDerWaalsContact C-N 3.34Å; L234-G236 PolarHBondContact O-N 3.48Å; L234-G236 VanDerWaalsContact O-N 3.1Å
235	P	45.1	Very low	59.7	Low	98 Å²	98	111.2 Å²	111.2	64%	0.636	66%	0.661	S	S	*	*			trans	-56.7	121.9	169.5	-16.6	29.3	0	0	0	107.6	H233 G237 Y238	H233-P235 WeakPolarHBondContact O-CD 3.17Å; P235-G237 PolarHBondContact O-N 3.03Å; P235-Y238 HydrophobicContact CB-CE2 4.33Å
236	G	47.5	Very low	59.8	Low	67 Å²	67	113 Å²	113	69%	0.691	68%	0.677	S	S	*	*	S	Bend	trans	-45.9	134.4	168.1	0	0	0	0	0	109.7	L234 Y238	L234-G236 PolarHBondContact O-N 3.48Å; L234-G236 VanDerWaalsContact O-N 3.1Å; G236-Y238 PolarHBondContact O-N 3.47Å
237	G	40.9	Very low	60.3	Low	76 Å²	76	112.7 Å²	112.7	78%	0.784	68%	0.684	S	S	*	*			trans	-16	105	-176.1	0	0	0	0	0	116.4	P235 S239	P235-G237 PolarHBondContact O-N 3.03Å; G237-S239 PolarHBondContact O-N 2.86Å
238	Y	45.5	Very low	60.3	Low	195 Å²	195	114.5 Å²	114.5	77%	0.765	70%	0.695	S	S	*	*			trans	-78.2	110.4	142.8	-73.3	-78.1	0	0	0	106.7	P235 G236 N240	P235-Y238 HydrophobicContact CB-CE2 4.33Å; G236-Y238 PolarHBondContact O-N 3.47Å; Y238-N240 PolarHBondContact O-N 2.98Å
239	S	53.7	Low	60.3	Low	99 Å²	99	118 Å²	118	69%	0.692	71%	0.713	S	S	*	*			trans	-47.9	105.5	156.1	41.1	0	0	0	0	108	G237 Q241	G237-S239 PolarHBondContact O-N 2.86Å; S239-Q241 PolarHBondContact O-N 2.82Å
240	N	47.4	Very low	60.1	Low	158 Å²	158	120.4 Å²	120.4	85%	0.845	73%	0.731	S	S	*	*			trans	-68.3	84.9	160.2	-88	-23.7	0	0	0	106.4	Y238 M242	Y238-N240 PolarHBondContact O-N 2.98Å; N240-M242 PolarHBondContact O-N 3.11Å
241	Q	55.4	Low	59.3	Low	172 Å²	172	120 Å²	120	80%	0.804	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-51.6	118.9	151.4	-76.7	177.8	-4.7	0	0	105.8	S239	S239-Q241 PolarHBondContact O-N 2.82Å
242	M	58.5	Low	58.9	Low	174 Å²	174	123.8 Å²	123.8	86%	0.857	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-51.1	135.4	171.1	-72	-154.6	160.9	0	0	108.4	N240 A244	N240-M242 PolarHBondContact O-N 3.11Å; M242-A244 PolarHBondContact O-N 3.36Å; M242-A244 VanDerWaalsContact O-N 3.12Å
243	P	62.1	Low	58.5	Low	121 Å²	121	128.6 Å²	128.6	79%	0.786	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.3	124.3	171.5	24.5	-29.8	0	0	0	107.4
244	A	64.6	Low	57.9	Low	85 Å²	85	127.8 Å²	127.8	70%	0.702	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-56.3	139	174.7	0	0	0	0	0	109.2	M242 V246	M242-A244 PolarHBondContact O-N 3.36Å; M242-A244 VanDerWaalsContact O-N 3.12Å; A244-V246 PolarHBondContact O-N 3.05Å
