A0A087XIS6_POEFO Loading...

Splicing factor 3B subunit 4

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, SF3B4 is part of the SF3B subcomplex, which is required for 'A' complex assembly formed by the stable binding of U2 snRNP to the branchpoint sequence in pre-mRNA. Sequence independent binding of SF3A and SF3B subcomplexes upstream of the branch site is essential, it may anchor U2 snRNP to the pre-mRNA. May also be involved in the assembly of the 'E' complex. Also acts as a component of the minor spliceosome, which is involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB , UniProt , Accession A0A087XIS6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 394 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	52.2	Low	248 Å²	248	114.7 Å²	114.7	100%	1.222	68%	0.676	S	S	*	*				0	130.4	0	-91.1	154.6	172.2	0	0	108.1
2	A	38.3	Very low	54.6	Low	104 Å²	104	111.3 Å²	111.3	86%	0.86	65%	0.652	S	S	*	*			trans	-71.6	127.6	-170.1	0	0	0	0	0	111.1	G4	A2-G4 PolarHBondContact O-N 3.22Å; A2-G4 VanDerWaalsContact O-N 3.09Å
3	A	44.8	Very low	57.1	Low	103 Å²	103	102.7 Å²	102.7	85%	0.851	60%	0.602	S	S	*	*			trans	-70.6	98.5	167.6	0	0	0	0	0	108.4
4	G	38.6	Very low	59.4	Low	49 Å²	49	96.1 Å²	96.1	51%	0.505	56%	0.563	S	S	.	*			trans	-62.9	161.6	170.7	0	0	0	0	0	112	A2 I6	A2-G4 PolarHBondContact O-N 3.22Å; A2-G4 VanDerWaalsContact O-N 3.09Å; G4-I6 PolarHBondContact O-N 3.42Å
5	P	43.5	Very low	61.5	Low	95 Å²	95	89.7 Å²	89.7	62%	0.617	53%	0.526	S	S	*	.			trans	-59.4	133.8	-178	26.2	-33.2	0	0	0	110.7	S7	P5-S7 PolarHBondContact O-N 3.48Å
6	I	54.5	Low	63.4	Low	135 Å²	135	86.1 Å²	86.1	69%	0.692	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-52.9	-11.4	176.1	42.6	164.2	0	0	0	115.1	G4	G4-I6 PolarHBondContact O-N 3.42Å
7	S	50.3	Low	65	Low	101 Å²	101	81 Å²	81	71%	0.706	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-84	-15.3	-172.1	48.6	0	0	0	0	115	P5	P5-S7 PolarHBondContact O-N 3.48Å
8	E	54.5	Low	66.3	Low	176 Å²	176	76.6 Å²	76.6	82%	0.822	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-118.1	22.9	-177.3	-148	125.8	80.5	0	0	112.5
9	R	62.7	Low	67.4	Low	68 Å²	68	74.4 Å²	74.4	26%	0.257	44%	0.442	S	S	.	.			trans	-76.5	127.8	170.6	-62.7	-174.3	-161.3	-173	2.2	107.8	Q11	R9-Q11 VanDerWaalsContact C-N 3.33Å; R9-Q11 PolarHBondContact O-N 3.06Å
10	N	75.4	Confident	68.6	Low	74 Å²	74	71.2 Å²	71.2	40%	0.396	42%	0.422	S	S	.	.			trans	-69.1	94.2	177.7	-173.6	-4.6	0	0	0	108.3	D12 A13 T14 E60	N10-D12 PolarHBondContact O-N 3.11Å; N10-D12 PolarHBondContact OD1-N 3.39Å; N10-A13 HydrophobicContact CB-CB 4.01Å; N10-A13 WeakPolarHBondContact ND2-CB 3.42Å; N10-A13 CarbonylContact O-C 3.58Å; N10-A13 PolarHBondContact O-N 3.33Å; N10-A13 VanDerWaalsContact O-N 3.1Å; N10-A13 PolarHBondContact OD1-N 3.15Å; N10-T14 WeakPolarHBondContact O-CB 3.38Å; N10-T14 PolarHBondContact O-N 3.3Å; N10-T14 PolarHBondContact O-OG1 3.38Å; N10-E60 PolarHBondContact N-OE1 2.96Å; N10-E60 VanDerWaalsContact N-OE1 3.14Å
11	Q	75.5	Confident	69.7	Low	109 Å²	109	68.8 Å²	68.8	51%	0.509	41%	0.408	S	S	.	.	S	Bend	trans	-63.6	-26.7	-175.6	-63.6	-146.6	-6.2	0	0	112.1	R9 T14 S90	R9-Q11 VanDerWaalsContact C-N 3.33Å; R9-Q11 PolarHBondContact O-N 3.06Å; Q11-T14 PolarHBondContact O-N 3.1Å; Q11-S90 PolarHBondContact O-OG 3.21Å
12	D	80.9	Confident	72.2	Confident	73 Å²	73	62.6 Å²	62.6	39%	0.39	38%	0.376	S	S	.	.	S	Bend	trans	-74.9	-31.7	176.7	-60.2	-65.5	0	0	0	112	N10 E64 K88	N10-D12 PolarHBondContact O-N 3.11Å; N10-D12 PolarHBondContact OD1-N 3.39Å; D12-E64 HydrophobicContact CB-CG 4.34Å; D12-K88 WeakPolarHBondContact O-CE 2.96Å
13	A	87.1	Confident	74.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	37%	0.366	C	S	.	.	S	Bend	trans	-90.8	4.8	169.8	0	0	0	0	0	113.8	N10 F61	N10-A13 HydrophobicContact CB-CB 4.01Å; N10-A13 WeakPolarHBondContact ND2-CB 3.42Å; N10-A13 CarbonylContact O-C 3.58Å; N10-A13 PolarHBondContact O-N 3.33Å; N10-A13 VanDerWaalsContact O-N 3.1Å; N10-A13 PolarHBondContact OD1-N 3.15Å; A13-F61 PolarHBondContact O-N 3.24Å
14	T	89.4	Confident	76.9	Confident	10 Å²	10	60 Å²	60	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.1	178.1	-56.2	0	0	0	0	110.6	N10 Q11 F58 V59 A89	N10-T14 WeakPolarHBondContact O-CB 3.38Å; N10-T14 PolarHBondContact O-N 3.3Å; N10-T14 PolarHBondContact O-OG1 3.38Å; Q11-T14 PolarHBondContact O-N 3.1Å; T14-F58 HydrophobicContact CG2-CB 3.99Å; T14-F58 HydrophobicContact CG2-CD1 4.3Å; T14-V59 CarbonylContact C-O 3.59Å; T14-V59 WeakPolarHBondContact CA-O 3.09Å; T14-A89 HydrophobicContact CG2-CB 3.76Å; T14-A89 WeakPolarHBondContact O-CB 3.48Å; T14-A89 PolarHBondContact O-N 3.42Å
15	V	91.2	Very high	79.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.1	172.5	-53.9	0	0	0	0	110.7	V17 F33 F58 V59 F61 A67 I71 V86 N87	V15-V17 HydrophobicContact CG2-CG2 4.21Å; V15-F33 HydrophobicContact CG2-CE1 4.29Å; V15-F58 CarbonylContact O-C 3.59Å; V15-F58 VanDerWaalsContact O-CA 3.28Å; V15-F58 WeakPolarHBondContact O-CA 3.29Å; V15-V59 HydrophobicContact CG2-CB 3.67Å; V15-V59 HydrophobicContact CG2-CG2 4.32Å; V15-V59 WeakPolarHBondContact CG2-O 3.48Å; V15-V59 PolarHBondContact N-O 2.65Å; V15-V59 PolarHBondContact O-N 3.17Å; V15-F61 HydrophobicContact CG1-CD2 4.13Å; V15-F61 HydrophobicContact CG1-CE2 3.98Å; V15-F61 HydrophobicContact CG2-CD2 4.32Å; V15-F61 HydrophobicContact CG2-CE2 3.72Å; V15-A67 HydrophobicContact CG1-CB 3.71Å; V15-I71 HydrophobicContact CB-CG1 4.39Å; V15-I71 HydrophobicContact CG1-CD1 3.94Å; V15-I71 HydrophobicContact CG1-CG1 3.76Å; V15-V86 HydrophobicContact CB-CG1 4.01Å; V15-V86 HydrophobicContact CG2-CG1 4.16Å; V15-N87 CarbonylContact C-O 3.5Å; V15-N87 WeakPolarHBondContact CA-O 3.49Å
16	Y	90.6	Very high	81.6	Confident	32 Å²	32	59.1 Å²	59.1	13%	0.125	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.5	166.2	170.7	-92.8	0	0	0	109.5	Y56 F58 V86 N87 H92	Y16-Y56 HydrophobicContact CD2-CD2 4.33Å; Y16-Y56 AromaticContact CE2-CD2 3.62Å; Y16-Y56 HydrophobicContact CE2-CD2 3.62Å; Y16-Y56 AromaticContact CE2-CG 3.81Å; Y16-Y56 HydrophobicContact CE2-CG 3.81Å; Y16-Y56 WeakPolarHBondContact OH-CB 3.25Å; Y16-F58 HydrophobicContact CD2-CD1 4.29Å; Y16-F58 AromaticContact CD2-CE1 3.69Å; Y16-F58 HydrophobicContact CD2-CE1 3.69Å; Y16-F58 HydrophobicContact CD2-CZ 4.01Å; Y16-F58 HydrophobicContact CG-CE1 4.47Å; Y16-V86 CarbonylContact O-C 3.51Å; Y16-V86 WeakPolarHBondContact O-CA 3.38Å; Y16-N87 HydrophobicContact CD1-CB 4.45Å; Y16-N87 PolarHBondContact N-O 2.9Å; Y16-N87 PolarHBondContact O-N 3.45Å; Y16-H92 AromaticContact CD1-ND1 3.72Å; Y16-H92 HydrophobicContact CD2-CB 4.36Å; Y16-H92 AromaticContact CD2-CD2 4Å; Y16-H92 AromaticContact CD2-CE1 3.88Å; Y16-H92 AromaticContact CD2-CG 3.74Å; Y16-H92 AromaticContact CD2-ND1 3.65Å; Y16-H92 AromaticContact CE1-CE1 3.68Å; Y16-H92 AromaticContact CE1-ND1 3.55Å; Y16-H92 AromaticContact CE2-CD2 3.85Å; Y16-H92 AromaticContact CE2-CE1 3.21Å; Y16-H92 WeakPolarHBondContact CE2-CE1 3.31Å; Y16-H92 AromaticContact CE2-CG 3.86Å; Y16-H92 AromaticContact CE2-ND1 3.46Å; Y16-H92 WeakPolarHBondContact CE2-ND1 3.07Å; Y16-H92 AromaticContact CE2-NE2 3.45Å; Y16-H92 WeakPolarHBondContact CE2-NE2 3.47Å; Y16-H92 HydrophobicContact CG-CB 4.33Å; Y16-H92 AromaticContact CG-ND1 3.77Å; Y16-H92 AromaticContact CZ-CE1 3.1Å; Y16-H92 AromaticContact CZ-ND1 3.41Å; Y16-H92 AromaticContact CZ-NE2 3.79Å; Y16-H92 PolarHBondContact OH-CE1 3.45Å; Y16-H92 VanDerWaalsContact OH-CE1 3.25Å
17	V	90.8	Very high	83.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.8	175.5	-169.3	0	0	0	0	108.6	V15 L20 L29 F33 Y56 G57 V59 I84 R85 V86	V15-V17 HydrophobicContact CG2-CG2 4.21Å; V17-L20 HydrophobicContact CG1-CD1 4.43Å; V17-L20 HydrophobicContact CG1-CD2 3.77Å; V17-L20 HydrophobicContact CG1-CG 4.3Å; V17-L29 HydrophobicContact CB-CD1 4.43Å; V17-L29 HydrophobicContact CG1-CD1 4.15Å; V17-F33 HydrophobicContact CB-CE2 4.46Å; V17-F33 HydrophobicContact CB-CZ 4.36Å; V17-F33 HydrophobicContact CG1-CE2 4.05Å; V17-F33 HydrophobicContact CG1-CZ 4.03Å; V17-F33 HydrophobicContact CG2-CE1 4.2Å; V17-F33 HydrophobicContact CG2-CE2 3.62Å; V17-F33 HydrophobicContact CG2-CZ 3.36Å; V17-Y56 CarbonylContact O-C 3.46Å; V17-Y56 WeakPolarHBondContact O-CA 3.36Å; V17-Y56 WeakPolarHBondContact O-CB 3.39Å; V17-G57 PolarHBondContact N-O 2.82Å; V17-G57 PolarHBondContact O-N 2.98Å; V17-V59 HydrophobicContact CG2-CG2 3.94Å; V17-I84 HydrophobicContact CG1-CB 4.33Å; V17-I84 HydrophobicContact CG1-CD1 4.48Å; V17-R85 CarbonylContact C-O 3.54Å; V17-R85 VanDerWaalsContact CA-O 3.27Å; V17-R85 WeakPolarHBondContact CA-O 3.32Å; V17-V86 HydrophobicContact CG1-CG2 4.41Å
18	G	89.5	Confident	85.5	Confident	1 Å²	1	54 Å²	54	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	171.3	179.1	0	0	0	0	0	113.1	L20 R85	G18-L20 VanDerWaalsContact C-N 3.32Å; G18-R85 PolarHBondContact N-O 3.47Å; G18-R85 PolarHBondContact O-N 3.45Å
19	G	86.9	Confident	87.2	Confident	36 Å²	36	45.7 Å²	45.7	37%	0.371	24%	0.238	S	C	.	.			trans	75	23.2	179.5	0	0	0	0	0	113.6	G55	G19-G55 PolarHBondContact N-O 3.26Å; G19-G55 VanDerWaalsContact N-O 3.11Å
20	L	91.1	Very high	88.6	Confident	10 Å²	10	48.1 Å²	48.1	5%	0.052	25%	0.247	C	C	.	.			trans	-73.6	135.6	179.7	-59.2	175.7	0	0	0	110.7	V17 G18 V24 L29 M44 G55 L79 I84	V17-L20 HydrophobicContact CG1-CD1 4.43Å; V17-L20 HydrophobicContact CG1-CD2 3.77Å; V17-L20 HydrophobicContact CG1-CG 4.3Å; G18-L20 VanDerWaalsContact C-N 3.32Å; L20-V24 HydrophobicContact CB-CB 4.44Å; L20-V24 HydrophobicContact CD2-CG1 4.32Å; L20-L29 HydrophobicContact CD1-CD1 3.48Å; L20-L29 VanDerWaalsContact CD1-CD1 3.48Å; L20-L29 HydrophobicContact CD2-CD1 3.76Å; L20-L29 HydrophobicContact CG-CD1 4.29Å; L20-M44 HydrophobicContact CD1-CE 3.7Å; L20-G55 PolarHBondContact N-O 2.67Å; L20-L79 HydrophobicContact CD2-CD1 4.33Å; L20-I84 HydrophobicContact CD2-CB 4.42Å; L20-I84 HydrophobicContact CD2-CG2 3.77Å
21	D	91.5	Very high	89.4	Confident	21 Å²	21	50 Å²	50	11%	0.112	25%	0.253	C	S	.	.			trans	-72.5	147.7	171.7	-168.1	-103.5	0	0	0	111.1	K23 V24 H53 Y80 K82	D21-K23 PolarHBondContact O-N 3.06Å; D21-K23 WeakPolarHBondContact OD1-CB 3.47Å; D21-K23 WeakPolarHBondContact OD1-CG 3.39Å; D21-K23 PolarHBondContact OD1-N 2.98Å; D21-V24 HydrophobicContact CB-CG2 4.21Å; D21-V24 VanDerWaalsContact O-CB 3.26Å; D21-V24 WeakPolarHBondContact O-CB 3.28Å; D21-V24 VanDerWaalsContact O-CG2 3.29Å; D21-V24 WeakPolarHBondContact O-CG2 3.47Å; D21-V24 PolarHBondContact O-N 3.31Å; D21-H53 PolarHBondContact O-CE1 2.93Å; D21-H53 PolarHBondContact O-NE2 3.06Å; D21-Y80 HydrophobicContact CB-CD2 4.29Å; D21-K82 HydrophobicContact CB-CD 3.98Å; D21-K82 WeakPolarHBondContact OD2-CD 3.29Å; D21-K82 WeakPolarHBondContact OD2-CE 3.41Å; D21-K82 IonicContact OD2-NZ 2.98Å; D21-K82 PolarHBondContact OD2-NZ 3.24Å
22	E	89.2	Confident	90.2	Very high	117 Å²	117	46.5 Å²	46.5	55%	0.547	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-24.3	-179.5	-166	178.9	101.4	0	0	114.3	V24 Q52 H53	E22-V24 VanDerWaalsContact C-N 3.3Å; E22-Q52 PolarHBondContact OE1-NE2 3.1Å; E22-Q52 PolarHBondContact OE2-NE2 3.33Å; E22-H53 WeakPolarHBondContact CA-CE1 3.42Å; E22-H53 VanDerWaalsContact CA-NE2 3.26Å; E22-H53 WeakPolarHBondContact CA-NE2 3.42Å; E22-H53 PolarHBondContact O-NE2 2.65Å; E22-H53 VanDerWaalsContact O-NE2 3.08Å
23	K	89.7	Confident	90.7	Very high	151 Å²	151	43 Å²	43	66%	0.657	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.9	178.2	-62.8	176	-177.6	176.4	0	113.5	D21 S25 Y80	D21-K23 PolarHBondContact O-N 3.06Å; D21-K23 WeakPolarHBondContact OD1-CB 3.47Å; D21-K23 WeakPolarHBondContact OD1-CG 3.39Å; D21-K23 PolarHBondContact OD1-N 2.98Å; K23-S25 PolarHBondContact O-N 2.85Å; K23-Y80 HydrophobicContact CB-CD1 4.42Å; K23-Y80 HydrophobicContact CB-CD2 4.13Å; K23-Y80 HydrophobicContact CB-CE1 4.3Å; K23-Y80 HydrophobicContact CB-CE2 3.99Å; K23-Y80 HydrophobicContact CB-CG 4.34Å; K23-Y80 HydrophobicContact CD-CD1 4.39Å
24	V	91.6	Very high	90.9	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	24%	0.237	C	C	.	.			trans	-72.9	125.7	-177.6	176.3	0	0	0	0	109.6	L20 D21 E22 L28 L29 M44 H53 L79 Y80	L20-V24 HydrophobicContact CB-CB 4.44Å; L20-V24 HydrophobicContact CD2-CG1 4.32Å; D21-V24 HydrophobicContact CB-CG2 4.21Å; D21-V24 VanDerWaalsContact O-CB 3.26Å; D21-V24 WeakPolarHBondContact O-CB 3.28Å; D21-V24 VanDerWaalsContact O-CG2 3.29Å; D21-V24 WeakPolarHBondContact O-CG2 3.47Å; D21-V24 PolarHBondContact O-N 3.31Å; E22-V24 VanDerWaalsContact C-N 3.3Å; V24-L28 HydrophobicContact CG1-CD2 4.44Å; V24-L29 HydrophobicContact CG1-CD1 4.34Å; V24-M44 HydrophobicContact CB-CE 4.42Å; V24-M44 HydrophobicContact CG1-CE 4.24Å; V24-H53 PolarHBondContact O-CD2 3.23Å; V24-H53 PolarHBondContact O-NE2 3.16Å; V24-H53 VanDerWaalsContact O-NE2 3.09Å; V24-L79 HydrophobicContact CG1-CD1 4.41Å; V24-L79 HydrophobicContact CG2-CB 4.25Å; V24-L79 HydrophobicContact CG2-CD1 4.16Å; V24-Y80 HydrophobicContact CG2-CD2 3.7Å; V24-Y80 HydrophobicContact CG2-CE2 3.87Å
25	S	91.6	Very high	91	Very high	53 Å²	53	53.4 Å²	53.4	37%	0.371	27%	0.269	S	S	.	.			trans	-97.4	156.3	175	71.7	0	0	0	0	111.2	K23 L28 L29	K23-S25 PolarHBondContact O-N 2.85Å; S25-L28 WeakPolarHBondContact O-CB 3.42Å; S25-L28 PolarHBondContact O-N 3.19Å; S25-L28 WeakPolarHBondContact OG-CB 3.29Å; S25-L28 PolarHBondContact OG-N 3.23Å; S25-L29 PolarHBondContact O-N 2.62Å; S25-L29 VanDerWaalsContact O-N 3.09Å
26	E	90.5	Very high	90.9	Very high	71 Å²	71	53.9 Å²	53.9	33%	0.332	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-41.1	175.3	179	-172	160.7	0	0	113.1	L28 L29 W30 T42 M44 K46	E26-L28 PolarHBondContact O-N 3.4Å; E26-L29 WeakPolarHBondContact O-CB 3.2Å; E26-L29 PolarHBondContact O-N 3.16Å; E26-W30 PolarHBondContact O-N 3.31Å; E26-T42 HydrophobicContact CG-CG2 3.95Å; E26-M44 HydrophobicContact CB-CB 4.27Å; E26-M44 HydrophobicContact CB-SD 4.38Å; E26-M44 HydrophobicContact CG-CB 4.41Å; E26-K46 IonicContact OE2-NZ 2.71Å
27	P	92.3	Very high	90.9	Very high	78 Å²	78	52.9 Å²	52.9	51%	0.506	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-40.7	172.9	-24.1	34.8	0	0	0	113.3	L29 W30 E31	P27-L29 VanDerWaalsContact C-N 3.26Å; P27-L29 PolarHBondContact O-N 2.89Å; P27-W30 WeakPolarHBondContact O-CB 3.5Å; P27-W30 PolarHBondContact O-N 3.34Å; P27-E31 WeakPolarHBondContact O-CG 3.17Å; P27-E31 PolarHBondContact O-N 3.25Å