245	P	71.5	Confident	58	Low	125 Å²	125	126.6 Å²	126.6	81%	0.812	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63	127.6	179.3	25	-31.7	0	0	0	109.8
246	V	70.2	Confident	58.3	Low	134 Å²	134	126.8 Å²	126.8	81%	0.812	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-64.3	125.4	174	-169.3	0	0	0	0	108.1	A244	A244-V246 PolarHBondContact O-N 3.05Å
247	P	76.1	Confident	58.3	Low	108 Å²	108	133.2 Å²	133.2	70%	0.701	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.5	147.5	177	27.4	-32.3	0	0	0	111.1
248	P	71.2	Confident	58.6	Low	107 Å²	107	135.8 Å²	135.8	70%	0.695	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.4	147	179.3	28.7	-33.9	0	0	0	111.5	V250	P248-V250 PolarHBondContact O-N 3.47Å
249	P	71	Confident	58.3	Low	131 Å²	131	136.8 Å²	136.8	85%	0.851	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.1	126.5	174	28.6	-31.2	0	0	0	110.2
250	V	66.3	Low	58.2	Low	132 Å²	132	142.8 Å²	142.8	80%	0.8	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-102.6	128.9	174	-143.9	0	0	0	0	108.6	P248	P248-V250 PolarHBondContact O-N 3.47Å
251	P	56	Low	58.5	Low	120 Å²	120	149 Å²	149	78%	0.779	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86	137	-176	31.9	-30.1	0	0	0	111.3
252	T	61.1	Low	58.6	Low	145 Å²	145	147.9 Å²	147.9	89%	0.89	80%	0.803	S	S	*	*			trans	-133.5	144	165.1	41	0	0	0	0	111.9
253	M	55.9	Low	58.7	Low	185 Å²	185	146.5 Å²	146.5	91%	0.911	80%	0.8	S	S	*	*			trans	-72.5	166.1	-160.7	-72.6	-164.3	179.8	0	0	115.6
254	P	46.7	Very low	58.5	Low	125 Å²	125	147.9 Å²	147.9	81%	0.812	80%	0.801	S	S	*	*			trans	-86.7	152.6	-176.5	35.6	-32.4	0	0	0	112.2
255	S	52	Low	58.1	Low	102 Å²	102	151.6 Å²	151.6	71%	0.713	81%	0.807	S	S	*	*			trans	-156.2	120.8	153.1	-176	0	0	0	0	111
256	T	50	Low	57.3	Low	102 Å²	102	153.3 Å²	153.3	63%	0.626	81%	0.807	S	S	*	*			trans	12.4	135.9	144.7	62	0	0	0	0	119.4
257	Y	47.6	Very low	56.4	Low	201 Å²	201	154.6 Å²	154.6	79%	0.788	81%	0.806	S	S	*	*				174.4	142.5	105.3	-100.5	-78.9	0	0	0	112.6
258	N	47.5	Very low	55	Low	130 Å²	130	157.9 Å²	157.9	70%	0.695	81%	0.814	S	S	*	*			trans	87.7	97.9	147.8	-66.7	-33.8	0	0	0	122.4
259	Y	39.9	Very low	53.8	Low	217 Å²	217	161.8 Å²	161.8	85%	0.851	82%	0.823	S	S	*	*				39.6	126.1	121.2	-87.1	-87.9	0	0	0	120.7
260	R	50.6	Low	52.3	Low	225 Å²	225	164.4 Å²	164.4	85%	0.849	82%	0.821	S	S	*	*				-172.1	128	116.3	-106.3	172.1	178.9	-178.8	0.1	112.8
261	Y	54.3	Low	51	Low	289 Å²	289	167.4 Å²	167.4	100%	1.133	82%	0.823	S	S	*	*			trans	70.6	0	173.9	-62.9	-77.9	0	0	0	118.3

Retrieved 261 of 261 residues in 190 ms (Link to these results)

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