28	L	92.4	Very high	91	Very high	51 Å²	51	56.1 Å²	56.1	27%	0.267	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-39.6	177.5	-177.6	70.2	0	0	0	111.1	V24 S25 E26 L32 Y80	V24-L28 HydrophobicContact CG1-CD2 4.44Å; S25-L28 WeakPolarHBondContact O-CB 3.42Å; S25-L28 PolarHBondContact O-N 3.19Å; S25-L28 WeakPolarHBondContact OG-CB 3.29Å; S25-L28 PolarHBondContact OG-N 3.23Å; E26-L28 PolarHBondContact O-N 3.4Å; L28-L32 WeakPolarHBondContact O-CB 3.32Å; L28-L32 PolarHBondContact O-N 3.1Å; L28-Y80 HydrophobicContact CD2-CE2 3.87Å
29	L	91.6	Very high	91.1	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-66.4	-43.3	176.9	-161.1	126.2	0	0	0	110.8	V17 L20 V24 S25 E26 P27 L32 F33 T42 V59	V17-L29 HydrophobicContact CB-CD1 4.43Å; V17-L29 HydrophobicContact CG1-CD1 4.15Å; L20-L29 HydrophobicContact CD1-CD1 3.48Å; L20-L29 VanDerWaalsContact CD1-CD1 3.48Å; L20-L29 HydrophobicContact CD2-CD1 3.76Å; L20-L29 HydrophobicContact CG-CD1 4.29Å; V24-L29 HydrophobicContact CG1-CD1 4.34Å; S25-L29 PolarHBondContact O-N 2.62Å; S25-L29 VanDerWaalsContact O-N 3.09Å; E26-L29 WeakPolarHBondContact O-CB 3.2Å; E26-L29 PolarHBondContact O-N 3.16Å; P27-L29 VanDerWaalsContact C-N 3.26Å; P27-L29 PolarHBondContact O-N 2.89Å; L29-L32 PolarHBondContact O-N 3.06Å; L29-F33 HydrophobicContact CD2-CD2 4.18Å; L29-F33 HydrophobicContact CD2-CE2 4.32Å; L29-F33 HydrophobicContact CG-CD2 4.04Å; L29-F33 HydrophobicContact CG-CE2 4.06Å; L29-F33 VanDerWaalsContact O-CD2 3.28Å; L29-F33 WeakPolarHBondContact O-CD2 3.43Å; L29-F33 PolarHBondContact O-N 2.97Å; L29-F33 VanDerWaalsContact O-N 3.1Å; L29-T42 HydrophobicContact CD2-CG2 3.46Å; L29-T42 VanDerWaalsContact CD2-CG2 3.46Å; L29-V59 HydrophobicContact CD2-CG2 3.18Å; L29-V59 HydrophobicContact CG-CG2 4.42Å
30	W	91.8	Very high	91.4	Very high	119 Å²	119	59.6 Å²	59.6	45%	0.451	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-52.4	173.2	-178.5	65.3	0	0	0	111.8	E26 P27 L32 F33 L34	E26-W30 PolarHBondContact O-N 3.31Å; P27-W30 WeakPolarHBondContact O-CB 3.5Å; P27-W30 PolarHBondContact O-N 3.34Å; W30-L32 VanDerWaalsContact C-N 3.3Å; W30-L32 PolarHBondContact O-N 3.13Å; W30-F33 PolarHBondContact O-N 3.48Å; W30-L34 VanDerWaalsContact CD1-CD1 3.41Å; W30-L34 HydrophobicContact CD2-CD1 3.67Å; W30-L34 HydrophobicContact CE3-CD1 4.49Å; W30-L34 HydrophobicContact CG-CD1 3.69Å; W30-L34 HydrophobicContact CH2-CD2 4.4Å; W30-L34 HydrophobicContact CZ2-CD1 4Å; W30-L34 HydrophobicContact CZ2-CD2 4.14Å; W30-L34 WeakPolarHBondContact O-CD1 3.49Å; W30-L34 PolarHBondContact O-N 3.16Å
31	E	92.1	Very high	91.2	Very high	113 Å²	113	62.4 Å²	62.4	53%	0.528	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-38.9	179.4	-71.4	177	145.6	0	0	113.2	P27	P27-E31 WeakPolarHBondContact O-CG 3.17Å; P27-E31 PolarHBondContact O-N 3.25Å
32	L	91.4	Very high	91.2	Very high	37 Å²	37	61.9 Å²	61.9	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-49.3	177	-179.6	67	0	0	0	111.5	L28 L29 W30 L34 Q35 M74 L79 I84	L28-L32 WeakPolarHBondContact O-CB 3.32Å; L28-L32 PolarHBondContact O-N 3.1Å; L29-L32 PolarHBondContact O-N 3.06Å; W30-L32 VanDerWaalsContact C-N 3.3Å; W30-L32 PolarHBondContact O-N 3.13Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.43Å; L32-Q35 WeakPolarHBondContact O-CB 3.45Å; L32-Q35 PolarHBondContact O-N 2.77Å; L32-M74 HydrophobicContact CD1-SD 4.41Å; L32-M74 HydrophobicContact CG-SD 4.36Å; L32-M74 WeakPolarHBondContact O-CE 3.45Å; L32-L79 HydrophobicContact CD2-CD1 3.94Å; L32-L79 HydrophobicContact CD2-CD2 4.16Å; L32-L79 HydrophobicContact CD2-CG 4.34Å; L32-I84 HydrophobicContact CD2-CD1 3.88Å
33	F	92.1	Very high	91.2	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-76.4	-19	-176.7	-79.8	-85.2	0	0	0	113.2	V15 V17 L29 W30 Q35 A36 G37 V39 V59 F61 A70 M74 I84 V86	V15-F33 HydrophobicContact CG2-CE1 4.29Å; V17-F33 HydrophobicContact CB-CE2 4.46Å; V17-F33 HydrophobicContact CB-CZ 4.36Å; V17-F33 HydrophobicContact CG1-CE2 4.05Å; V17-F33 HydrophobicContact CG1-CZ 4.03Å; V17-F33 HydrophobicContact CG2-CE1 4.2Å; V17-F33 HydrophobicContact CG2-CE2 3.62Å; V17-F33 HydrophobicContact CG2-CZ 3.36Å; L29-F33 HydrophobicContact CD2-CD2 4.18Å; L29-F33 HydrophobicContact CD2-CE2 4.32Å; L29-F33 HydrophobicContact CG-CD2 4.04Å; L29-F33 HydrophobicContact CG-CE2 4.06Å; L29-F33 VanDerWaalsContact O-CD2 3.28Å; L29-F33 WeakPolarHBondContact O-CD2 3.43Å; L29-F33 PolarHBondContact O-N 2.97Å; L29-F33 VanDerWaalsContact O-N 3.1Å; W30-F33 PolarHBondContact O-N 3.48Å; F33-Q35 PolarHBondContact O-N 3.08Å; F33-A36 WeakPolarHBondContact O-CB 3.42Å; F33-A36 PolarHBondContact O-N 3.38Å; F33-G37 PolarHBondContact O-N 3.19Å; F33-V39 HydrophobicContact CB-CG2 4Å; F33-V59 HydrophobicContact CB-CG1 4.08Å; F33-V59 HydrophobicContact CD2-CG2 4Å; F33-V59 HydrophobicContact CE2-CG2 4.31Å; F33-V59 HydrophobicContact CG-CG1 4.32Å; F33-V59 HydrophobicContact CG-CG2 4.22Å; F33-F61 HydrophobicContact CB-CZ 4.1Å; F33-F61 HydrophobicContact CD1-CE2 4.26Å; F33-F61 AromaticContact CD1-CZ 3.81Å; F33-F61 HydrophobicContact CD1-CZ 3.81Å; F33-F61 HydrophobicContact CG-CZ 4.39Å; F33-A70 HydrophobicContact CD1-CB 4.26Å; F33-A70 HydrophobicContact CE1-CB 4.45Å; F33-M74 HydrophobicContact CD1-CB 4.38Å; F33-M74 HydrophobicContact CD1-CG 4.06Å; F33-M74 HydrophobicContact CE1-CB 3.74Å; F33-M74 HydrophobicContact CE1-CG 3.94Å; F33-M74 HydrophobicContact CZ-CB 4.16Å; F33-I84 HydrophobicContact CZ-CD1 4.44Å; F33-V86 HydrophobicContact CE1-CG1 4.02Å; F33-V86 HydrophobicContact CE1-CG2 4.12Å; F33-V86 HydrophobicContact CZ-CG1 4.26Å; F33-V86 HydrophobicContact CZ-CG2 3.73Å
34	L	92.5	Very high	91.2	Very high	70 Å²	70	53.2 Å²	53.2	37%	0.366	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-27.7	168.1	-105.2	77.7	0	0	0	113	W30 L32 A36 V39	W30-L34 VanDerWaalsContact CD1-CD1 3.41Å; W30-L34 HydrophobicContact CD2-CD1 3.67Å; W30-L34 HydrophobicContact CE3-CD1 4.49Å; W30-L34 HydrophobicContact CG-CD1 3.69Å; W30-L34 HydrophobicContact CH2-CD2 4.4Å; W30-L34 HydrophobicContact CZ2-CD1 4Å; W30-L34 HydrophobicContact CZ2-CD2 4.14Å; W30-L34 WeakPolarHBondContact O-CD1 3.49Å; W30-L34 PolarHBondContact O-N 3.16Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.43Å; L34-A36 VanDerWaalsContact C-N 3.26Å; L34-A36 PolarHBondContact O-N 2.97Å; L34-V39 HydrophobicContact CD1-CB 4Å; L34-V39 HydrophobicContact CD1-CG2 3.96Å
35	Q	90	Very high	91.1	Very high	157 Å²	157	54.2 Å²	54.2	73%	0.734	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21	176.9	-56.6	-57.1	-63.6	0	0	112.7	L32 F33 M74	L32-Q35 WeakPolarHBondContact O-CB 3.45Å; L32-Q35 PolarHBondContact O-N 2.77Å; F33-Q35 PolarHBondContact O-N 3.08Å; Q35-M74 HydrophobicContact CB-CE 3.86Å
36	A	89.7	Confident	91	Very high	10 Å²	10	56.5 Å²	56.5	8%	0.083	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-35.7	177.4	0	0	0	0	0	112.6	F33 L34 Y69 A70 I73 M74	F33-A36 WeakPolarHBondContact O-CB 3.42Å; F33-A36 PolarHBondContact O-N 3.38Å; L34-A36 VanDerWaalsContact C-N 3.26Å; L34-A36 PolarHBondContact O-N 2.97Å; A36-Y69 WeakPolarHBondContact O-CD1 3.28Å; A36-A70 HydrophobicContact CB-CB 3.74Å; A36-I73 HydrophobicContact CB-CD1 3.82Å; A36-I73 HydrophobicContact CB-CG1 4.38Å; A36-M74 HydrophobicContact CB-CE 3.72Å; A36-M74 HydrophobicContact CB-CG 4.12Å
37	G	91.3	Very high	90.9	Very high	11 Å²	11	56 Å²	56	11%	0.113	29%	0.291	C	S	.	.	S	Bend	trans	177.9	174.1	-178.2	0	0	0	0	0	113.4	F33 V39	F33-G37 PolarHBondContact O-N 3.19Å; G37-V39 PolarHBondContact O-N 3.04Å
38	P	92.8	Very high	90.7	Very high	69 Å²	69	64 Å²	64	45%	0.448	31%	0.311	S	S	.	.			trans	-66.7	113.3	178.7	26.4	-33	0	0	0	111.7	L62	P38-L62 HydrophobicContact CB-CB 4.4Å; P38-L62 HydrophobicContact CG-CB 4.04Å; P38-L62 HydrophobicContact CG-CD2 4.36Å; P38-L62 PolarHBondContact O-N 3.29Å; P38-L62 VanDerWaalsContact O-N 3.09Å
39	V	91.9	Very high	90.6	Very high	22 Å²	22	67.9 Å²	67.9	13%	0.133	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	126.6	178.8	-179.2	0	0	0	0	110.6	F33 L34 G37 V59 F61	F33-V39 HydrophobicContact CB-CG2 4Å; L34-V39 HydrophobicContact CD1-CB 4Å; L34-V39 HydrophobicContact CD1-CG2 3.96Å; G37-V39 PolarHBondContact O-N 3.04Å; V39-V59 HydrophobicContact CB-CG1 4.34Å; V39-V59 HydrophobicContact CG1-CG1 3.49Å; V39-V59 VanDerWaalsContact CG1-CG1 3.49Å; V39-V59 HydrophobicContact CG2-CG1 3.88Å; V39-F61 HydrophobicContact CG2-CD1 4.19Å; V39-F61 HydrophobicContact CG2-CE1 3.77Å; V39-F61 HydrophobicContact CG2-CZ 4.3Å
40	V	91.3	Very high	90.4	Very high	87 Å²	87	72 Å²	72	53%	0.527	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-46.3	177.4	176.6	0	0	0	0	110.7	E60 L62	V40-E60 HydrophobicContact CB-CG 4.48Å; V40-E60 PolarHBondContact N-O 3.35Å; V40-L62 HydrophobicContact CG2-CB 4.01Å; V40-L62 HydrophobicContact CG2-CD1 3.95Å
41	N	87.8	Confident	90	Very high	69 Å²	69	68.7 Å²	68.7	37%	0.369	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144	-174.7	-176	44	0	0	0	111.2	E60	N41-E60 HydrophobicContact CB-CB 4.22Å; N41-E60 PolarHBondContact N-O 3.36Å; N41-E60 PolarHBondContact O-N 2.98Å
42	T	90.7	Very high	89.8	Confident	11 Å²	11	67 Å²	67	7%	0.067	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.3	172.9	-57.9	0	0	0	0	107.9	E26 L29 F58 V59	E26-T42 HydrophobicContact CG-CG2 3.95Å; L29-T42 HydrophobicContact CD2-CG2 3.46Å; L29-T42 VanDerWaalsContact CD2-CG2 3.46Å; T42-F58 CarbonylContact C-O 3.58Å; T42-F58 WeakPolarHBondContact CA-O 3.38Å; T42-V59 HydrophobicContact CG2-CG2 4.29Å
43	H	89.6	Confident	89.7	Confident	76 Å²	76	66.2 Å²	66.2	35%	0.352	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	111.3	-179.7	-177.7	-100.1	0	0	0	110.2	P45 G57 F58	H43-P45 WeakPolarHBondContact O-CD 3.47Å; H43-G57 CarbonylContact O-C 3.39Å; H43-G57 WeakPolarHBondContact O-CA 3.42Å; H43-F58 PolarHBondContact N-O 3.31Å; H43-F58 PolarHBondContact O-N 3.2Å
44	M	90.1	Very high	89.4	Confident	10 Å²	10	71.6 Å²	71.6	5%	0.049	38%	0.377	C	S	.	.			trans	-111.8	103.6	178.6	-165.7	-174.6	-151.7	0	0	109.8	L20 V24 E26 K46 H53	L20-M44 HydrophobicContact CD1-CE 3.7Å; V24-M44 HydrophobicContact CB-CE 4.42Å; V24-M44 HydrophobicContact CG1-CE 4.24Å; E26-M44 HydrophobicContact CB-CB 4.27Å; E26-M44 HydrophobicContact CB-SD 4.38Å; E26-M44 HydrophobicContact CG-CB 4.41Å; M44-K46 PolarHBondContact O-N 3.24Å; M44-K46 VanDerWaalsContact O-N 3.17Å; M44-H53 HydrophobicContact CE-CB 3.52Å; M44-H53 WeakPolarHBondContact CE-CD2 3.45Å; M44-H53 HydrophobicContact CG-CB 3.86Å; M44-H53 HydrophobicContact SD-CB 3.65Å
45	P	88.8	Confident	89.1	Confident	23 Å²	23	69.1 Å²	69.1	15%	0.149	37%	0.369	C	S	.	.			trans	-60.2	119.9	176.2	-24.8	35.8	0	0	0	111.1	H43 H53 Q54 Y56 F58	H43-P45 WeakPolarHBondContact O-CD 3.47Å; P45-H53 WeakPolarHBondContact O-CA 2.98Å; P45-Q54 PolarHBondContact O-N 2.94Å; P45-Y56 HydrophobicContact CB-CE2 4.4Å; P45-Y56 HydrophobicContact CG-CD2 4.48Å; P45-Y56 HydrophobicContact CG-CE2 3.74Å; P45-F58 HydrophobicContact CG-CE2 4.35Å
46	K	89.8	Confident	89.2	Confident	102 Å²	102	64.2 Å²	64.2	44%	0.443	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-110.4	139.4	175	-64	173.1	-167.2	167.9	0	109.6	E26 M44 R48 Q52 H53	E26-K46 IonicContact OE2-NZ 2.71Å; M44-K46 PolarHBondContact O-N 3.24Å; M44-K46 VanDerWaalsContact O-N 3.17Å; K46-R48 PolarHBondContact O-N 2.98Å; K46-Q52 CarbonylContact C-O 3.55Å; K46-Q52 WeakPolarHBondContact CA-O 3.03Å; K46-H53 HydrophobicContact CG-CB 3.95Å
47	D	89.8	Confident	89.3	Confident	59 Å²	59	63.8 Å²	63.8	32%	0.316	34%	0.34	S	S	.	.			trans	-61	127.3	170.2	176.3	3.1	0	0	0	108.9	V49 T50 G51 Q52	D47-V49 PolarHBondContact O-N 3.5Å; D47-V49 PolarHBondContact OD1-N 3.15Å; D47-T50 VanDerWaalsContact CB-OG1 3.3Å; D47-T50 WeakPolarHBondContact CB-OG1 3.15Å; D47-T50 VanDerWaalsContact CG-OG1 3.23Å; D47-T50 WeakPolarHBondContact OD2-CG2 3.24Å; D47-T50 PolarHBondContact OD2-OG1 3.33Å; D47-G51 WeakPolarHBondContact O-CA 3.09Å; D47-G51 PolarHBondContact O-N 3.37Å; D47-Q52 PolarHBondContact N-O 2.86Å
48	R	86.8	Confident	89.3	Confident	248 Å²	248	65.5 Å²	65.5	94%	0.936	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-24	-177.1	-171.1	174.6	-179.7	-178.3	1	112.6	K46	K46-R48 PolarHBondContact O-N 2.98Å
49	V	89.9	Confident	89.3	Confident	132 Å²	132	62.2 Å²	62.2	80%	0.8	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-50.6	-178.2	-177.1	0	0	0	0	110.7	D47	D47-V49 PolarHBondContact O-N 3.5Å; D47-V49 PolarHBondContact OD1-N 3.15Å
50	T	87.7	Confident	89.3	Confident	86 Å²	86	62.5 Å²	62.5	53%	0.528	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-16.2	-174.6	60.9	0	0	0	0	113.4	D47 Q52	D47-T50 VanDerWaalsContact CB-OG1 3.3Å; D47-T50 WeakPolarHBondContact CB-OG1 3.15Å; D47-T50 VanDerWaalsContact CG-OG1 3.23Å; D47-T50 WeakPolarHBondContact OD2-CG2 3.24Å; D47-T50 PolarHBondContact OD2-OG1 3.33Å; T50-Q52 PolarHBondContact O-N 3.01Å; T50-Q52 VanDerWaalsContact O-N 3.13Å; T50-Q52 PolarHBondContact OG1-N 3.35Å
51	G	84.6	Confident	89.4	Confident	50 Å²	50	58.5 Å²	58.5	52%	0.515	30%	0.299	S	S	.	.			trans	70.4	-3.4	-173.4	0	0	0	0	0	114	D47	D47-G51 WeakPolarHBondContact O-CA 3.09Å; D47-G51 PolarHBondContact O-N 3.37Å
52	Q	86.3	Confident	89.5	Confident	77 Å²	77	61.1 Å²	61.1	36%	0.36	31%	0.312	S	S	.	.			trans	-76.5	141.7	-179.4	-59.4	-83.5	39.4	0	0	109.5	E22 K46 D47 T50	E22-Q52 PolarHBondContact OE1-NE2 3.1Å; E22-Q52 PolarHBondContact OE2-NE2 3.33Å; K46-Q52 CarbonylContact C-O 3.55Å; K46-Q52 WeakPolarHBondContact CA-O 3.03Å; D47-Q52 PolarHBondContact N-O 2.86Å; T50-Q52 PolarHBondContact O-N 3.01Å; T50-Q52 VanDerWaalsContact O-N 3.13Å; T50-Q52 PolarHBondContact OG1-N 3.35Å
53	H	89.3	Confident	89.4	Confident	21 Å²	21	62.4 Å²	62.4	10%	0.097	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-74.4	152.5	172.2	61.5	63.8	0	0	0	111.3	D21 E22 V24 M44 P45 K46 G55	D21-H53 PolarHBondContact O-CE1 2.93Å; D21-H53 PolarHBondContact O-NE2 3.06Å; E22-H53 WeakPolarHBondContact CA-CE1 3.42Å; E22-H53 VanDerWaalsContact CA-NE2 3.26Å; E22-H53 WeakPolarHBondContact CA-NE2 3.42Å; E22-H53 PolarHBondContact O-NE2 2.65Å; E22-H53 VanDerWaalsContact O-NE2 3.08Å; V24-H53 PolarHBondContact O-CD2 3.23Å; V24-H53 PolarHBondContact O-NE2 3.16Å; V24-H53 VanDerWaalsContact O-NE2 3.09Å; M44-H53 HydrophobicContact CE-CB 3.52Å; M44-H53 WeakPolarHBondContact CE-CD2 3.45Å; M44-H53 HydrophobicContact CG-CB 3.86Å; M44-H53 HydrophobicContact SD-CB 3.65Å; P45-H53 WeakPolarHBondContact O-CA 2.98Å; K46-H53 HydrophobicContact CG-CB 3.95Å; H53-G55 PolarHBondContact ND1-N 3.2Å; H53-G55 PolarHBondContact O-N 2.84Å; H53-G55 VanDerWaalsContact O-N 3.07Å
54	Q	86.4	Confident	89.4	Confident	113 Å²	113	62.9 Å²	62.9	53%	0.528	32%	0.324	S	S	.	.			trans	-78.5	9.9	-176.2	-62.7	-173.2	-8.1	0	0	114.5	P45 Y56	P45-Q54 PolarHBondContact O-N 2.94Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Q54-Y56 HydrophobicContact CB-CD1 3.79Å; Q54-Y56 HydrophobicContact CB-CE1 3.34Å; Q54-Y56 HydrophobicContact CG-CE1 4.34Å; Q54-Y56 VanDerWaalsContact OE1-CE1 3.27Å; Q54-Y56 PolarHBondContact OE1-OH 3.32Å
55	G	87.6	Confident	89.4	Confident	19 Å²	19	69.9 Å²	69.9	20%	0.196	36%	0.356	C	S	.	.	S	Bend	trans	82.7	13	179.1	0	0	0	0	0	113.6	G19 L20 H53	G19-G55 PolarHBondContact N-O 3.26Å; G19-G55 VanDerWaalsContact N-O 3.11Å; L20-G55 PolarHBondContact N-O 2.67Å; H53-G55 PolarHBondContact ND1-N 3.2Å; H53-G55 PolarHBondContact O-N 2.84Å; H53-G55 VanDerWaalsContact O-N 3.07Å
56	Y	90.8	Very high	89.5	Confident	54 Å²	54	70.8 Å²	70.8	21%	0.212	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	162.6	172.1	69	-84.6	0	0	0	111.4	Y16 V17 P45 Q54 F58	Y16-Y56 HydrophobicContact CD2-CD2 4.33Å; Y16-Y56 AromaticContact CE2-CD2 3.62Å; Y16-Y56 HydrophobicContact CE2-CD2 3.62Å; Y16-Y56 AromaticContact CE2-CG 3.81Å; Y16-Y56 HydrophobicContact CE2-CG 3.81Å; Y16-Y56 WeakPolarHBondContact OH-CB 3.25Å; V17-Y56 CarbonylContact O-C 3.46Å; V17-Y56 WeakPolarHBondContact O-CA 3.36Å; V17-Y56 WeakPolarHBondContact O-CB 3.39Å; P45-Y56 HydrophobicContact CB-CE2 4.4Å; P45-Y56 HydrophobicContact CG-CD2 4.48Å; P45-Y56 HydrophobicContact CG-CE2 3.74Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Q54-Y56 HydrophobicContact CB-CD1 3.79Å; Q54-Y56 HydrophobicContact CB-CE1 3.34Å; Q54-Y56 HydrophobicContact CG-CE1 4.34Å; Q54-Y56 VanDerWaalsContact OE1-CE1 3.27Å; Q54-Y56 PolarHBondContact OE1-OH 3.32Å; Y56-F58 AromaticContact CD2-CE2 3.95Å; Y56-F58 HydrophobicContact CD2-CE2 3.95Å; Y56-F58 HydrophobicContact CD2-CZ 4.25Å; Y56-F58 AromaticContact CE2-CE2 3.68Å; Y56-F58 HydrophobicContact CE2-CE2 3.68Å; Y56-F58 HydrophobicContact CE2-CZ 4.1Å
57	G	91.6	Very high	89.5	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	170.9	176.5	0	0	0	0	0	111.2	V17 H43	V17-G57 PolarHBondContact N-O 2.82Å; V17-G57 PolarHBondContact O-N 2.98Å; H43-G57 CarbonylContact O-C 3.39Å; H43-G57 WeakPolarHBondContact O-CA 3.42Å
58	F	92.1	Very high	89.5	Confident	47 Å²	47	65.6 Å²	65.6	21%	0.206	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.3	176	-60.6	-86.5	0	0	0	109.2	T14 V15 Y16 T42 H43 P45 Y56 A89	T14-F58 HydrophobicContact CG2-CB 3.99Å; T14-F58 HydrophobicContact CG2-CD1 4.3Å; V15-F58 CarbonylContact O-C 3.59Å; V15-F58 VanDerWaalsContact O-CA 3.28Å; V15-F58 WeakPolarHBondContact O-CA 3.29Å; Y16-F58 HydrophobicContact CD2-CD1 4.29Å; Y16-F58 AromaticContact CD2-CE1 3.69Å; Y16-F58 HydrophobicContact CD2-CE1 3.69Å; Y16-F58 HydrophobicContact CD2-CZ 4.01Å; Y16-F58 HydrophobicContact CG-CE1 4.47Å; T42-F58 CarbonylContact C-O 3.58Å; T42-F58 WeakPolarHBondContact CA-O 3.38Å; H43-F58 PolarHBondContact N-O 3.31Å; H43-F58 PolarHBondContact O-N 3.2Å; P45-F58 HydrophobicContact CG-CE2 4.35Å; Y56-F58 AromaticContact CD2-CE2 3.95Å; Y56-F58 HydrophobicContact CD2-CE2 3.95Å; Y56-F58 HydrophobicContact CD2-CZ 4.25Å; Y56-F58 AromaticContact CE2-CE2 3.68Å; Y56-F58 HydrophobicContact CE2-CE2 3.68Å; Y56-F58 HydrophobicContact CE2-CZ 4.1Å; F58-A89 HydrophobicContact CD1-CB 4.25Å; F58-A89 HydrophobicContact CE1-CB 4.46Å
59	V	92.6	Very high	89.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.9	176.8	-172.1	0	0	0	0	107.9	T14 V15 V17 L29 F33 V39 T42 F61	T14-V59 CarbonylContact C-O 3.59Å; T14-V59 WeakPolarHBondContact CA-O 3.09Å; V15-V59 HydrophobicContact CG2-CB 3.67Å; V15-V59 HydrophobicContact CG2-CG2 4.32Å; V15-V59 WeakPolarHBondContact CG2-O 3.48Å; V15-V59 PolarHBondContact N-O 2.65Å; V15-V59 PolarHBondContact O-N 3.17Å; V17-V59 HydrophobicContact CG2-CG2 3.94Å; L29-V59 HydrophobicContact CD2-CG2 3.18Å; L29-V59 HydrophobicContact CG-CG2 4.42Å; F33-V59 HydrophobicContact CB-CG1 4.08Å; F33-V59 HydrophobicContact CD2-CG2 4Å; F33-V59 HydrophobicContact CE2-CG2 4.31Å; F33-V59 HydrophobicContact CG-CG1 4.32Å; F33-V59 HydrophobicContact CG-CG2 4.22Å; V39-V59 HydrophobicContact CB-CG1 4.34Å; V39-V59 HydrophobicContact CG1-CG1 3.49Å; V39-V59 VanDerWaalsContact CG1-CG1 3.49Å; V39-V59 HydrophobicContact CG2-CG1 3.88Å; T42-V59 HydrophobicContact CG2-CG2 4.29Å; V59-F61 HydrophobicContact CB-CE2 4.47Å; V59-F61 HydrophobicContact CG1-CE2 4.1Å; V59-F61 HydrophobicContact CG1-CZ 4.29Å
60	E	91.4	Very high	89.7	Confident	29 Å²	29	53.4 Å²	53.4	14%	0.136	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.5	178.2	-174.5	169.1	-163.7	0	0	108.8	N10 V40 N41	N10-E60 PolarHBondContact N-OE1 2.96Å; N10-E60 VanDerWaalsContact N-OE1 3.14Å; V40-E60 HydrophobicContact CB-CG 4.48Å; V40-E60 PolarHBondContact N-O 3.35Å; N41-E60 HydrophobicContact CB-CB 4.22Å; N41-E60 PolarHBondContact N-O 3.36Å; N41-E60 PolarHBondContact O-N 2.98Å
61	F	93	Very high	89.8	Confident	3 Å²	3	50.2 Å²	50.2	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	164	174.6	-74.1	-83.3	0	0	0	111.2	A13 V15 F33 V39 V59 S63 D66 A67 A70	A13-F61 PolarHBondContact O-N 3.24Å; V15-F61 HydrophobicContact CG1-CD2 4.13Å; V15-F61 HydrophobicContact CG1-CE2 3.98Å; V15-F61 HydrophobicContact CG2-CD2 4.32Å; V15-F61 HydrophobicContact CG2-CE2 3.72Å; F33-F61 HydrophobicContact CB-CZ 4.1Å; F33-F61 HydrophobicContact CD1-CE2 4.26Å; F33-F61 AromaticContact CD1-CZ 3.81Å; F33-F61 HydrophobicContact CD1-CZ 3.81Å; F33-F61 HydrophobicContact CG-CZ 4.39Å; V39-F61 HydrophobicContact CG2-CD1 4.19Å; V39-F61 HydrophobicContact CG2-CE1 3.77Å; V39-F61 HydrophobicContact CG2-CZ 4.3Å; V59-F61 HydrophobicContact CB-CE2 4.47Å; V59-F61 HydrophobicContact CG1-CE2 4.1Å; V59-F61 HydrophobicContact CG1-CZ 4.29Å; F61-S63 WeakPolarHBondContact CB-O 3.44Å; F61-D66 HydrophobicContact CB-CB 4.08Å; F61-D66 HydrophobicContact CD1-CB 3.9Å; F61-D66 HydrophobicContact CG-CB 4.14Å; F61-A67 HydrophobicContact CB-CB 4.3Å; F61-A67 HydrophobicContact CD2-CB 3.84Å; F61-A67 HydrophobicContact CG-CB 4.36Å; F61-A70 HydrophobicContact CE1-CB 4.28Å; F61-A70 HydrophobicContact CE2-CB 3.59Å; F61-A70 HydrophobicContact CZ-CB 3.42Å; F61-A70 VanDerWaalsContact CZ-CB 3.42Å
62	L	90.6	Very high	89.8	Confident	124 Å²	124	55.3 Å²	55.3	65%	0.649	27%	0.265	S	S	*	.	S	Bend	trans	-69.4	-39.9	173.7	-172.1	67.4	0	0	0	111.8	P38 V40	P38-L62 HydrophobicContact CB-CB 4.4Å; P38-L62 HydrophobicContact CG-CB 4.04Å; P38-L62 HydrophobicContact CG-CD2 4.36Å; P38-L62 PolarHBondContact O-N 3.29Å; P38-L62 VanDerWaalsContact O-N 3.09Å; V40-L62 HydrophobicContact CG2-CB 4.01Å; V40-L62 HydrophobicContact CG2-CD1 3.95Å
63	S	89.8	Confident	89.9	Confident	37 Å²	37	54.7 Å²	54.7	26%	0.259	26%	0.264	S	S	.	.	S	Bend	trans	-117.5	150.7	178.6	-171.8	0	0	0	0	111.7	F61 E65 D66 A67	F61-S63 WeakPolarHBondContact CB-O 3.44Å; S63-E65 VanDerWaalsContact C-N 3.27Å; S63-E65 PolarHBondContact OG-N 3.27Å; S63-D66 WeakPolarHBondContact CB-OD2 3.49Å; S63-D66 PolarHBondContact O-N 3.31Å; S63-A67 PolarHBondContact O-N 3.2Å
64	E	88.6	Confident	89.9	Confident	87 Å²	87	54.3 Å²	54.3	41%	0.407	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-36.2	167.2	174.7	176	-171.6	0	0	111.2	D12 D66 A67 D68 K88	D12-E64 HydrophobicContact CB-CG 4.34Å; E64-D66 VanDerWaalsContact C-N 3.29Å; E64-D66 PolarHBondContact O-N 3.13Å; E64-A67 WeakPolarHBondContact O-CA 3.19Å; E64-A67 WeakPolarHBondContact O-CB 3.48Å; E64-A67 PolarHBondContact O-N 2.84Å; E64-A67 VanDerWaalsContact O-N 3.08Å; E64-D68 WeakPolarHBondContact CG-OD2 3.05Å; E64-D68 PolarHBondContact O-N 2.91Å; E64-K88 IonicContact OE1-NZ 3.23Å; E64-K88 PolarHBondContact OE1-NZ 2.96Å
65	E	90.1	Very high	89.9	Confident	156 Å²	156	49.4 Å²	49.4	73%	0.729	24%	0.239	S	C	*	.	H	α-helix	trans	-62.6	-38.8	179.3	-61.4	177.3	112	0	0	111.6	S63 Y69	S63-E65 VanDerWaalsContact C-N 3.27Å; S63-E65 PolarHBondContact OG-N 3.27Å; E65-Y69 VanDerWaalsContact O-CB 3.29Å; E65-Y69 WeakPolarHBondContact O-CB 3.44Å; E65-Y69 PolarHBondContact O-N 3.05Å
66	D	91.8	Very high	89.7	Confident	43 Å²	43	49.1 Å²	49.1	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-37.7	174.4	-68	-50.5	0	0	0	111.2	F61 S63 E64 Y69 A70	F61-D66 HydrophobicContact CB-CB 4.08Å; F61-D66 HydrophobicContact CD1-CB 3.9Å; F61-D66 HydrophobicContact CG-CB 4.14Å; S63-D66 WeakPolarHBondContact CB-OD2 3.49Å; S63-D66 PolarHBondContact O-N 3.31Å; E64-D66 VanDerWaalsContact C-N 3.29Å; E64-D66 PolarHBondContact O-N 3.13Å; D66-Y69 PolarHBondContact O-N 3.01Å; D66-A70 VanDerWaalsContact O-CB 3.26Å; D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 2.76Å
67	A	89.9	Confident	89.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.3	-47.5	175.9	0	0	0	0	0	111.7	V15 F61 S63 E64 Y69 A70 I71	V15-A67 HydrophobicContact CG1-CB 3.71Å; F61-A67 HydrophobicContact CB-CB 4.3Å; F61-A67 HydrophobicContact CD2-CB 3.84Å; F61-A67 HydrophobicContact CG-CB 4.36Å; S63-A67 PolarHBondContact O-N 3.2Å; E64-A67 WeakPolarHBondContact O-CA 3.19Å; E64-A67 WeakPolarHBondContact O-CB 3.48Å; E64-A67 PolarHBondContact O-N 2.84Å; E64-A67 VanDerWaalsContact O-N 3.08Å; A67-Y69 VanDerWaalsContact C-N 3.31Å; A67-Y69 PolarHBondContact O-N 3.4Å; A67-A70 PolarHBondContact O-N 3.4Å; A67-I71 WeakPolarHBondContact O-CD1 3.49Å; A67-I71 VanDerWaalsContact O-CG1 3.26Å; A67-I71 WeakPolarHBondContact O-CG1 3.5Å; A67-I71 PolarHBondContact O-N 3.36Å
68	D	88.6	Confident	89.3	Confident	52 Å²	52	54.6 Å²	54.6	28%	0.278	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-35.3	175.9	-85.2	-69.3	0	0	0	112	E64 K72 K88	E64-D68 WeakPolarHBondContact CG-OD2 3.05Å; E64-D68 PolarHBondContact O-N 2.91Å; D68-K72 WeakPolarHBondContact O-CG 3.4Å; D68-K72 PolarHBondContact O-N 2.83Å; D68-K88 IonicContact OD1-NZ 3.99Å; D68-K88 IonicContact OD2-NZ 2.62Å; D68-K88 PolarHBondContact OD2-NZ 3.36Å
69	Y	90.8	Very high	89.1	Confident	123 Å²	123	53.5 Å²	53.5	48%	0.482	26%	0.256	S	S	.	.	H	α-helix	trans	-64.9	-49.7	171	-177.4	-110	0	0	0	111.6	A36 E65 D66 A67 I71 K72 I73	A36-Y69 WeakPolarHBondContact O-CD1 3.28Å; E65-Y69 VanDerWaalsContact O-CB 3.29Å; E65-Y69 WeakPolarHBondContact O-CB 3.44Å; E65-Y69 PolarHBondContact O-N 3.05Å; D66-Y69 PolarHBondContact O-N 3.01Å; A67-Y69 VanDerWaalsContact C-N 3.31Å; A67-Y69 PolarHBondContact O-N 3.4Å; Y69-I71 VanDerWaalsContact C-N 3.29Å; Y69-I71 PolarHBondContact O-N 2.86Å; Y69-K72 WeakPolarHBondContact O-CB 3.14Å; Y69-K72 PolarHBondContact O-N 2.9Å; Y69-I73 HydrophobicContact CD1-CD1 3.97Å; Y69-I73 HydrophobicContact CD1-CG1 4.16Å; Y69-I73 HydrophobicContact CD2-CG2 4.38Å; Y69-I73 HydrophobicContact CE1-CD1 3.37Å; Y69-I73 HydrophobicContact CE1-CG1 3.94Å; Y69-I73 HydrophobicContact CE1-CG2 4.41Å; Y69-I73 HydrophobicContact CE2-CG2 3.84Å; Y69-I73 WeakPolarHBondContact O-CG1 3.19Å; Y69-I73 PolarHBondContact O-N 3.14Å
70	A	91.4	Very high	88.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-39.4	178.9	0	0	0	0	0	112.2	F33 A36 F61 D66 A67 K72 I73 M74	F33-A70 HydrophobicContact CD1-CB 4.26Å; F33-A70 HydrophobicContact CE1-CB 4.45Å; A36-A70 HydrophobicContact CB-CB 3.74Å; F61-A70 HydrophobicContact CE1-CB 4.28Å; F61-A70 HydrophobicContact CE2-CB 3.59Å; F61-A70 HydrophobicContact CZ-CB 3.42Å; F61-A70 VanDerWaalsContact CZ-CB 3.42Å; D66-A70 VanDerWaalsContact O-CB 3.26Å; D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 2.76Å; A67-A70 PolarHBondContact O-N 3.4Å; A70-K72 VanDerWaalsContact C-N 3.29Å; A70-K72 PolarHBondContact O-N 3.04Å; A70-I73 PolarHBondContact O-N 2.89Å; A70-M74 WeakPolarHBondContact O-CA 3.32Å; A70-M74 WeakPolarHBondContact O-CB 3.33Å; A70-M74 PolarHBondContact O-N 2.83Å
71	I	89.1	Confident	88.5	Confident	20 Å²	20	61.7 Å²	61.7	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-43	173.8	-70.3	160.3	0	0	0	110.8	V15 A67 Y69 N75 V86 K88	V15-I71 HydrophobicContact CB-CG1 4.39Å; V15-I71 HydrophobicContact CG1-CD1 3.94Å; V15-I71 HydrophobicContact CG1-CG1 3.76Å; A67-I71 WeakPolarHBondContact O-CD1 3.49Å; A67-I71 VanDerWaalsContact O-CG1 3.26Å; A67-I71 WeakPolarHBondContact O-CG1 3.5Å; A67-I71 PolarHBondContact O-N 3.36Å; Y69-I71 VanDerWaalsContact C-N 3.29Å; Y69-I71 PolarHBondContact O-N 2.86Å; I71-N75 WeakPolarHBondContact O-CB 3.36Å; I71-V86 HydrophobicContact CB-CG1 4.44Å; I71-V86 HydrophobicContact CG1-CG1 3.92Å; I71-K88 HydrophobicContact CD1-CB 3.99Å
72	K	84.7	Confident	88.1	Confident	156 Å²	156	66.3 Å²	66.3	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-70.7	-42	-177.7	-69.1	168.9	-175	172.2	0	112.7	D68 Y69 A70	D68-K72 WeakPolarHBondContact O-CG 3.4Å; D68-K72 PolarHBondContact O-N 2.83Å; Y69-K72 WeakPolarHBondContact O-CB 3.14Å; Y69-K72 PolarHBondContact O-N 2.9Å; A70-K72 VanDerWaalsContact C-N 3.29Å; A70-K72 PolarHBondContact O-N 3.04Å
73	I	88.4	Confident	87.8	Confident	65 Å²	65	62.4 Å²	62.4	33%	0.333	31%	0.31	S	S	.	.	H	α-helix	trans	-93.4	-30.9	-171.9	61.9	149.5	0	0	0	114.3	A36 Y69 A70	A36-I73 HydrophobicContact CB-CD1 3.82Å; A36-I73 HydrophobicContact CB-CG1 4.38Å; Y69-I73 HydrophobicContact CD1-CD1 3.97Å; Y69-I73 HydrophobicContact CD1-CG1 4.16Å; Y69-I73 HydrophobicContact CD2-CG2 4.38Å; Y69-I73 HydrophobicContact CE1-CD1 3.37Å; Y69-I73 HydrophobicContact CE1-CG1 3.94Å; Y69-I73 HydrophobicContact CE1-CG2 4.41Å; Y69-I73 HydrophobicContact CE2-CG2 3.84Å; Y69-I73 WeakPolarHBondContact O-CG1 3.19Å; Y69-I73 PolarHBondContact O-N 3.14Å; A70-I73 PolarHBondContact O-N 2.89Å
74	M	88.2	Confident	87.8	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.059	30%	0.298	C	S	.	.	H	α-helix	trans	-93.3	-11.9	-175.8	-63.4	-65.6	177.5	0	0	113.3	L32 F33 Q35 A36 A70 I77 I84 V86	L32-M74 HydrophobicContact CD1-SD 4.41Å; L32-M74 HydrophobicContact CG-SD 4.36Å; L32-M74 WeakPolarHBondContact O-CE 3.45Å; F33-M74 HydrophobicContact CD1-CB 4.38Å; F33-M74 HydrophobicContact CD1-CG 4.06Å; F33-M74 HydrophobicContact CE1-CB 3.74Å; F33-M74 HydrophobicContact CE1-CG 3.94Å; F33-M74 HydrophobicContact CZ-CB 4.16Å; Q35-M74 HydrophobicContact CB-CE 3.86Å; A36-M74 HydrophobicContact CB-CE 3.72Å; A36-M74 HydrophobicContact CB-CG 4.12Å; A70-M74 WeakPolarHBondContact O-CA 3.32Å; A70-M74 WeakPolarHBondContact O-CB 3.33Å; A70-M74 PolarHBondContact O-N 2.83Å; M74-I77 HydrophobicContact CB-CD1 4.29Å; M74-I77 HydrophobicContact CG-CD1 4.49Å; M74-I77 WeakPolarHBondContact O-CG1 3.5Å; M74-I77 HydrophobicContact SD-CD1 3.4Å; M74-I77 WeakPolarHBondContact SD-CD1 3.45Å; M74-I84 WeakPolarHBondContact O-CD1 3.49Å; M74-I84 WeakPolarHBondContact O-CG1 3.21Å; M74-V86 HydrophobicContact CB-CG2 4.11Å
75	N	87.9	Confident	87.7	Confident	10 Å²	10	61.1 Å²	61.1	5%	0.053	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	139	175.5	-166.8	22.8	0	0	0	110.5	I71 I77 R85 V86	I71-N75 WeakPolarHBondContact O-CB 3.36Å; N75-I77 VanDerWaalsContact C-N 3.31Å; N75-I77 PolarHBondContact O-N 2.73Å; N75-R85 WeakPolarHBondContact OD1-CA 3.47Å; N75-V86 HydrophobicContact CB-CB 4.26Å; N75-V86 PolarHBondContact OD1-N 3.37Å
76	M	82.6	Confident	87.6	Confident	14 Å²	14	53.7 Å²	53.7	7%	0.069	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	11.7	179.2	-53.7	-57.4	-66.9	0	0	116.7	K78 P83 I84 E113 K114 T129	M76-K78 PolarHBondContact O-N 3.36Å; M76-P83 HydrophobicContact CE-CB 4.08Å; M76-I84 WeakPolarHBondContact CA-O 3.49Å; M76-I84 PolarHBondContact N-O 3.25Å; M76-E113 HydrophobicContact CE-CB 3.14Å; M76-E113 HydrophobicContact CE-CG 4.02Å; M76-K114 HydrophobicContact CB-CB 4.17Å; M76-T129 HydrophobicContact CE-CG2 3.39Å; M76-T129 HydrophobicContact SD-CG2 3.12Å; M76-T129 WeakPolarHBondContact SD-CG2 3.32Å
77	I	87.1	Confident	87.4	Confident	58 Å²	58	54.1 Å²	54.1	30%	0.297	26%	0.263	S	S	.	.			trans	-70.2	131.3	172.1	-66	-179.3	0	0	0	110.1	M74 N75 L79 P83 I84	M74-I77 HydrophobicContact CB-CD1 4.29Å; M74-I77 HydrophobicContact CG-CD1 4.49Å; M74-I77 WeakPolarHBondContact O-CG1 3.5Å; M74-I77 HydrophobicContact SD-CD1 3.4Å; M74-I77 WeakPolarHBondContact SD-CD1 3.45Å; N75-I77 VanDerWaalsContact C-N 3.31Å; N75-I77 PolarHBondContact O-N 2.73Å; I77-L79 PolarHBondContact O-N 2.93Å; I77-P83 CarbonylContact O-C 3.53Å; I77-P83 WeakPolarHBondContact O-CA 3.42Å; I77-I84 HydrophobicContact CB-CD1 4.07Å; I77-I84 HydrophobicContact CB-CG1 4.14Å; I77-I84 WeakPolarHBondContact O-CG1 3.37Å; I77-I84 PolarHBondContact O-N 3.28Å
78	K	86.9	Confident	87.2	Confident	111 Å²	111	56.1 Å²	56.1	48%	0.483	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	111.7	180	-64.9	174.7	-175.9	169.2	0	109.9	M76 K82 P83 D112	M76-K78 PolarHBondContact O-N 3.36Å; K78-K82 CarbonylContact C-O 3.58Å; K78-K82 WeakPolarHBondContact CA-O 3.32Å; K78-P83 HydrophobicContact CG-CB 4.3Å; K78-D112 IonicContact NZ-OD1 2.97Å; K78-D112 PolarHBondContact NZ-OD1 2.9Å
79	L	88	Confident	86.8	Confident	23 Å²	23	54.4 Å²	54.4	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.7	167.5	-70.2	-175.8	0	0	0	109.5	L20 V24 L32 I77 G81 K82 I84	L20-L79 HydrophobicContact CD2-CD1 4.33Å; V24-L79 HydrophobicContact CG1-CD1 4.41Å; V24-L79 HydrophobicContact CG2-CB 4.25Å; V24-L79 HydrophobicContact CG2-CD1 4.16Å; L32-L79 HydrophobicContact CD2-CD1 3.94Å; L32-L79 HydrophobicContact CD2-CD2 4.16Å; L32-L79 HydrophobicContact CD2-CG 4.34Å; I77-L79 PolarHBondContact O-N 2.93Å; L79-G81 PolarHBondContact O-N 2.92Å; L79-G81 VanDerWaalsContact O-N 3.11Å; L79-K82 PolarHBondContact N-O 3.3Å; L79-K82 PolarHBondContact O-N 2.84Å; L79-K82 VanDerWaalsContact O-O 3.13Å; L79-I84 HydrophobicContact CB-CG2 3.96Å; L79-I84 HydrophobicContact CD1-CG2 3.64Å; L79-I84 HydrophobicContact CG-CG2 3.72Å
80	Y	88	Confident	85.8	Confident	135 Å²	135	50.6 Å²	50.6	53%	0.529	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	33.6	-175.5	-60.8	-76.4	0	0	0	113.8	D21 K23 V24 L28 K82	D21-Y80 HydrophobicContact CB-CD2 4.29Å; K23-Y80 HydrophobicContact CB-CD1 4.42Å; K23-Y80 HydrophobicContact CB-CD2 4.13Å; K23-Y80 HydrophobicContact CB-CE1 4.3Å; K23-Y80 HydrophobicContact CB-CE2 3.99Å; K23-Y80 HydrophobicContact CB-CG 4.34Å; K23-Y80 HydrophobicContact CD-CD1 4.39Å; V24-Y80 HydrophobicContact CG2-CD2 3.7Å; V24-Y80 HydrophobicContact CG2-CE2 3.87Å; L28-Y80 HydrophobicContact CD2-CE2 3.87Å; Y80-K82 VanDerWaalsContact C-N 3.28Å; Y80-K82 PolarHBondContact O-N 3.37Å
81	G	82.9	Confident	84.5	Confident	66 Å²	66	52.5 Å²	52.5	68%	0.68	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-3.9	-177.7	0	0	0	0	0	115.2	L79	L79-G81 PolarHBondContact O-N 2.92Å; L79-G81 VanDerWaalsContact O-N 3.11Å
82	K	84.4	Confident	83	Confident	101 Å²	101	55.8 Å²	55.8	44%	0.439	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.3	173.5	-70.6	-176.1	-179.6	159.4	0	111	D21 K78 L79 Y80 I84	D21-K82 HydrophobicContact CB-CD 3.98Å; D21-K82 WeakPolarHBondContact OD2-CD 3.29Å; D21-K82 WeakPolarHBondContact OD2-CE 3.41Å; D21-K82 IonicContact OD2-NZ 2.98Å; D21-K82 PolarHBondContact OD2-NZ 3.24Å; K78-K82 CarbonylContact C-O 3.58Å; K78-K82 WeakPolarHBondContact CA-O 3.32Å; L79-K82 PolarHBondContact N-O 3.3Å; L79-K82 PolarHBondContact O-N 2.84Å; L79-K82 VanDerWaalsContact O-O 3.13Å; Y80-K82 VanDerWaalsContact C-N 3.28Å; Y80-K82 PolarHBondContact O-N 3.37Å; K82-I84 PolarHBondContact O-N 3.25Å
83	P	84.1	Confident	81.5	Confident	42 Å²	42	55.9 Å²	55.9	27%	0.273	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.7	175.7	28	-32.5	0	0	0	110.8	M76 I77 K78	M76-P83 HydrophobicContact CE-CB 4.08Å; I77-P83 CarbonylContact O-C 3.53Å; I77-P83 WeakPolarHBondContact O-CA 3.42Å; K78-P83 HydrophobicContact CG-CB 4.3Å
84	I	90.3	Very high	79.8	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-76.9	148.4	174.9	73.4	-177.4	0	0	0	110.5	V17 L20 L32 F33 M74 M76 I77 L79 K82 V86	V17-I84 HydrophobicContact CG1-CB 4.33Å; V17-I84 HydrophobicContact CG1-CD1 4.48Å; L20-I84 HydrophobicContact CD2-CB 4.42Å; L20-I84 HydrophobicContact CD2-CG2 3.77Å; L32-I84 HydrophobicContact CD2-CD1 3.88Å; F33-I84 HydrophobicContact CZ-CD1 4.44Å; M74-I84 WeakPolarHBondContact O-CD1 3.49Å; M74-I84 WeakPolarHBondContact O-CG1 3.21Å; M76-I84 WeakPolarHBondContact CA-O 3.49Å; M76-I84 PolarHBondContact N-O 3.25Å; I77-I84 HydrophobicContact CB-CD1 4.07Å; I77-I84 HydrophobicContact CB-CG1 4.14Å; I77-I84 WeakPolarHBondContact O-CG1 3.37Å; I77-I84 PolarHBondContact O-N 3.28Å; L79-I84 HydrophobicContact CB-CG2 3.96Å; L79-I84 HydrophobicContact CD1-CG2 3.64Å; L79-I84 HydrophobicContact CG-CG2 3.72Å; K82-I84 PolarHBondContact O-N 3.25Å; I84-V86 HydrophobicContact CD1-CG2 4.28Å; I84-V86 HydrophobicContact CG1-CG2 4.24Å
85	R	85.5	Confident	78.1	Confident	95 Å²	95	62.7 Å²	62.7	36%	0.358	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120	179.1	-58.4	-174.3	174.7	-166.8	-9.8	108.8	V17 G18 N75 T129	V17-R85 CarbonylContact C-O 3.54Å; V17-R85 VanDerWaalsContact CA-O 3.27Å; V17-R85 WeakPolarHBondContact CA-O 3.32Å; G18-R85 PolarHBondContact N-O 3.47Å; G18-R85 PolarHBondContact O-N 3.45Å; N75-R85 WeakPolarHBondContact OD1-CA 3.47Å; R85-T129 WeakPolarHBondContact CD-OG1 3.46Å; R85-T129 WeakPolarHBondContact CG-OG1 3.13Å; R85-T129 PolarHBondContact NE-OG1 2.92Å
86	V	89.4	Confident	76.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.1	-179.3	-169	0	0	0	0	108.5	V15 Y16 V17 F33 I71 M74 N75 I84	V15-V86 HydrophobicContact CB-CG1 4.01Å; V15-V86 HydrophobicContact CG2-CG1 4.16Å; Y16-V86 CarbonylContact O-C 3.51Å; Y16-V86 WeakPolarHBondContact O-CA 3.38Å; V17-V86 HydrophobicContact CG1-CG2 4.41Å; F33-V86 HydrophobicContact CE1-CG1 4.02Å; F33-V86 HydrophobicContact CE1-CG2 4.12Å; F33-V86 HydrophobicContact CZ-CG1 4.26Å; F33-V86 HydrophobicContact CZ-CG2 3.73Å; I71-V86 HydrophobicContact CB-CG1 4.44Å; I71-V86 HydrophobicContact CG1-CG1 3.92Å; M74-V86 HydrophobicContact CB-CG2 4.11Å; N75-V86 HydrophobicContact CB-CB 4.26Å; N75-V86 PolarHBondContact OD1-N 3.37Å; I84-V86 HydrophobicContact CD1-CG2 4.28Å; I84-V86 HydrophobicContact CG1-CG2 4.24Å
87	N	86.6	Confident	75.8	Confident	52 Å²	52	68.3 Å²	68.3	28%	0.278	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	160.8	-179.9	-75.1	-28.3	0	0	0	109.8	V15 Y16 A89	V15-N87 CarbonylContact C-O 3.5Å; V15-N87 WeakPolarHBondContact CA-O 3.49Å; Y16-N87 HydrophobicContact CD1-CB 4.45Å; Y16-N87 PolarHBondContact N-O 2.9Å; Y16-N87 PolarHBondContact O-N 3.45Å; N87-A89 PolarHBondContact O-N 3.37Å
88	K	86.5	Confident	74.8	Confident	43 Å²	43	66.2 Å²	66.2	19%	0.187	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	136	171.9	-156.2	155	-173.2	157	0	110	D12 E64 D68 I71 S90 A91	D12-K88 WeakPolarHBondContact O-CE 2.96Å; E64-K88 IonicContact OE1-NZ 3.23Å; E64-K88 PolarHBondContact OE1-NZ 2.96Å; D68-K88 IonicContact OD1-NZ 3.99Å; D68-K88 IonicContact OD2-NZ 2.62Å; D68-K88 PolarHBondContact OD2-NZ 3.36Å; I71-K88 HydrophobicContact CD1-CB 3.99Å; K88-S90 PolarHBondContact O-N 3.08Å; K88-A91 HydrophobicContact CB-CB 4.42Å; K88-A91 WeakPolarHBondContact O-CB 3.14Å; K88-A91 PolarHBondContact O-N 3.46Å
89	A	80.3	Confident	74	Confident	15 Å²	15	60.9 Å²	60.9	12%	0.124	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-58.9	-36.3	-176.9	0	0	0	0	0	112.1	T14 F58 N87 A91 H92	T14-A89 HydrophobicContact CG2-CB 3.76Å; T14-A89 WeakPolarHBondContact O-CB 3.48Å; T14-A89 PolarHBondContact O-N 3.42Å; F58-A89 HydrophobicContact CD1-CB 4.25Å; F58-A89 HydrophobicContact CE1-CB 4.46Å; N87-A89 PolarHBondContact O-N 3.37Å; A89-A91 PolarHBondContact O-N 3.1Å; A89-H92 WeakPolarHBondContact O-CB 3.42Å; A89-H92 PolarHBondContact O-N 2.86Å
90	S	70.3	Confident	73.7	Confident	44 Å²	44	59.8 Å²	59.8	31%	0.308	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.8	-22.8	174.3	-47.8	0	0	0	0	113.9	Q11 K88	Q11-S90 PolarHBondContact O-OG 3.21Å; K88-S90 PolarHBondContact O-N 3.08Å
91	A	63.4	Low	73.7	Confident	40 Å²	40	54.6 Å²	54.6	33%	0.331	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-86.5	-16.3	-180	0	0	0	0	0	113.3	K88 A89 N93 K94	K88-A91 HydrophobicContact CB-CB 4.42Å; K88-A91 WeakPolarHBondContact O-CB 3.14Å; K88-A91 PolarHBondContact O-N 3.46Å; A89-A91 PolarHBondContact O-N 3.1Å; A91-N93 PolarHBondContact O-N 3.34Å; A91-N93 VanDerWaalsContact O-N 3.15Å; A91-K94 PolarHBondContact O-N 2.85Å
92	H	57.6	Low	74.1	Confident	89 Å²	89	51.5 Å²	51.5	41%	0.412	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.2	-173.1	-168.5	60	0	0	0	113.7	Y16 A89 K94	Y16-H92 AromaticContact CD1-ND1 3.72Å; Y16-H92 HydrophobicContact CD2-CB 4.36Å; Y16-H92 AromaticContact CD2-CD2 4Å; Y16-H92 AromaticContact CD2-CE1 3.88Å; Y16-H92 AromaticContact CD2-CG 3.74Å; Y16-H92 AromaticContact CD2-ND1 3.65Å; Y16-H92 AromaticContact CE1-CE1 3.68Å; Y16-H92 AromaticContact CE1-ND1 3.55Å; Y16-H92 AromaticContact CE2-CD2 3.85Å; Y16-H92 AromaticContact CE2-CE1 3.21Å; Y16-H92 WeakPolarHBondContact CE2-CE1 3.31Å; Y16-H92 AromaticContact CE2-CG 3.86Å; Y16-H92 AromaticContact CE2-ND1 3.46Å; Y16-H92 WeakPolarHBondContact CE2-ND1 3.07Å; Y16-H92 AromaticContact CE2-NE2 3.45Å; Y16-H92 WeakPolarHBondContact CE2-NE2 3.47Å; Y16-H92 HydrophobicContact CG-CB 4.33Å; Y16-H92 AromaticContact CG-ND1 3.77Å; Y16-H92 AromaticContact CZ-CE1 3.1Å; Y16-H92 AromaticContact CZ-ND1 3.41Å; Y16-H92 AromaticContact CZ-NE2 3.79Å; Y16-H92 PolarHBondContact OH-CE1 3.45Å; Y16-H92 VanDerWaalsContact OH-CE1 3.25Å; A89-H92 WeakPolarHBondContact O-CB 3.42Å; A89-H92 PolarHBondContact O-N 2.86Å; H92-K94 VanDerWaalsContact C-N 3.31Å; H92-K94 PolarHBondContact O-N 2.69Å
93	N	52.1	Low	74.5	Confident	157 Å²	157	49.7 Å²	49.7	84%	0.84	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	6.2	-175.5	-121.5	-30.2	0	0	0	114.9	A91	A91-N93 PolarHBondContact O-N 3.34Å; A91-N93 VanDerWaalsContact O-N 3.15Å
94	K	53.2	Low	74.9	Confident	96 Å²	96	47.7 Å²	47.7	42%	0.417	25%	0.247	S	C	.	.			trans	-134.7	74.5	-175.4	-26.8	-179.5	-162.5	178	0	109.9	A91 H92 L96 L201	A91-K94 PolarHBondContact O-N 2.85Å; H92-K94 VanDerWaalsContact C-N 3.31Å; H92-K94 PolarHBondContact O-N 2.69Å; K94-L96 HydrophobicContact CB-CD1 3.3Å; K94-L96 HydrophobicContact CB-CG 4.01Å; K94-L96 HydrophobicContact CD-CD1 3.98Å; K94-L96 HydrophobicContact CG-CD1 4.25Å; K94-L96 PolarHBondContact O-N 2.94Å; K94-L201 HydrophobicContact CD-CD1 3.94Å
95	N	53.6	Low	75	Confident	124 Å²	124	48 Å²	48	66%	0.663	25%	0.249	S	C	*	.			trans	-68.7	60	157.3	-167.3	61.2	0	0	0	108.8	D97 Q128	N95-D97 PolarHBondContact O-N 2.88Å; N95-Q128 PolarHBondContact OD1-NE2 3.47Å
96	L	57.7	Low	75.3	Confident	66 Å²	66	46.9 Å²	46.9	35%	0.346	25%	0.251	S	S	.	.			trans	-71	86.2	167.8	-71.1	135.2	0	0	0	104.5	K94 V98 L127 N199 L201	K94-L96 HydrophobicContact CB-CD1 3.3Å; K94-L96 HydrophobicContact CB-CG 4.01Å; K94-L96 HydrophobicContact CD-CD1 3.98Å; K94-L96 HydrophobicContact CG-CD1 4.25Å; K94-L96 PolarHBondContact O-N 2.94Å; L96-V98 HydrophobicContact CB-CG2 3.9Å; L96-V98 WeakPolarHBondContact O-CG2 2.95Å; L96-V98 PolarHBondContact O-N 3.23Å; L96-L127 WeakPolarHBondContact O-CD1 3.43Å; L96-N199 WeakPolarHBondContact CD1-OD1 3.46Å; L96-L201 HydrophobicContact CD1-CD1 4.48Å
97	D	63.5	Low	75.4	Confident	77 Å²	77	47.1 Å²	47.1	41%	0.412	25%	0.252	S	S	.	.			trans	-65.5	89.2	155.9	-163.4	-104.7	0	0	0	105.3	N95 G99 N148 H187	N95-D97 PolarHBondContact O-N 2.88Å; D97-G99 PolarHBondContact O-N 3.33Å; D97-G99 VanDerWaalsContact O-N 3.14Å; D97-N148 PolarHBondContact OD2-ND2 3.48Å; D97-H187 IonicContact OD1-CE1 2.86Å
98	V	66.7	Low	75.5	Confident	13 Å²	13	45.3 Å²	45.3	8%	0.079	24%	0.242	C	C	.	.			trans	-65.8	-9.8	176.3	177.3	0	0	0	0	109.7	L96 A100 F152 A196	L96-V98 HydrophobicContact CB-CG2 3.9Å; L96-V98 WeakPolarHBondContact O-CG2 2.95Å; L96-V98 PolarHBondContact O-N 3.23Å; V98-A100 VanDerWaalsContact C-N 3.28Å; V98-F152 HydrophobicContact CG1-CD2 4.1Å; V98-F152 HydrophobicContact CG1-CE2 3.75Å; V98-F152 WeakPolarHBondContact O-CE2 3.33Å; V98-F152 WeakPolarHBondContact O-CZ 3.35Å; V98-A196 HydrophobicContact CB-CB 4.46Å; V98-A196 HydrophobicContact CG1-CB 2.98Å
99	G	70.3	Confident	75.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	80.8	9.9	-172.2	0	0	0	0	0	112	D97 N101 F152 H187	D97-G99 PolarHBondContact O-N 3.33Å; D97-G99 VanDerWaalsContact O-N 3.14Å; G99-N101 PolarHBondContact O-N 2.78Å; G99-F152 VanDerWaalsContact C-CE1 3.47Å; G99-F152 WeakPolarHBondContact O-CE1 3.5Å; G99-F152 VanDerWaalsContact O-CZ 3.24Å; G99-F152 WeakPolarHBondContact O-CZ 3.36Å; G99-H187 VanDerWaalsContact CA-ND1 3.33Å; G99-H187 WeakPolarHBondContact CA-ND1 3.32Å; G99-H187 WeakPolarHBondContact O-CB 3.32Å; G99-H187 PolarHBondContact O-ND1 3.24Å
100	A	81.1	Confident	75.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.			trans	-84.7	51.2	177.5	0	0	0	0	0	110.9	V98 F149 F152 S155	V98-A100 VanDerWaalsContact C-N 3.28Å; A100-F149 HydrophobicContact CB-CB 4.23Å; A100-F149 WeakPolarHBondContact CB-O 3.49Å; A100-F149 PolarHBondContact O-N 2.76Å; A100-F152 HydrophobicContact CB-CD1 4.05Å; A100-F152 HydrophobicContact CB-CD2 4.34Å; A100-F152 HydrophobicContact CB-CE1 4.08Å; A100-F152 HydrophobicContact CB-CE2 4.41Å; A100-F152 HydrophobicContact CB-CG 4.16Å; A100-F152 HydrophobicContact CB-CZ 4.28Å; A100-S155 WeakPolarHBondContact CB-OG 3.37Å; A100-S155 PolarHBondContact O-OG 2.79Å
101	N	88.2	Confident	76.6	Confident	26 Å²	26	50.8 Å²	50.8	14%	0.139	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.6	-173.8	-155.8	43.4	0	0	0	110.3	G99 I147 N148 A177	G99-N101 PolarHBondContact O-N 2.78Å; N101-I147 CarbonylContact C-O 3.58Å; N101-I147 WeakPolarHBondContact CA-O 3.48Å; N101-I147 VanDerWaalsContact OD1-C 3.3Å; N101-I147 PolarHBondContact OD1-O 3.2Å; N101-I147 VanDerWaalsContact OD1-O 3.05Å; N101-N148 WeakPolarHBondContact OD1-CA 3.33Å; N101-N148 WeakPolarHBondContact OD1-CB 3.4Å; N101-N148 PolarHBondContact OD1-N 3.32Å; N101-A177 HydrophobicContact CB-CB 4.3Å; N101-A177 WeakPolarHBondContact O-CB 3.43Å; N101-A177 PolarHBondContact O-N 2.83Å
102	I	91.6	Very high	77.7	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139	-175.2	-60.5	177.2	0	0	0	109.8	I104 F146 I147 F149 S155 A158 I159 V174 S175	I102-I104 HydrophobicContact CG2-CG1 4.38Å; I102-F146 CarbonylContact O-C 3.45Å; I102-F146 VanDerWaalsContact O-CA 3.29Å; I102-F146 WeakPolarHBondContact O-CA 3.27Å; I102-I147 PolarHBondContact N-O 2.89Å; I102-I147 PolarHBondContact O-N 3.25Å; I102-F149 HydrophobicContact CD1-CD2 3.56Å; I102-F149 HydrophobicContact CD1-CE2 3.35Å; I102-F149 HydrophobicContact CD1-CZ 4.45Å; I102-F149 HydrophobicContact CG1-CD2 4.14Å; I102-F149 HydrophobicContact CG1-CE2 4.22Å; I102-S155 VanDerWaalsContact CD1-CA 3.41Å; I102-S155 VanDerWaalsContact CD1-CB 3.45Å; I102-S155 WeakPolarHBondContact CD1-O 3.27Å; I102-A158 HydrophobicContact CD1-CB 4.12Å; I102-I159 HydrophobicContact CD1-CD1 4.22Å; I102-I159 HydrophobicContact CD1-CG1 4.05Å; I102-I159 HydrophobicContact CG1-CD1 4.27Å; I102-I159 HydrophobicContact CG1-CG1 4.44Å; I102-I159 HydrophobicContact CG2-CG1 4.28Å; I102-V174 HydrophobicContact CG2-CG1 3.31Å; I102-S175 WeakPolarHBondContact CG2-O 3.48Å
103	F	92.4	Very high	79.1	Confident	64 Å²	64	48.9 Å²	48.9	28%	0.281	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.8	167.8	170.1	-94.3	0	0	0	109.9	Y144 F146 V174 S175 A177	F103-Y144 HydrophobicContact CD2-CD2 4.47Å; F103-Y144 AromaticContact CE2-CD2 3.73Å; F103-Y144 HydrophobicContact CE2-CD2 3.73Å; F103-Y144 AromaticContact CE2-CG 3.86Å; F103-Y144 HydrophobicContact CE2-CG 3.86Å; F103-Y144 HydrophobicContact CZ-CG 4.36Å; F103-F146 HydrophobicContact CB-CD1 4.31Å; F103-F146 HydrophobicContact CB-CE1 4.15Å; F103-F146 HydrophobicContact CD2-CD1 4.28Å; F103-F146 AromaticContact CD2-CE1 3.64Å; F103-F146 HydrophobicContact CD2-CE1 3.64Å; F103-F146 AromaticContact CD2-CZ 3.83Å; F103-F146 HydrophobicContact CD2-CZ 3.83Å; F103-F146 HydrophobicContact CE2-CZ 4.38Å; F103-F146 HydrophobicContact CG-CE1 4.38Å; F103-V174 WeakPolarHBondContact O-CA 3.39Å; F103-S175 WeakPolarHBondContact CA-O 3.42Å; F103-S175 WeakPolarHBondContact CB-O 3.2Å; F103-S175 PolarHBondContact N-O 3.36Å; F103-S175 PolarHBondContact O-N 3.09Å; F103-S175 VanDerWaalsContact O-O 3.09Å; F103-A177 HydrophobicContact CB-CB 4.21Å
104	I	92.4	Very high	80.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.3	173	-53.2	162.3	0	0	0	107.6	I102 L107 L116 F120 Y144 A145 I147 I172 T173 V174	I102-I104 HydrophobicContact CG2-CG1 4.38Å; I104-L107 HydrophobicContact CB-CD1 4.38Å; I104-L107 HydrophobicContact CG2-CD1 4.17Å; I104-L107 HydrophobicContact CG2-CD2 3.55Å; I104-L107 HydrophobicContact CG2-CG 3.85Å; I104-L116 HydrophobicContact CD1-CD2 4.27Å; I104-F120 HydrophobicContact CD1-CD2 4.06Å; I104-F120 HydrophobicContact CD1-CE1 3.97Å; I104-F120 HydrophobicContact CD1-CE2 3.47Å; I104-F120 VanDerWaalsContact CD1-CE2 3.47Å; I104-F120 HydrophobicContact CD1-CZ 3.42Å; I104-F120 VanDerWaalsContact CD1-CZ 3.42Å; I104-F120 HydrophobicContact CG1-CE1 4.48Å; I104-F120 HydrophobicContact CG1-CE2 4.49Å; I104-F120 HydrophobicContact CG1-CZ 4.02Å; I104-Y144 CarbonylContact O-C 3.59Å; I104-Y144 WeakPolarHBondContact O-CA 3.42Å; I104-Y144 VanDerWaalsContact O-CB 3.26Å; I104-Y144 WeakPolarHBondContact O-CB 3.2Å; I104-A145 PolarHBondContact N-O 3.46Å; I104-A145 PolarHBondContact O-N 3.49Å; I104-I147 HydrophobicContact CD1-CD1 3.34Å; I104-I147 HydrophobicContact CD1-CG1 3.73Å; I104-I172 HydrophobicContact CG2-CB 4.11Å; I104-I172 HydrophobicContact CG2-CD1 4.12Å; I104-T173 CarbonylContact C-O 3.47Å; I104-T173 WeakPolarHBondContact CA-O 3.37Å; I104-V174 HydrophobicContact CG1-CG1 4.37Å; I104-V174 HydrophobicContact CG1-CG2 4.45Å; I104-V174 HydrophobicContact CG2-CG2 4.33Å
105	G	92.3	Very high	82.4	Confident	6 Å²	6	46 Å²	46	6%	0.062	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	167.8	177.4	0	0	0	0	0	112.8	L107 G143 I172 T173	G105-L107 PolarHBondContact O-N 3.44Å; G105-G143 CarbonylContact C-O 3.57Å; G105-I172 WeakPolarHBondContact O-CA 3.28Å; G105-T173 PolarHBondContact N-O 2.78Å; G105-T173 PolarHBondContact O-N 3Å
106	N	91.8	Very high	84.1	Confident	73 Å²	73	40.1 Å²	40.1	39%	0.39	21%	0.205	S	C	.	.	S	Bend	trans	56.8	33.2	-178.5	-160.4	42	0	0	0	114.2	G143 P171	N106-G143 PolarHBondContact N-O 2.98Å; N106-P171 PolarHBondContact ND2-O 3.35Å
107	L	91.3	Very high	85.5	Confident	5 Å²	5	40 Å²	40	3%	0.026	20%	0.2	C	C	.	.			trans	-67.3	141.7	172.2	-68.3	176.2	0	0	0	110.6	I104 G105 L116 G143 A145 L167 I172	I104-L107 HydrophobicContact CB-CD1 4.38Å; I104-L107 HydrophobicContact CG2-CD1 4.17Å; I104-L107 HydrophobicContact CG2-CD2 3.55Å; I104-L107 HydrophobicContact CG2-CG 3.85Å; G105-L107 PolarHBondContact O-N 3.44Å; L107-L116 HydrophobicContact CD1-CD1 3.96Å; L107-L116 HydrophobicContact CD1-CD2 4.28Å; L107-L116 HydrophobicContact CD2-CD2 3.97Å; L107-G143 PolarHBondContact N-O 2.93Å; L107-G143 WeakPolarHBondContact O-CA 3.37Å; L107-A145 HydrophobicContact CD1-CB 3.45Å; L107-A145 VanDerWaalsContact CD1-CB 3.45Å; L107-L167 HydrophobicContact CD2-CD2 4.17Å; L107-I172 HydrophobicContact CD2-CB 4.45Å; L107-I172 HydrophobicContact CD2-CG2 3.7Å
108	D	89.6	Confident	86.7	Confident	13 Å²	13	41.2 Å²	41.2	7%	0.07	21%	0.206	C	C	.	.			trans	-69	139.3	171	-165.4	-83.1	0	0	0	110.5	E110 I111 R170	D108-E110 PolarHBondContact O-N 2.7Å; D108-E110 VanDerWaalsContact O-N 3.16Å; D108-E110 WeakPolarHBondContact OD1-CB 3.46Å; D108-E110 WeakPolarHBondContact OD1-CG 3.32Å; D108-E110 PolarHBondContact OD1-N 2.95Å; D108-I111 HydrophobicContact CB-CG1 4.05Å; D108-I111 WeakPolarHBondContact O-CB 3.29Å; D108-I111 WeakPolarHBondContact O-CG1 3.26Å; D108-I111 PolarHBondContact O-N 3.2Å; D108-R170 HydrophobicContact CB-CB 4.48Å; D108-R170 HydrophobicContact CB-CG 4.19Å; D108-R170 WeakPolarHBondContact OD2-CD 3.49Å; D108-R170 IonicContact OD2-NE 3.33Å; D108-R170 PolarHBondContact OD2-NE 3.23Å
109	P	86.5	Confident	87.8	Confident	64 Å²	64	41.9 Å²	41.9	42%	0.416	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.6	-179.3	24.8	-36.2	0	0	0	114.4	I111 S141	P109-I111 VanDerWaalsContact C-N 3.27Å; P109-S141 PolarHBondContact O-OG 3.17Å
110	E	86.3	Confident	88.8	Confident	152 Å²	152	41.9 Å²	41.9	71%	0.71	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.2	175.5	-59.1	-169.3	100.7	0	0	113.3	D108 D112	D108-E110 PolarHBondContact O-N 2.7Å; D108-E110 VanDerWaalsContact O-N 3.16Å; D108-E110 WeakPolarHBondContact OD1-CB 3.46Å; D108-E110 WeakPolarHBondContact OD1-CG 3.32Å; D108-E110 PolarHBondContact OD1-N 2.95Å; E110-D112 PolarHBondContact O-N 2.92Å
111	I	87.8	Confident	89.1	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	23%	0.227	C	C	.	.			trans	-71.6	125	178	-60.4	-68.5	0	0	0	110.5	D108 P109 L115 L116 I132 L167 C168	D108-I111 HydrophobicContact CB-CG1 4.05Å; D108-I111 WeakPolarHBondContact O-CB 3.29Å; D108-I111 WeakPolarHBondContact O-CG1 3.26Å; D108-I111 PolarHBondContact O-N 3.2Å; P109-I111 VanDerWaalsContact C-N 3.27Å; I111-L115 HydrophobicContact CD1-CD2 3.51Å; I111-L116 HydrophobicContact CG2-CD1 4.23Å; I111-L116 HydrophobicContact CG2-CD2 3.96Å; I111-L116 HydrophobicContact CG2-CG 3.68Å; I111-I132 HydrophobicContact CG2-CD1 4.5Å; I111-I132 VanDerWaalsContact O-CD1 3.26Å; I111-I132 WeakPolarHBondContact O-CD1 3.42Å; I111-L167 HydrophobicContact CD1-CD2 3.87Å; I111-L167 HydrophobicContact CD1-CG 3.87Å; I111-L167 HydrophobicContact CG1-CD2 4.4Å; I111-L167 HydrophobicContact CG2-CD2 4.4Å; I111-C168 HydrophobicContact CD1-CB 4.06Å; I111-C168 WeakPolarHBondContact CD1-SG 3.44Å
112	D	86.6	Confident	89.1	Confident	66 Å²	66	47.1 Å²	47.1	35%	0.353	26%	0.255	S	S	.	.			trans	-92.5	156.8	169.3	-79.4	-66.6	0	0	0	112.3	K78 E110 K114 L115 L116 R134	K78-D112 IonicContact NZ-OD1 2.97Å; K78-D112 PolarHBondContact NZ-OD1 2.9Å; E110-D112 PolarHBondContact O-N 2.92Å; D112-K114 PolarHBondContact O-N 3.15Å; D112-L115 PolarHBondContact O-N 3.05Å; D112-L116 PolarHBondContact O-N 2.8Å; D112-R134 IonicContact OD1-NH2 2.94Å
113	E	86.6	Confident	89	Confident	22 Å²	22	49.9 Å²	49.9	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-30.5	177.3	-63.9	80.4	177.2	0	0	112.2	M76 Y117 P130 I132 R134	M76-E113 HydrophobicContact CE-CB 3.14Å; M76-E113 HydrophobicContact CE-CG 4.02Å; E113-Y117 PolarHBondContact O-N 2.94Å; E113-P130 VanDerWaalsContact CG-O 3.29Å; E113-P130 WeakPolarHBondContact CG-O 3.47Å; E113-I132 HydrophobicContact CB-CD1 4.33Å; E113-I132 HydrophobicContact CG-CB 4.18Å; E113-I132 HydrophobicContact CG-CD1 3.75Å; E113-I132 HydrophobicContact CG-CG1 3.83Å; E113-R134 IonicContact OE1-CZ 3.85Å; E113-R134 IonicContact OE1-NE 3.71Å; E113-R134 PolarHBondContact OE1-NE 2.87Å; E113-R134 IonicContact OE1-NH2 3.95Å; E113-R134 PolarHBondContact OE1-NH2 2.71Å; E113-R134 IonicContact OE2-NH2 3.52Å; E113-R134 PolarHBondContact OE2-NH2 2.79Å
114	K	85.4	Confident	88.6	Confident	128 Å²	128	47.4 Å²	47.4	56%	0.557	26%	0.259	S	S	*	.	H	α-helix	trans	-65.4	-42.2	175.3	-177.7	178.3	-177.2	-72.1	0	112	M76 D112 Y117 D118	M76-K114 HydrophobicContact CB-CB 4.17Å; D112-K114 PolarHBondContact O-N 3.15Å; K114-Y117 PolarHBondContact O-N 3.43Å; K114-D118 WeakPolarHBondContact O-CB 3.26Å; K114-D118 PolarHBondContact O-N 3.13Å
115	L	88.8	Confident	88.2	Confident	66 Å²	66	50.2 Å²	50.2	35%	0.346	28%	0.276	S	S	.	.	H	α-helix	trans	-67.4	-40.1	179	179.9	61.9	0	0	0	110.7	I111 D112 Y117 D118 T119	I111-L115 HydrophobicContact CD1-CD2 3.51Å; D112-L115 PolarHBondContact O-N 3.05Å; L115-Y117 VanDerWaalsContact C-N 3.33Å; L115-D118 PolarHBondContact O-N 2.87Å; L115-T119 VanDerWaalsContact O-CB 3.31Å; L115-T119 WeakPolarHBondContact O-CB 3.33Å; L115-T119 PolarHBondContact O-N 2.76Å; L115-T119 PolarHBondContact O-OG1 3.26Å
116	L	89.5	Confident	87.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-44.7	171.7	-71.1	175.3	0	0	0	111.5	I104 L107 I111 D112 F120 P130 I132 A145 I147 L167	I104-L116 HydrophobicContact CD1-CD2 4.27Å; L107-L116 HydrophobicContact CD1-CD1 3.96Å; L107-L116 HydrophobicContact CD1-CD2 4.28Å; L107-L116 HydrophobicContact CD2-CD2 3.97Å; I111-L116 HydrophobicContact CG2-CD1 4.23Å; I111-L116 HydrophobicContact CG2-CD2 3.96Å; I111-L116 HydrophobicContact CG2-CG 3.68Å; D112-L116 PolarHBondContact O-N 2.8Å; L116-F120 HydrophobicContact CD2-CD2 4.22Å; L116-F120 HydrophobicContact CD2-CE2 3.9Å; L116-F120 WeakPolarHBondContact O-CB 3.2Å; L116-F120 VanDerWaalsContact O-CD2 3.32Å; L116-F120 WeakPolarHBondContact O-CD2 3.48Å; L116-F120 PolarHBondContact O-N 3.18Å; L116-P130 HydrophobicContact CB-CB 3.93Å; L116-P130 HydrophobicContact CB-CG 4.13Å; L116-P130 HydrophobicContact CD1-CB 4.22Å; L116-I132 HydrophobicContact CD1-CD1 3.78Å; L116-I132 HydrophobicContact CD1-CG1 3.62Å; L116-A145 HydrophobicContact CD1-CB 3.63Å; L116-I147 HydrophobicContact CB-CD1 4.33Å; L116-L167 HydrophobicContact CD2-CD2 3.82Å
117	Y	87.9	Confident	87.2	Confident	62 Å²	62	48.7 Å²	48.7	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-51.1	178.5	-176.2	-92.2	0	0	0	111.2	E113 K114 L115 T119 F120 S121 I126 P130	E113-Y117 PolarHBondContact O-N 2.94Å; K114-Y117 PolarHBondContact O-N 3.43Å; L115-Y117 VanDerWaalsContact C-N 3.33Å; Y117-T119 PolarHBondContact O-N 2.9Å; Y117-F120 PolarHBondContact O-N 2.88Å; Y117-S121 WeakPolarHBondContact O-CA 3.36Å; Y117-S121 WeakPolarHBondContact O-CB 3.49Å; Y117-S121 PolarHBondContact O-N 3.09Å; Y117-S121 PolarHBondContact O-OG 2.92Å; Y117-I126 HydrophobicContact CD2-CB 4.08Å; Y117-I126 HydrophobicContact CD2-CD1 3.73Å; Y117-I126 HydrophobicContact CD2-CG2 4.06Å; Y117-I126 HydrophobicContact CE2-CB 3.78Å; Y117-I126 HydrophobicContact CE2-CD1 4.15Å; Y117-I126 HydrophobicContact CE2-CG2 4.06Å; Y117-I126 HydrophobicContact CG-CD1 4.29Å; Y117-P130 HydrophobicContact CD2-CG 4.4Å
118	D	88.4	Confident	86.5	Confident	103 Å²	103	51.7 Å²	51.7	55%	0.551	28%	0.28	S	S	*	.	H	α-helix	trans	-57	-50	179.4	-170.3	-100.7	0	0	0	111.5	K114 L115 S121	K114-D118 WeakPolarHBondContact O-CB 3.26Å; K114-D118 PolarHBondContact O-N 3.13Å; L115-D118 PolarHBondContact O-N 2.87Å; D118-S121 PolarHBondContact O-OG 3.27Å
119	T	89.5	Confident	85.9	Confident	28 Å²	28	51.7 Å²	51.7	17%	0.172	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-46.2	-177.7	-50.5	0	0	0	0	112.4	L115 Y117 M162 L167	L115-T119 VanDerWaalsContact O-CB 3.31Å; L115-T119 WeakPolarHBondContact O-CB 3.33Å; L115-T119 PolarHBondContact O-N 2.76Å; L115-T119 PolarHBondContact O-OG1 3.26Å; Y117-T119 PolarHBondContact O-N 2.9Å; T119-M162 HydrophobicContact CG2-CE 3.16Å; T119-L167 HydrophobicContact CG2-CD1 3.95Å
120	F	89.9	Confident	85.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-84.5	-17.2	-175.4	-77.8	-89.7	0	0	0	113.3	I104 L116 Y117 A122 F123 I126 I147 F149 A158 M162 I172 V174	I104-F120 HydrophobicContact CD1-CD2 4.06Å; I104-F120 HydrophobicContact CD1-CE1 3.97Å; I104-F120 HydrophobicContact CD1-CE2 3.47Å; I104-F120 VanDerWaalsContact CD1-CE2 3.47Å; I104-F120 HydrophobicContact CD1-CZ 3.42Å; I104-F120 VanDerWaalsContact CD1-CZ 3.42Å; I104-F120 HydrophobicContact CG1-CE1 4.48Å; I104-F120 HydrophobicContact CG1-CE2 4.49Å; I104-F120 HydrophobicContact CG1-CZ 4.02Å; L116-F120 HydrophobicContact CD2-CD2 4.22Å; L116-F120 HydrophobicContact CD2-CE2 3.9Å; L116-F120 WeakPolarHBondContact O-CB 3.2Å; L116-F120 VanDerWaalsContact O-CD2 3.32Å; L116-F120 WeakPolarHBondContact O-CD2 3.48Å; L116-F120 PolarHBondContact O-N 3.18Å; Y117-F120 PolarHBondContact O-N 2.88Å; F120-A122 PolarHBondContact O-N 2.82Å; F120-F123 HydrophobicContact CD1-CD2 4.28Å; F120-F123 HydrophobicContact CD1-CE2 4.45Å; F120-F123 PolarHBondContact O-N 3.4Å; F120-I126 HydrophobicContact CB-CD1 3.97Å; F120-I147 HydrophobicContact CB-CD1 3.82Å; F120-I147 HydrophobicContact CD1-CD1 4.24Å; F120-I147 HydrophobicContact CD2-CD1 3.64Å; F120-I147 HydrophobicContact CE2-CD1 4.27Å; F120-I147 HydrophobicContact CG-CD1 3.62Å; F120-F149 HydrophobicContact CB-CZ 4.05Å; F120-F149 HydrophobicContact CD1-CZ 4.16Å; F120-A158 HydrophobicContact CD1-CB 4.09Å; F120-A158 HydrophobicContact CE1-CB 4.33Å; F120-M162 HydrophobicContact CE1-CB 4.11Å; F120-M162 HydrophobicContact CE1-CG 4.07Å; F120-M162 HydrophobicContact CZ-CB 4.24Å; F120-M162 HydrophobicContact CZ-CG 4.32Å; F120-I172 HydrophobicContact CE2-CD1 4.33Å; F120-I172 HydrophobicContact CZ-CD1 3.86Å; F120-V174 HydrophobicContact CE1-CG1 4.44Å; F120-V174 HydrophobicContact CE1-CG2 4.47Å; F120-V174 HydrophobicContact CZ-CG2 4.27Å
121	S	88.9	Confident	85.8	Confident	49 Å²	49	47.2 Å²	47.2	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-22.3	174.4	69.4	0	0	0	0	112.9	Y117 D118 F123 G124	Y117-S121 WeakPolarHBondContact O-CA 3.36Å; Y117-S121 WeakPolarHBondContact O-CB 3.49Å; Y117-S121 PolarHBondContact O-N 3.09Å; Y117-S121 PolarHBondContact O-OG 2.92Å; D118-S121 PolarHBondContact O-OG 3.27Å; S121-F123 PolarHBondContact O-N 3.14Å; S121-G124 PolarHBondContact O-N 2.86Å
122	A	88.6	Confident	85.9	Confident	87 Å²	87	47.8 Å²	47.8	72%	0.719	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.2	176.2	0	0	0	0	0	113.8	F120	F120-A122 PolarHBondContact O-N 2.82Å
123	F	88.7	Confident	85.9	Confident	57 Å²	57	47 Å²	47	25%	0.25	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-19.1	178.7	-56.3	-75	0	0	0	113.1	F120 S121 A154 A157 A158 A161 M162	F120-F123 HydrophobicContact CD1-CD2 4.28Å; F120-F123 HydrophobicContact CD1-CE2 4.45Å; F120-F123 PolarHBondContact O-N 3.4Å; S121-F123 PolarHBondContact O-N 3.14Å; F123-A154 WeakPolarHBondContact O-CA 3.45Å; F123-A154 VanDerWaalsContact O-CB 3.28Å; F123-A154 WeakPolarHBondContact O-CB 3.45Å; F123-A157 HydrophobicContact CD1-CB 4.4Å; F123-A158 HydrophobicContact CB-CB 4Å; F123-A158 HydrophobicContact CD2-CB 3.85Å; F123-A158 HydrophobicContact CG-CB 3.88Å; F123-A161 HydrophobicContact CD1-CB 4.41Å; F123-A161 HydrophobicContact CE1-CB 3.44Å; F123-A161 VanDerWaalsContact CE1-CB 3.44Å; F123-A161 HydrophobicContact CZ-CB 3.82Å; F123-M162 HydrophobicContact CE2-CE 3.76Å; F123-M162 HydrophobicContact CE2-CG 3.48Å; F123-M162 VanDerWaalsContact CE2-CG 3.48Å; F123-M162 HydrophobicContact CE2-SD 4.21Å; F123-M162 HydrophobicContact CZ-CE 3.99Å; F123-M162 HydrophobicContact CZ-CG 3.49Å; F123-M162 VanDerWaalsContact CZ-CG 3.49Å; F123-M162 HydrophobicContact CZ-SD 4Å
124	G	84.6	Confident	85.9	Confident	12 Å²	12	49.9 Å²	49.9	12%	0.124	26%	0.26	C	S	.	.	S	Bend	trans	159.5	177.8	175.2	0	0	0	0	0	113.5	S121 I126	S121-G124 PolarHBondContact O-N 2.86Å; G124-I126 PolarHBondContact O-N 3.32Å
125	V	82.5	Confident	85.8	Confident	59 Å²	59	46 Å²	46	36%	0.358	25%	0.245	S	C	.	.			trans	-66.4	120.9	-176.3	-176.2	0	0	0	0	111.2	A150 D205	V125-A150 HydrophobicContact CB-CB 4.01Å; V125-A150 HydrophobicContact CG1-CB 4.39Å; V125-A150 WeakPolarHBondContact O-CB 3.49Å; V125-A150 PolarHBondContact O-N 3Å; V125-D205 HydrophobicContact CG2-CB 3.96Å; V125-D205 VanDerWaalsContact CG2-CG 3.42Å
126	I	85.4	Confident	85.3	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.046	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.5	173.1	-62.7	170.7	0	0	0	108.4	Y117 F120 G124 Q128 I147 N148 F149	Y117-I126 HydrophobicContact CD2-CB 4.08Å; Y117-I126 HydrophobicContact CD2-CD1 3.73Å; Y117-I126 HydrophobicContact CD2-CG2 4.06Å; Y117-I126 HydrophobicContact CE2-CB 3.78Å; Y117-I126 HydrophobicContact CE2-CD1 4.15Å; Y117-I126 HydrophobicContact CE2-CG2 4.06Å; Y117-I126 HydrophobicContact CG-CD1 4.29Å; F120-I126 HydrophobicContact CB-CD1 3.97Å; G124-I126 PolarHBondContact O-N 3.32Å; I126-Q128 WeakPolarHBondContact CG2-O 3.28Å; I126-I147 HydrophobicContact CD1-CG2 4.09Å; I126-I147 HydrophobicContact CG1-CG2 3.96Å; I126-I147 HydrophobicContact CG2-CG2 3.89Å; I126-N148 CarbonylContact C-O 3.57Å; I126-F149 HydrophobicContact CG1-CD1 4.19Å; I126-F149 HydrophobicContact CG1-CE1 3.89Å; I126-F149 HydrophobicContact CG1-CZ 4.42Å
127	L	78.1	Confident	84.8	Confident	38 Å²	38	55.2 Å²	55.2	20%	0.199	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-36.3	-179.3	-68.9	-179.9	0	0	0	112.6	L96 N148 A150 L201	L96-L127 WeakPolarHBondContact O-CD1 3.43Å; L127-N148 PolarHBondContact N-O 2.85Å; L127-A150 HydrophobicContact CD1-CB 4.35Å; L127-A150 HydrophobicContact CD2-CB 3.68Å; L127-A150 HydrophobicContact CG-CB 3.82Å; L127-L201 HydrophobicContact CD2-CD2 4.21Å
128	Q	76.9	Confident	84.4	Confident	68 Å²	68	56.6 Å²	56.6	32%	0.318	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137.7	-176.5	-60	-175	-38.9	0	0	110.2	N95 I126 N148	N95-Q128 PolarHBondContact OD1-NE2 3.47Å; I126-Q128 WeakPolarHBondContact CG2-O 3.28Å; Q128-N148 HydrophobicContact CB-CB 3.94Å; Q128-N148 HydrophobicContact CG-CB 4.09Å; Q128-N148 PolarHBondContact OE1-ND2 2.86Å; Q128-N148 VanDerWaalsContact OE1-ND2 3.13Å
129	T	76.6	Confident	83.8	Confident	13 Å²	13	53.8 Å²	53.8	8%	0.08	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-41.6	127.1	169.7	-60	0	0	0	0	112.2	M76 R85 K131	M76-T129 HydrophobicContact CE-CG2 3.39Å; M76-T129 HydrophobicContact SD-CG2 3.12Å; M76-T129 WeakPolarHBondContact SD-CG2 3.32Å; R85-T129 WeakPolarHBondContact CD-OG1 3.46Å; R85-T129 WeakPolarHBondContact CG-OG1 3.13Å; R85-T129 PolarHBondContact NE-OG1 2.92Å; T129-K131 PolarHBondContact O-N 3.07Å
130	P	85.6	Confident	83.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	124.4	171.8	-29.1	36.3	0	0	0	110.5	E113 L116 Y117 F146 I147	E113-P130 VanDerWaalsContact CG-O 3.29Å; E113-P130 WeakPolarHBondContact CG-O 3.47Å; L116-P130 HydrophobicContact CB-CB 3.93Å; L116-P130 HydrophobicContact CB-CG 4.13Å; L116-P130 HydrophobicContact CD1-CB 4.22Å; Y117-P130 HydrophobicContact CD2-CG 4.4Å; P130-F146 WeakPolarHBondContact CA-O 3.09Å; P130-I147 HydrophobicContact CB-CD1 4.22Å; P130-I147 HydrophobicContact CB-CG1 3.94Å; P130-I147 HydrophobicContact CG-CD1 4.11Å; P130-I147 HydrophobicContact CG-CG1 4.12Å
131	K	85.9	Confident	83	Confident	122 Å²	122	58.5 Å²	58.5	53%	0.53	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	101.9	-179.2	-172.8	-177.2	178.9	-177.2	0	109.2	T129 A145 F146	T129-K131 PolarHBondContact O-N 3.07Å; K131-A145 CarbonylContact O-C 3.54Å; K131-A145 WeakPolarHBondContact O-CA 3.36Å; K131-F146 PolarHBondContact N-O 3.31Å; K131-F146 PolarHBondContact O-N 3.39Å
132	I	89	Confident	82.9	Confident	14 Å²	14	60.6 Å²	60.6	7%	0.072	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.5	169.1	-62.7	171.7	0	0	0	108.3	I111 E113 L116 R134 A145	I111-I132 HydrophobicContact CG2-CD1 4.5Å; I111-I132 VanDerWaalsContact O-CD1 3.26Å; I111-I132 WeakPolarHBondContact O-CD1 3.42Å; E113-I132 HydrophobicContact CB-CD1 4.33Å; E113-I132 HydrophobicContact CG-CB 4.18Å; E113-I132 HydrophobicContact CG-CD1 3.75Å; E113-I132 HydrophobicContact CG-CG1 3.83Å; L116-I132 HydrophobicContact CD1-CD1 3.78Å; L116-I132 HydrophobicContact CD1-CG1 3.62Å; I132-R134 HydrophobicContact CG2-CG 4.06Å; I132-R134 PolarHBondContact O-N 2.78Å; I132-A145 HydrophobicContact CB-CB 4.49Å; I132-A145 HydrophobicContact CG1-CB 3.87Å
133	M	87.6	Confident	82.9	Confident	51 Å²	51	57.1 Å²	57.1	25%	0.251	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	110.3	173.5	-76.5	-65.9	-52.7	0	0	108.6	K142 Y144 F146	M133-K142 VanDerWaalsContact O-CB 3.27Å; M133-K142 WeakPolarHBondContact O-CB 3.38Å; M133-K142 WeakPolarHBondContact O-CG 3.12Å; M133-K142 PolarHBondContact O-N 2.9Å; M133-Y144 HydrophobicContact CB-CD2 3.85Å; M133-Y144 HydrophobicContact CB-CE1 4.22Å; M133-Y144 HydrophobicContact CB-CE2 3.38Å; M133-Y144 HydrophobicContact CB-CG 4.46Å; M133-Y144 HydrophobicContact CG-CD2 3.93Å; M133-Y144 HydrophobicContact CG-CE2 3.34Å; M133-Y144 PolarHBondContact N-O 3.44Å; M133-F146 HydrophobicContact CG-CD2 4.41Å; M133-F146 HydrophobicContact CG-CE2 4.1Å
134	R	86.6	Confident	83	Confident	82 Å²	82	57.6 Å²	57.6	31%	0.309	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	151	174.4	-59.8	178.1	-173.5	-106.4	4.9	109.7	D112 E113 I132 N140 S141	D112-R134 IonicContact OD1-NH2 2.94Å; E113-R134 IonicContact OE1-CZ 3.85Å; E113-R134 IonicContact OE1-NE 3.71Å; E113-R134 PolarHBondContact OE1-NE 2.87Å; E113-R134 IonicContact OE1-NH2 3.95Å; E113-R134 PolarHBondContact OE1-NH2 2.71Å; E113-R134 IonicContact OE2-NH2 3.52Å; E113-R134 PolarHBondContact OE2-NH2 2.79Å; I132-R134 HydrophobicContact CG2-CG 4.06Å; I132-R134 PolarHBondContact O-N 2.78Å; R134-N140 CarbonylContact C-O 3.54Å; R134-N140 WeakPolarHBondContact CA-O 3.49Å; R134-S141 PolarHBondContact NH1-OG 3.44Å
135	D	83.8	Confident	83.3	Confident	45 Å²	45	57 Å²	57	24%	0.241	31%	0.307	C	S	.	.			trans	-70	128.2	174.1	-167.7	-94.1	0	0	0	109.7	D137 T138 G139 N140 K142	D135-D137 VanDerWaalsContact C-N 3.27Å; D135-D137 PolarHBondContact O-N 2.94Å; D135-D137 PolarHBondContact OD1-N 3.46Å; D135-T138 WeakPolarHBondContact CB-OG1 3.45Å; D135-T138 PolarHBondContact OD1-N 3.27Å; D135-T138 VanDerWaalsContact OD1-N 3.14Å; D135-T138 PolarHBondContact OD1-OG1 3.07Å; D135-T138 VanDerWaalsContact OD1-OG1 3.05Å; D135-G139 WeakPolarHBondContact O-CA 3.46Å; D135-G139 PolarHBondContact O-N 2.9Å; D135-N140 WeakPolarHBondContact CB-O 3.21Å; D135-N140 PolarHBondContact N-O 3.5Å; D135-K142 HydrophobicContact CB-CG 4.44Å; D135-K142 IonicContact OD2-NZ 3.2Å
136	P	77.1	Confident	83.8	Confident	113 Å²	113	57.1 Å²	57.1	73%	0.734	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.9	-173.8	27.2	-32.7	0	0	0	113.1
137	D	80.1	Confident	84	Confident	148 Å²	148	56.8 Å²	56.8	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-42.9	-177.2	-58.2	-84.8	0	0	0	111.5	D135	D135-D137 VanDerWaalsContact C-N 3.27Å; D135-D137 PolarHBondContact O-N 2.94Å; D135-D137 PolarHBondContact OD1-N 3.46Å
138	T	79.6	Confident	84.4	Confident	91 Å²	91	55.1 Å²	55.1	56%	0.558	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-14	-175.7	57.2	0	0	0	0	114.1	D135 N140	D135-T138 WeakPolarHBondContact CB-OG1 3.45Å; D135-T138 PolarHBondContact OD1-N 3.27Å; D135-T138 VanDerWaalsContact OD1-N 3.14Å; D135-T138 PolarHBondContact OD1-OG1 3.07Å; D135-T138 VanDerWaalsContact OD1-OG1 3.05Å; T138-N140 PolarHBondContact O-N 3.17Å; T138-N140 VanDerWaalsContact O-N 3.12Å
139	G	74.5	Confident	85	Confident	43 Å²	43	51.9 Å²	51.9	44%	0.443	28%	0.278	S	S	.	.			trans	70	-3.1	-173.2	0	0	0	0	0	114.3	D135	D135-G139 WeakPolarHBondContact O-CA 3.46Å; D135-G139 PolarHBondContact O-N 2.9Å
140	N	79.9	Confident	85.3	Confident	109 Å²	109	51.5 Å²	51.5	58%	0.583	28%	0.276	S	S	*	.			trans	-71.9	138.4	-177.6	-78.7	-3.3	0	0	0	111.1	R134 D135 T138 K142	R134-N140 CarbonylContact C-O 3.54Å; R134-N140 WeakPolarHBondContact CA-O 3.49Å; D135-N140 WeakPolarHBondContact CB-O 3.21Å; D135-N140 PolarHBondContact N-O 3.5Å; T138-N140 PolarHBondContact O-N 3.17Å; T138-N140 VanDerWaalsContact O-N 3.12Å; N140-K142 PolarHBondContact O-N 2.97Å
141	S	84	Confident	85.1	Confident	18 Å²	18	53 Å²	53	13%	0.126	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	129.6	174.6	-58.7	0	0	0	0	110.3	P109 R134 G143	P109-S141 PolarHBondContact O-OG 3.17Å; R134-S141 PolarHBondContact NH1-OG 3.44Å; S141-G143 PolarHBondContact O-N 3.2Å; S141-G143 VanDerWaalsContact O-N 3.09Å
142	K	86.4	Confident	85.1	Confident	93 Å²	93	47.5 Å²	47.5	40%	0.404	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	5.5	175	-59.5	-169.9	173.9	-165.8	0	112.8	M133 D135 N140 Y144	M133-K142 VanDerWaalsContact O-CB 3.27Å; M133-K142 WeakPolarHBondContact O-CB 3.38Å; M133-K142 WeakPolarHBondContact O-CG 3.12Å; M133-K142 PolarHBondContact O-N 2.9Å; D135-K142 HydrophobicContact CB-CG 4.44Å; D135-K142 IonicContact OD2-NZ 3.2Å; N140-K142 PolarHBondContact O-N 2.97Å; K142-Y144 HydrophobicContact CB-CD1 3.77Å; K142-Y144 HydrophobicContact CB-CE1 3.32Å; K142-Y144 HydrophobicContact CD-CE1 4.07Å; K142-Y144 HydrophobicContact CG-CE1 4.31Å; K142-Y144 VanDerWaalsContact O-CD1 3.29Å; K142-Y144 WeakPolarHBondContact O-CD1 3.26Å
143	G	87.6	Confident	85.1	Confident	15 Å²	15	52.9 Å²	52.9	16%	0.155	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.6	21.2	179.2	0	0	0	0	0	114.2	G105 N106 L107 S141	G105-G143 CarbonylContact C-O 3.57Å; N106-G143 PolarHBondContact N-O 2.98Å; L107-G143 PolarHBondContact N-O 2.93Å; L107-G143 WeakPolarHBondContact O-CA 3.37Å; S141-G143 PolarHBondContact O-N 3.2Å; S141-G143 VanDerWaalsContact O-N 3.09Å
144	Y	91.2	Very high	85.2	Confident	66 Å²	66	50.8 Å²	50.8	26%	0.259	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.1	173.4	63.7	-87.8	0	0	0	113.4	F103 I104 M133 K142 F146	F103-Y144 HydrophobicContact CD2-CD2 4.47Å; F103-Y144 AromaticContact CE2-CD2 3.73Å; F103-Y144 HydrophobicContact CE2-CD2 3.73Å; F103-Y144 AromaticContact CE2-CG 3.86Å; F103-Y144 HydrophobicContact CE2-CG 3.86Å; F103-Y144 HydrophobicContact CZ-CG 4.36Å; I104-Y144 CarbonylContact O-C 3.59Å; I104-Y144 WeakPolarHBondContact O-CA 3.42Å; I104-Y144 VanDerWaalsContact O-CB 3.26Å; I104-Y144 WeakPolarHBondContact O-CB 3.2Å; M133-Y144 HydrophobicContact CB-CD2 3.85Å; M133-Y144 HydrophobicContact CB-CE1 4.22Å; M133-Y144 HydrophobicContact CB-CE2 3.38Å; M133-Y144 HydrophobicContact CB-CG 4.46Å; M133-Y144 HydrophobicContact CG-CD2 3.93Å; M133-Y144 HydrophobicContact CG-CE2 3.34Å; M133-Y144 PolarHBondContact N-O 3.44Å; K142-Y144 HydrophobicContact CB-CD1 3.77Å; K142-Y144 HydrophobicContact CB-CE1 3.32Å; K142-Y144 HydrophobicContact CD-CE1 4.07Å; K142-Y144 HydrophobicContact CG-CE1 4.31Å; K142-Y144 VanDerWaalsContact O-CD1 3.29Å; K142-Y144 WeakPolarHBondContact O-CD1 3.26Å; Y144-F146 AromaticContact CD2-CE2 3.91Å; Y144-F146 HydrophobicContact CD2-CE2 3.91Å; Y144-F146 HydrophobicContact CD2-CZ 4.33Å; Y144-F146 AromaticContact CE2-CE2 3.92Å; Y144-F146 HydrophobicContact CE2-CE2 3.92Å; Y144-F146 HydrophobicContact CE2-CZ 4.38Å
145	A	91.9	Very high	85.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	163.8	-179.7	0	0	0	0	0	112.2	I104 L107 L116 K131 I132	I104-A145 PolarHBondContact N-O 3.46Å; I104-A145 PolarHBondContact O-N 3.49Å; L107-A145 HydrophobicContact CD1-CB 3.45Å; L107-A145 VanDerWaalsContact CD1-CB 3.45Å; L116-A145 HydrophobicContact CD1-CB 3.63Å; K131-A145 CarbonylContact O-C 3.54Å; K131-A145 WeakPolarHBondContact O-CA 3.36Å; I132-A145 HydrophobicContact CB-CB 4.49Å; I132-A145 HydrophobicContact CG1-CB 3.87Å
146	F	91.3	Very high	85.6	Confident	62 Å²	62	46.8 Å²	46.8	27%	0.272	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.4	172.7	-61.5	-86.8	0	0	0	110.5	I102 F103 P130 K131 M133 Y144 A177	I102-F146 CarbonylContact O-C 3.45Å; I102-F146 VanDerWaalsContact O-CA 3.29Å; I102-F146 WeakPolarHBondContact O-CA 3.27Å; F103-F146 HydrophobicContact CB-CD1 4.31Å; F103-F146 HydrophobicContact CB-CE1 4.15Å; F103-F146 HydrophobicContact CD2-CD1 4.28Å; F103-F146 AromaticContact CD2-CE1 3.64Å; F103-F146 HydrophobicContact CD2-CE1 3.64Å; F103-F146 AromaticContact CD2-CZ 3.83Å; F103-F146 HydrophobicContact CD2-CZ 3.83Å; F103-F146 HydrophobicContact CE2-CZ 4.38Å; F103-F146 HydrophobicContact CG-CE1 4.38Å; P130-F146 WeakPolarHBondContact CA-O 3.09Å; K131-F146 PolarHBondContact N-O 3.31Å; K131-F146 PolarHBondContact O-N 3.39Å; M133-F146 HydrophobicContact CG-CD2 4.41Å; M133-F146 HydrophobicContact CG-CE2 4.1Å; Y144-F146 AromaticContact CD2-CE2 3.91Å; Y144-F146 HydrophobicContact CD2-CE2 3.91Å; Y144-F146 HydrophobicContact CD2-CZ 4.33Å; Y144-F146 AromaticContact CE2-CE2 3.92Å; Y144-F146 HydrophobicContact CE2-CE2 3.92Å; Y144-F146 HydrophobicContact CE2-CZ 4.38Å; F146-A177 HydrophobicContact CD1-CB 3.88Å; F146-A177 HydrophobicContact CE1-CB 4.05Å
147	I	90.3	Very high	86.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.9	177	-56.9	-170.6	0	0	0	109.2	N101 I102 I104 L116 F120 I126 P130 F149	N101-I147 CarbonylContact C-O 3.58Å; N101-I147 WeakPolarHBondContact CA-O 3.48Å; N101-I147 VanDerWaalsContact OD1-C 3.3Å; N101-I147 PolarHBondContact OD1-O 3.2Å; N101-I147 VanDerWaalsContact OD1-O 3.05Å; I102-I147 PolarHBondContact N-O 2.89Å; I102-I147 PolarHBondContact O-N 3.25Å; I104-I147 HydrophobicContact CD1-CD1 3.34Å; I104-I147 HydrophobicContact CD1-CG1 3.73Å; L116-I147 HydrophobicContact CB-CD1 4.33Å; F120-I147 HydrophobicContact CB-CD1 3.82Å; F120-I147 HydrophobicContact CD1-CD1 4.24Å; F120-I147 HydrophobicContact CD2-CD1 3.64Å; F120-I147 HydrophobicContact CE2-CD1 4.27Å; F120-I147 HydrophobicContact CG-CD1 3.62Å; I126-I147 HydrophobicContact CD1-CG2 4.09Å; I126-I147 HydrophobicContact CG1-CG2 3.96Å; I126-I147 HydrophobicContact CG2-CG2 3.89Å; P130-I147 HydrophobicContact CB-CD1 4.22Å; P130-I147 HydrophobicContact CB-CG1 3.94Å; P130-I147 HydrophobicContact CG-CD1 4.11Å; P130-I147 HydrophobicContact CG-CG1 4.12Å; I147-F149 HydrophobicContact CB-CE2 4.29Å; I147-F149 HydrophobicContact CG2-CD2 4.09Å; I147-F149 HydrophobicContact CG2-CE2 3.7Å; I147-F149 HydrophobicContact CG2-CZ 4.06Å
148	N	87.6	Confident	86.8	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.8	177.8	-162	-25.2	0	0	0	109.9	D97 N101 I126 L127 Q128	D97-N148 PolarHBondContact OD2-ND2 3.48Å; N101-N148 WeakPolarHBondContact OD1-CA 3.33Å; N101-N148 WeakPolarHBondContact OD1-CB 3.4Å; N101-N148 PolarHBondContact OD1-N 3.32Å; I126-N148 CarbonylContact C-O 3.57Å; L127-N148 PolarHBondContact N-O 2.85Å; Q128-N148 HydrophobicContact CB-CB 3.94Å; Q128-N148 HydrophobicContact CG-CB 4.09Å; Q128-N148 PolarHBondContact OE1-ND2 2.86Å; Q128-N148 VanDerWaalsContact OE1-ND2 3.13Å
149	F	88	Confident	87.4	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	156.9	178.2	-75.4	-85.2	0	0	0	112.1	A100 I102 F120 I126 I147 S151 A154 S155 A158	A100-F149 HydrophobicContact CB-CB 4.23Å; A100-F149 WeakPolarHBondContact CB-O 3.49Å; A100-F149 PolarHBondContact O-N 2.76Å; I102-F149 HydrophobicContact CD1-CD2 3.56Å; I102-F149 HydrophobicContact CD1-CE2 3.35Å; I102-F149 HydrophobicContact CD1-CZ 4.45Å; I102-F149 HydrophobicContact CG1-CD2 4.14Å; I102-F149 HydrophobicContact CG1-CE2 4.22Å; F120-F149 HydrophobicContact CB-CZ 4.05Å; F120-F149 HydrophobicContact CD1-CZ 4.16Å; I126-F149 HydrophobicContact CG1-CD1 4.19Å; I126-F149 HydrophobicContact CG1-CE1 3.89Å; I126-F149 HydrophobicContact CG1-CZ 4.42Å; I147-F149 HydrophobicContact CB-CE2 4.29Å; I147-F149 HydrophobicContact CG2-CD2 4.09Å; I147-F149 HydrophobicContact CG2-CE2 3.7Å; I147-F149 HydrophobicContact CG2-CZ 4.06Å; F149-S151 VanDerWaalsContact C-N 3.27Å; F149-S151 WeakPolarHBondContact CB-O 3.44Å; F149-S151 PolarHBondContact O-N 2.98Å; F149-A154 HydrophobicContact CB-CB 4.41Å; F149-A154 HydrophobicContact CD1-CB 3.82Å; F149-A154 HydrophobicContact CE1-CB 4.4Å; F149-A154 HydrophobicContact CG-CB 4.3Å; F149-S155 WeakPolarHBondContact CB-OG 3.35Å; F149-A158 HydrophobicContact CE2-CB 4.26Å; F149-A158 HydrophobicContact CZ-CB 4.01Å
150	A	83	Confident	88.3	Confident	5 Å²	5	39 Å²	39	4%	0.041	21%	0.205	C	C	.	.	S	Bend	trans	-70.7	-26.2	174.1	0	0	0	0	0	112.8	V125 L127 S202	V125-A150 HydrophobicContact CB-CB 4.01Å; V125-A150 HydrophobicContact CG1-CB 4.39Å; V125-A150 WeakPolarHBondContact O-CB 3.49Å; V125-A150 PolarHBondContact O-N 3Å; L127-A150 HydrophobicContact CD1-CB 4.35Å; L127-A150 HydrophobicContact CD2-CB 3.68Å; L127-A150 HydrophobicContact CG-CB 3.82Å; A150-S202 PolarHBondContact O-OG 3.09Å
151	S	82.9	Confident	88.8	Confident	33 Å²	33	35.8 Å²	35.8	23%	0.231	19%	0.194	C	C	.	.			trans	-136.4	149.1	-175.3	-176.8	0	0	0	0	111.4	F149 D153 S155	F149-S151 VanDerWaalsContact C-N 3.27Å; F149-S151 WeakPolarHBondContact CB-O 3.44Å; F149-S151 PolarHBondContact O-N 2.98Å; S151-D153 VanDerWaalsContact C-N 3.29Å; S151-D153 PolarHBondContact OG-N 2.92Å; S151-S155 PolarHBondContact O-N 3.47Å; S151-S155 PolarHBondContact O-OG 3.3Å
152	F	85.8	Confident	89.2	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-67.9	-30.9	169.9	-79.2	-76.8	0	0	0	112.6	V98 G99 A100 S155 D156 Y176 G188 E192 R193 A196	V98-F152 HydrophobicContact CG1-CD2 4.1Å; V98-F152 HydrophobicContact CG1-CE2 3.75Å; V98-F152 WeakPolarHBondContact O-CE2 3.33Å; V98-F152 WeakPolarHBondContact O-CZ 3.35Å; G99-F152 VanDerWaalsContact C-CE1 3.47Å; G99-F152 WeakPolarHBondContact O-CE1 3.5Å; G99-F152 VanDerWaalsContact O-CZ 3.24Å; G99-F152 WeakPolarHBondContact O-CZ 3.36Å; A100-F152 HydrophobicContact CB-CD1 4.05Å; A100-F152 HydrophobicContact CB-CD2 4.34Å; A100-F152 HydrophobicContact CB-CE1 4.08Å; A100-F152 HydrophobicContact CB-CE2 4.41Å; A100-F152 HydrophobicContact CB-CG 4.16Å; A100-F152 HydrophobicContact CB-CZ 4.28Å; F152-S155 CarbonylContact O-C 3.57Å; F152-S155 WeakPolarHBondContact O-CA 3.39Å; F152-S155 VanDerWaalsContact O-CB 3.32Å; F152-S155 WeakPolarHBondContact O-CB 3.07Å; F152-S155 PolarHBondContact O-N 2.98Å; F152-D156 PolarHBondContact O-N 2.84Å; F152-D156 VanDerWaalsContact O-OD2 3.11Å; F152-Y176 AromaticContact CD1-CE1 3.98Å; F152-Y176 HydrophobicContact CD1-CE1 3.98Å; F152-Y176 HydrophobicContact CE1-CE1 4.17Å; F152-G188 VanDerWaalsContact CE1-CA 3.45Å; F152-E192 HydrophobicContact CE2-CB 3.75Å; F152-E192 WeakPolarHBondContact CE2-O 3.29Å; F152-E192 HydrophobicContact CZ-CB 3.48Å; F152-E192 VanDerWaalsContact CZ-CB 3.48Å; F152-R193 HydrophobicContact CB-CG 4.01Å; F152-R193 HydrophobicContact CD1-CG 4.08Å; F152-R193 HydrophobicContact CD2-CB 4.21Å; F152-R193 HydrophobicContact CD2-CG 3.73Å; F152-R193 HydrophobicContact CE2-CG 4.19Å; F152-R193 HydrophobicContact CG-CG 3.65Å; F152-A196 HydrophobicContact CD2-CB 3.47Å; F152-A196 VanDerWaalsContact CD2-CB 3.47Å; F152-A196 HydrophobicContact CE2-CB 3.74Å
153	D	88.6	Confident	89.6	Confident	126 Å²	126	35.8 Å²	35.8	67%	0.674	20%	0.196	S	C	*	.	H	α-helix	trans	-60.6	-48.6	178.4	-174.4	-104.6	0	0	0	111.1	S151 S155 D156 A157	S151-D153 VanDerWaalsContact C-N 3.29Å; S151-D153 PolarHBondContact OG-N 2.92Å; D153-S155 PolarHBondContact O-N 3.09Å; D153-D156 PolarHBondContact O-N 3.21Å; D153-A157 WeakPolarHBondContact O-CB 3.46Å; D153-A157 PolarHBondContact O-N 3.27Å
154	A	88.8	Confident	89.8	Confident	7 Å²	7	37.2 Å²	37.2	6%	0.058	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-34	171.8	0	0	0	0	0	112.4	F123 F149 A158	F123-A154 WeakPolarHBondContact O-CA 3.45Å; F123-A154 VanDerWaalsContact O-CB 3.28Å; F123-A154 WeakPolarHBondContact O-CB 3.45Å; F149-A154 HydrophobicContact CB-CB 4.41Å; F149-A154 HydrophobicContact CD1-CB 3.82Å; F149-A154 HydrophobicContact CE1-CB 4.4Å; F149-A154 HydrophobicContact CG-CB 4.3Å; A154-A158 VanDerWaalsContact O-CB 3.29Å; A154-A158 WeakPolarHBondContact O-CB 3.35Å; A154-A158 PolarHBondContact O-N 2.87Å
155	S	89.6	Confident	89.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-72	-45.7	178.7	-59.8	0	0	0	0	113.1	A100 I102 F149 S151 F152 D153 A158 I159	A100-S155 WeakPolarHBondContact CB-OG 3.37Å; A100-S155 PolarHBondContact O-OG 2.79Å; I102-S155 VanDerWaalsContact CD1-CA 3.41Å; I102-S155 VanDerWaalsContact CD1-CB 3.45Å; I102-S155 WeakPolarHBondContact CD1-O 3.27Å; F149-S155 WeakPolarHBondContact CB-OG 3.35Å; S151-S155 PolarHBondContact O-N 3.47Å; S151-S155 PolarHBondContact O-OG 3.3Å; F152-S155 CarbonylContact O-C 3.57Å; F152-S155 WeakPolarHBondContact O-CA 3.39Å; F152-S155 VanDerWaalsContact O-CB 3.32Å; F152-S155 WeakPolarHBondContact O-CB 3.07Å; F152-S155 PolarHBondContact O-N 2.98Å; D153-S155 PolarHBondContact O-N 3.09Å; S155-A158 PolarHBondContact O-N 2.8Å; S155-I159 WeakPolarHBondContact O-CD1 3.26Å; S155-I159 VanDerWaalsContact O-CG1 3.28Å; S155-I159 WeakPolarHBondContact O-CG1 3.29Å; S155-I159 PolarHBondContact O-N 3.2Å
156	D	90.1	Very high	89.7	Confident	43 Å²	43	47 Å²	47	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-44.8	176.3	-68.9	-57.3	0	0	0	110.8	F152 D153 A158 I159 E160 Y176 R193	F152-D156 PolarHBondContact O-N 2.84Å; F152-D156 VanDerWaalsContact O-OD2 3.11Å; D153-D156 PolarHBondContact O-N 3.21Å; D156-A158 VanDerWaalsContact C-N 3.31Å; D156-A158 PolarHBondContact O-N 2.81Å; D156-I159 PolarHBondContact O-N 2.8Å; D156-I159 VanDerWaalsContact O-N 3.1Å; D156-E160 WeakPolarHBondContact O-CG 3.48Å; D156-E160 PolarHBondContact O-N 3.09Å; D156-Y176 WeakPolarHBondContact OD1-CE2 3.33Å; D156-Y176 PolarHBondContact OD1-OH 3.29Å; D156-Y176 PolarHBondContact OD2-OH 2.78Å; D156-R193 VanDerWaalsContact CG-NH2 3.34Å; D156-R193 IonicContact OD1-CZ 2.85Å; D156-R193 IonicContact OD1-NH2 3.18Å; D156-R193 PolarHBondContact OD1-NH2 2.82Å; D156-R193 IonicContact OD2-CZ 2.96Å; D156-R193 IonicContact OD2-NH1 3.98Å; D156-R193 PolarHBondContact OD2-NH1 3.42Å; D156-R193 IonicContact OD2-NH2 2.65Å; D156-R193 PolarHBondContact OD2-NH2 3.49Å
157	A	91	Very high	89.5	Confident	37 Å²	37	44.9 Å²	44.9	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-57.5	-43.7	176.2	0	0	0	0	0	111.9	F123 D153 A161	F123-A157 HydrophobicContact CD1-CB 4.4Å; D153-A157 WeakPolarHBondContact O-CB 3.46Å; D153-A157 PolarHBondContact O-N 3.27Å; A157-A161 WeakPolarHBondContact O-CB 3.41Å; A157-A161 PolarHBondContact O-N 2.77Å
158	A	91.8	Very high	89.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-41.3	175.4	0	0	0	0	0	112.4	I102 F120 F123 F149 A154 S155 D156 M162	I102-A158 HydrophobicContact CD1-CB 4.12Å; F120-A158 HydrophobicContact CD1-CB 4.09Å; F120-A158 HydrophobicContact CE1-CB 4.33Å; F123-A158 HydrophobicContact CB-CB 4Å; F123-A158 HydrophobicContact CD2-CB 3.85Å; F123-A158 HydrophobicContact CG-CB 3.88Å; F149-A158 HydrophobicContact CE2-CB 4.26Å; F149-A158 HydrophobicContact CZ-CB 4.01Å; A154-A158 VanDerWaalsContact O-CB 3.29Å; A154-A158 WeakPolarHBondContact O-CB 3.35Å; A154-A158 PolarHBondContact O-N 2.87Å; S155-A158 PolarHBondContact O-N 2.8Å; D156-A158 VanDerWaalsContact C-N 3.31Å; D156-A158 PolarHBondContact O-N 2.81Å; A158-M162 WeakPolarHBondContact O-CB 3.33Å; A158-M162 PolarHBondContact O-N 2.8Å
159	I	92.2	Very high	89.3	Confident	27 Å²	27	54.5 Å²	54.5	14%	0.138	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-47.7	177.9	-69.4	159.8	0	0	0	110.5	I102 S155 D156 N163 V174 Y176	I102-I159 HydrophobicContact CD1-CD1 4.22Å; I102-I159 HydrophobicContact CD1-CG1 4.05Å; I102-I159 HydrophobicContact CG1-CD1 4.27Å; I102-I159 HydrophobicContact CG1-CG1 4.44Å; I102-I159 HydrophobicContact CG2-CG1 4.28Å; S155-I159 WeakPolarHBondContact O-CD1 3.26Å; S155-I159 VanDerWaalsContact O-CG1 3.28Å; S155-I159 WeakPolarHBondContact O-CG1 3.29Å; S155-I159 PolarHBondContact O-N 3.2Å; D156-I159 PolarHBondContact O-N 2.8Å; D156-I159 VanDerWaalsContact O-N 3.1Å; I159-N163 WeakPolarHBondContact O-CB 3.38Å; I159-N163 PolarHBondContact O-N 2.79Å; I159-V174 HydrophobicContact CB-CG1 4.46Å; I159-V174 HydrophobicContact CG1-CG1 3.86Å; I159-Y176 HydrophobicContact CD1-CD1 4.23Å; I159-Y176 HydrophobicContact CD1-CD2 3.53Å; I159-Y176 HydrophobicContact CD1-CE1 4.11Å; I159-Y176 HydrophobicContact CD1-CE2 3.36Å; I159-Y176 HydrophobicContact CD1-CG 3.96Å
160	E	92	Very high	89.4	Confident	167 Å²	167	59.6 Å²	59.6	78%	0.78	32%	0.32	S	S	*	.	H	α-helix	trans	-66.5	-40.3	-177.9	-70.7	-170	109.5	0	0	112.3	D156	D156-E160 WeakPolarHBondContact O-CG 3.48Å; D156-E160 PolarHBondContact O-N 3.09Å
161	A	91.4	Very high	89.8	Confident	43 Å²	43	61.5 Å²	61.5	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-78.9	-38.6	-178.1	0	0	0	0	0	113.1	F123 A157 Q165	F123-A161 HydrophobicContact CD1-CB 4.41Å; F123-A161 HydrophobicContact CE1-CB 3.44Å; F123-A161 VanDerWaalsContact CE1-CB 3.44Å; F123-A161 HydrophobicContact CZ-CB 3.82Å; A157-A161 WeakPolarHBondContact O-CB 3.41Å; A157-A161 PolarHBondContact O-N 2.77Å; A161-Q165 WeakPolarHBondContact O-CG 3.01Å
162	M	92.8	Very high	90.4	Very high	29 Å²	29	60 Å²	60	14%	0.143	32%	0.322	C	S	.	.	H	α-helix	trans	-102.9	-15.3	-168.9	-65.4	-62.7	-133.6	0	0	115.2	T119 F120 F123 A158 G164 Q165 I172 V174	T119-M162 HydrophobicContact CG2-CE 3.16Å; F120-M162 HydrophobicContact CE1-CB 4.11Å; F120-M162 HydrophobicContact CE1-CG 4.07Å; F120-M162 HydrophobicContact CZ-CB 4.24Å; F120-M162 HydrophobicContact CZ-CG 4.32Å; F123-M162 HydrophobicContact CE2-CE 3.76Å; F123-M162 HydrophobicContact CE2-CG 3.48Å; F123-M162 VanDerWaalsContact CE2-CG 3.48Å; F123-M162 HydrophobicContact CE2-SD 4.21Å; F123-M162 HydrophobicContact CZ-CE 3.99Å; F123-M162 HydrophobicContact CZ-CG 3.49Å; F123-M162 VanDerWaalsContact CZ-CG 3.49Å; F123-M162 HydrophobicContact CZ-SD 4Å; A158-M162 WeakPolarHBondContact O-CB 3.33Å; A158-M162 PolarHBondContact O-N 2.8Å; M162-G164 PolarHBondContact O-N 3.19Å; M162-G164 VanDerWaalsContact O-N 3.13Å; M162-Q165 WeakPolarHBondContact O-CB 3.29Å; M162-Q165 PolarHBondContact O-N 3.16Å; M162-Q165 HydrophobicContact SD-CB 4.25Å; M162-Q165 HydrophobicContact SD-CG 4.25Å; M162-I172 HydrophobicContact CB-CD1 4.28Å; M162-I172 WeakPolarHBondContact O-CG1 3.43Å; M162-V174 HydrophobicContact CB-CG2 3.91Å
163	N	93.5	Very high	90.7	Very high	81 Å²	81	62.9 Å²	62.9	43%	0.433	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	117	178.5	-175.6	38.7	0	0	0	111.1	I159 V174	I159-N163 WeakPolarHBondContact O-CB 3.38Å; I159-N163 PolarHBondContact O-N 2.79Å; N163-V174 HydrophobicContact CB-CB 4.11Å; N163-V174 PolarHBondContact OD1-N 3.07Å; N163-V174 PolarHBondContact OD1-O 3.41Å
164	G	91.3	Very high	91	Very high	45 Å²	45	56.9 Å²	56.9	46%	0.464	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-1.8	-175.8	0	0	0	0	0	114.6	M162 I172	M162-G164 PolarHBondContact O-N 3.19Å; M162-G164 VanDerWaalsContact O-N 3.13Å; G164-I172 VanDerWaalsContact CA-O 3.32Å; G164-I172 WeakPolarHBondContact CA-O 3.27Å; G164-I172 PolarHBondContact N-O 3.04Å
165	Q	92.1	Very high	91.1	Very high	106 Å²	106	58.1 Å²	58.1	50%	0.495	32%	0.316	S	S	.	.			trans	-74.4	155.7	174.9	-68.3	-60.7	-25.6	0	0	111.8	A161 M162 P171 I172	A161-Q165 WeakPolarHBondContact O-CG 3.01Å; M162-Q165 WeakPolarHBondContact O-CB 3.29Å; M162-Q165 PolarHBondContact O-N 3.16Å; M162-Q165 HydrophobicContact SD-CB 4.25Å; M162-Q165 HydrophobicContact SD-CG 4.25Å; Q165-P171 CarbonylContact O-C 3.43Å; Q165-P171 VanDerWaalsContact O-CA 3.27Å; Q165-P171 WeakPolarHBondContact O-CA 3.36Å; Q165-I172 WeakPolarHBondContact O-CG1 3.5Å; Q165-I172 PolarHBondContact O-N 3Å
166	Y	90.1	Very high	91.1	Very high	165 Å²	165	59.7 Å²	59.7	65%	0.647	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	122.9	176.5	-77.5	-107.1	0	0	0	110.4	R170 P171	Y166-R170 WeakPolarHBondContact CA-O 3.44Å; Y166-P171 HydrophobicContact CD1-CB 4.5Å; Y166-P171 HydrophobicContact CD2-CB 4.2Å; Y166-P171 HydrophobicContact CE1-CB 4.29Å; Y166-P171 HydrophobicContact CE1-CG 4.25Å; Y166-P171 HydrophobicContact CE2-CB 3.96Å; Y166-P171 HydrophobicContact CG-CB 4.46Å
167	L	87.3	Confident	90.9	Very high	19 Å²	19	57.7 Å²	57.7	10%	0.099	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	112.6	167.8	-160.5	71.3	0	0	0	107.8	L107 I111 L116 T119 N169 R170 I172	L107-L167 HydrophobicContact CD2-CD2 4.17Å; I111-L167 HydrophobicContact CD1-CD2 3.87Å; I111-L167 HydrophobicContact CD1-CG 3.87Å; I111-L167 HydrophobicContact CG1-CD2 4.4Å; I111-L167 HydrophobicContact CG2-CD2 4.4Å; L116-L167 HydrophobicContact CD2-CD2 3.82Å; T119-L167 HydrophobicContact CG2-CD1 3.95Å; L167-N169 PolarHBondContact O-N 3Å; L167-R170 PolarHBondContact N-O 3.11Å; L167-R170 PolarHBondContact O-N 2.73Å; L167-I172 HydrophobicContact CB-CD1 4.36Å; L167-I172 HydrophobicContact CB-CG2 3.53Å; L167-I172 HydrophobicContact CD2-CG2 4.47Å
168	C	86.1	Confident	90.5	Very high	75 Å²	75	61.6 Å²	61.6	51%	0.507	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	-117.5	-164.1	-62.6	0	0	0	0	111.6	I111	I111-C168 HydrophobicContact CD1-CB 4.06Å; I111-C168 WeakPolarHBondContact CD1-SG 3.44Å
169	N	87.3	Confident	89.8	Confident	131 Å²	131	64 Å²	64	70%	0.701	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	5.9	-173.5	-73	-39.5	0	0	0	114	L167	L167-N169 PolarHBondContact O-N 3Å
170	R	89.9	Confident	88.6	Confident	106 Å²	106	72.1 Å²	72.1	40%	0.4	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.9	-176.7	-63.6	-172.7	-173.5	-133.5	-6.2	112.5	D108 Y166 L167 I172	D108-R170 HydrophobicContact CB-CB 4.48Å; D108-R170 HydrophobicContact CB-CG 4.19Å; D108-R170 WeakPolarHBondContact OD2-CD 3.49Å; D108-R170 IonicContact OD2-NE 3.33Å; D108-R170 PolarHBondContact OD2-NE 3.23Å; Y166-R170 WeakPolarHBondContact CA-O 3.44Å; L167-R170 PolarHBondContact N-O 3.11Å; L167-R170 PolarHBondContact O-N 2.73Å; R170-I172 PolarHBondContact O-N 3.23Å
171	P	92.4	Very high	87.3	Confident	45 Å²	45	71.5 Å²	71.5	29%	0.292	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.5	170.6	29.3	-31.2	0	0	0	109.7	N106 Q165 Y166	N106-P171 PolarHBondContact ND2-O 3.35Å; Q165-P171 CarbonylContact O-C 3.43Å; Q165-P171 VanDerWaalsContact O-CA 3.27Å; Q165-P171 WeakPolarHBondContact O-CA 3.36Å; Y166-P171 HydrophobicContact CD1-CB 4.5Å; Y166-P171 HydrophobicContact CD2-CB 4.2Å; Y166-P171 HydrophobicContact CE1-CB 4.29Å; Y166-P171 HydrophobicContact CE1-CG 4.25Å; Y166-P171 HydrophobicContact CE2-CB 3.96Å; Y166-P171 HydrophobicContact CG-CB 4.46Å
172	I	93.9	Very high	86	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	37%	0.365	C	S	.	.			trans	-86.2	150.3	-179.5	67.2	171.5	0	0	0	110.5	I104 G105 L107 F120 M162 G164 Q165 L167 R170 V174	I104-I172 HydrophobicContact CG2-CB 4.11Å; I104-I172 HydrophobicContact CG2-CD1 4.12Å; G105-I172 WeakPolarHBondContact O-CA 3.28Å; L107-I172 HydrophobicContact CD2-CB 4.45Å; L107-I172 HydrophobicContact CD2-CG2 3.7Å; F120-I172 HydrophobicContact CE2-CD1 4.33Å; F120-I172 HydrophobicContact CZ-CD1 3.86Å; M162-I172 HydrophobicContact CB-CD1 4.28Å; M162-I172 WeakPolarHBondContact O-CG1 3.43Å; G164-I172 VanDerWaalsContact CA-O 3.32Å; G164-I172 WeakPolarHBondContact CA-O 3.27Å; G164-I172 PolarHBondContact N-O 3.04Å; Q165-I172 WeakPolarHBondContact O-CG1 3.5Å; Q165-I172 PolarHBondContact O-N 3Å; L167-I172 HydrophobicContact CB-CD1 4.36Å; L167-I172 HydrophobicContact CB-CG2 3.53Å; L167-I172 HydrophobicContact CD2-CG2 4.47Å; R170-I172 PolarHBondContact O-N 3.23Å; I172-V174 HydrophobicContact CD1-CG2 3.84Å; I172-V174 HydrophobicContact CG1-CG2 4.05Å
173	T	93	Very high	84.1	Confident	67 Å²	67	80.5 Å²	80.5	41%	0.411	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.1	173.8	-54.4	0	0	0	0	108.8	I104 G105	I104-T173 CarbonylContact C-O 3.47Å; I104-T173 WeakPolarHBondContact CA-O 3.37Å; G105-T173 PolarHBondContact N-O 2.78Å; G105-T173 PolarHBondContact O-N 3Å
174	V	93.6	Very high	82.7	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.4	-176.2	-169.1	0	0	0	0	108.7	I102 F103 I104 F120 I159 M162 N163 I172	I102-V174 HydrophobicContact CG2-CG1 3.31Å; F103-V174 WeakPolarHBondContact O-CA 3.39Å; I104-V174 HydrophobicContact CG1-CG1 4.37Å; I104-V174 HydrophobicContact CG1-CG2 4.45Å; I104-V174 HydrophobicContact CG2-CG2 4.33Å; F120-V174 HydrophobicContact CE1-CG1 4.44Å; F120-V174 HydrophobicContact CE1-CG2 4.47Å; F120-V174 HydrophobicContact CZ-CG2 4.27Å; I159-V174 HydrophobicContact CB-CG1 4.46Å; I159-V174 HydrophobicContact CG1-CG1 3.86Å; M162-V174 HydrophobicContact CB-CG2 3.91Å; N163-V174 HydrophobicContact CB-CB 4.11Å; N163-V174 PolarHBondContact OD1-N 3.07Å; N163-V174 PolarHBondContact OD1-O 3.41Å; I172-V174 HydrophobicContact CD1-CG2 3.84Å; I172-V174 HydrophobicContact CG1-CG2 4.05Å
175	S	91.2	Very high	81.8	Confident	33 Å²	33	82.5 Å²	82.5	23%	0.231	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	157	-178.1	-74.4	0	0	0	0	110.8	I102 F103 A177	I102-S175 WeakPolarHBondContact CG2-O 3.48Å; F103-S175 WeakPolarHBondContact CA-O 3.42Å; F103-S175 WeakPolarHBondContact CB-O 3.2Å; F103-S175 PolarHBondContact N-O 3.36Å; F103-S175 PolarHBondContact O-N 3.09Å; F103-S175 VanDerWaalsContact O-O 3.09Å; S175-A177 PolarHBondContact O-N 3.27Å
176	Y	90.6	Very high	81	Confident	33 Å²	33	83.8 Å²	83.8	13%	0.129	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	134.6	170.5	-78.2	-73.3	0	0	0	112.1	F152 D156 I159 H187 R193	F152-Y176 AromaticContact CD1-CE1 3.98Å; F152-Y176 HydrophobicContact CD1-CE1 3.98Å; F152-Y176 HydrophobicContact CE1-CE1 4.17Å; D156-Y176 WeakPolarHBondContact OD1-CE2 3.33Å; D156-Y176 PolarHBondContact OD1-OH 3.29Å; D156-Y176 PolarHBondContact OD2-OH 2.78Å; I159-Y176 HydrophobicContact CD1-CD1 4.23Å; I159-Y176 HydrophobicContact CD1-CD2 3.53Å; I159-Y176 HydrophobicContact CD1-CE1 4.11Å; I159-Y176 HydrophobicContact CD1-CE2 3.36Å; I159-Y176 HydrophobicContact CD1-CG 3.96Å; Y176-H187 WeakPolarHBondContact CB-O 3.36Å; Y176-H187 HydrophobicContact CD1-CB 4.15Å; Y176-H187 WeakPolarHBondContact CD1-O 3.47Å; Y176-R193 PolarHBondContact OH-NH2 2.86Å; Y176-R193 VanDerWaalsContact OH-NH2 3.13Å
177	A	86	Confident	80.2	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.008	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-67.4	154.6	177.4	0	0	0	0	0	110.9	N101 F103 F146 S175 R186 H187	N101-A177 HydrophobicContact CB-CB 4.3Å; N101-A177 WeakPolarHBondContact O-CB 3.43Å; N101-A177 PolarHBondContact O-N 2.83Å; F103-A177 HydrophobicContact CB-CB 4.21Å; F146-A177 HydrophobicContact CD1-CB 3.88Å; F146-A177 HydrophobicContact CE1-CB 4.05Å; S175-A177 PolarHBondContact O-N 3.27Å; A177-R186 WeakPolarHBondContact O-CA 3.37Å; A177-H187 WeakPolarHBondContact O-CB 3.4Å; A177-H187 PolarHBondContact O-CD2 3.1Å; A177-H187 VanDerWaalsContact O-CD2 3.28Å; A177-H187 PolarHBondContact O-N 3.22Å
178	F	82.3	Confident	79.4	Confident	119 Å²	119	76.7 Å²	76.7	52%	0.522	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-75.1	139.3	170.8	-68.9	-76.3	0	0	0	110.4	R186	F178-R186 HydrophobicContact CD1-CG 3.76Å; F178-R186 HydrophobicContact CE1-CG 3.65Å; F178-R186 HydrophobicContact CZ-CG 4.37Å
179	K	77.3	Confident	78.9	Confident	52 Å²	52	75.3 Å²	75.3	23%	0.226	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-67	132.4	175.7	-61.3	-179.8	86.4	156	0	108.9	D181 E185 E192	K179-D181 PolarHBondContact O-N 2.91Å; K179-E185 HydrophobicContact CD-CB 4.13Å; K179-E185 WeakPolarHBondContact CG-O 3.46Å; K179-E185 PolarHBondContact N-O 3.48Å; K179-E192 VanDerWaalsContact CE-OE1 3.25Å; K179-E192 WeakPolarHBondContact CE-OE1 3.21Å; K179-E192 IonicContact NZ-OE1 3.61Å; K179-E192 PolarHBondContact NZ-OE1 2.87Å; K179-E192 IonicContact NZ-OE2 3.74Å; K179-E192 PolarHBondContact NZ-OE2 3.26Å
180	K	66	Low	78	Confident	196 Å²	196	72.7 Å²	72.7	85%	0.852	38%	0.379	S	S	*	.	S	Bend	trans	-62.4	-29.9	-175.6	-171.4	178.2	175.9	-170.6	0	113.1
181	D	65.3	Low	76.8	Confident	154 Å²	154	70.7 Å²	70.7	82%	0.824	39%	0.385	S	S	*	.	S	Bend	trans	-109.1	-5.8	-171.6	-54.9	-74.8	0	0	0	114	K179	K179-D181 PolarHBondContact O-N 2.91Å
182	S	64.3	Low	75.9	Confident	40 Å²	40	69.5 Å²	69.5	28%	0.28	38%	0.376	S	S	.	.	S	Bend	trans	-115.9	122.2	179.5	-86.7	0	0	0	0	111.3	G184 E185	S182-G184 PolarHBondContact O-N 3.2Å; S182-E185 WeakPolarHBondContact CB-OE2 3.37Å; S182-E185 PolarHBondContact OG-OE2 2.95Å
183	K	52.4	Low	75.1	Confident	222 Å²	222	73.6 Å²	73.6	97%	0.965	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	89.7	-175.7	-164.7	178.7	-176	-175.3	0	111.4
184	G	64.1	Low	74.1	Confident	57 Å²	57	76.1 Å²	76.1	59%	0.588	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.1	0.9	172.4	0	0	0	0	0	115.6	S182	S182-G184 PolarHBondContact O-N 3.2Å
185	E	72.7	Confident	73	Confident	110 Å²	110	82.1 Å²	82.1	51%	0.514	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-79.9	130.1	172.8	-71.4	171.5	91.9	0	0	110	K179 S182	K179-E185 HydrophobicContact CD-CB 4.13Å; K179-E185 WeakPolarHBondContact CG-O 3.46Å; K179-E185 PolarHBondContact N-O 3.48Å; S182-E185 WeakPolarHBondContact CB-OE2 3.37Å; S182-E185 PolarHBondContact OG-OE2 2.95Å
186	R	75.3	Confident	71.9	Confident	134 Å²	134	80.7 Å²	80.7	51%	0.506	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-85.4	148.8	171.3	-63.4	-175.2	-176.7	-155.3	1.6	109.2	A177 F178	A177-R186 WeakPolarHBondContact O-CA 3.37Å; F178-R186 HydrophobicContact CD1-CG 3.76Å; F178-R186 HydrophobicContact CE1-CG 3.65Å; F178-R186 HydrophobicContact CZ-CG 4.37Å
187	H	73.4	Confident	70.7	Confident	17 Å²	17	82.1 Å²	82.1	8%	0.079	44%	0.442	C	S	.	.	S	Bend	trans	-56	155.1	164.2	-81.9	-67.4	0	0	0	110.8	D97 G99 Y176 A177 E192	D97-H187 IonicContact OD1-CE1 2.86Å; G99-H187 VanDerWaalsContact CA-ND1 3.33Å; G99-H187 WeakPolarHBondContact CA-ND1 3.32Å; G99-H187 WeakPolarHBondContact O-CB 3.32Å; G99-H187 PolarHBondContact O-ND1 3.24Å; Y176-H187 WeakPolarHBondContact CB-O 3.36Å; Y176-H187 HydrophobicContact CD1-CB 4.15Å; Y176-H187 WeakPolarHBondContact CD1-O 3.47Å; A177-H187 WeakPolarHBondContact O-CB 3.4Å; A177-H187 PolarHBondContact O-CD2 3.1Å; A177-H187 VanDerWaalsContact O-CD2 3.28Å; A177-H187 PolarHBondContact O-N 3.22Å; H187-E192 IonicContact CE1-OE1 3.07Å; H187-E192 IonicContact ND1-OE1 3Å; H187-E192 PolarHBondContact ND1-OE1 3.47Å
188	G	69.8	Low	69.6	Low	17 Å²	17	89.6 Å²	89.6	18%	0.175	48%	0.477	C	S	.	.			trans	107.8	9	-179.9	0	0	0	0	0	116.2	F152 R193	F152-G188 VanDerWaalsContact CE1-CA 3.45Å; G188-R193 PolarHBondContact O-NE 3.42Å
189	S	76.3	Confident	68.7	Low	46 Å²	46	84.4 Å²	84.4	32%	0.322	45%	0.454	S	S	.	.			trans	-61.9	151.7	177.9	68.2	0	0	0	0	112.2	A191 E192 R193	S189-A191 PolarHBondContact O-N 3.3Å; S189-A191 VanDerWaalsContact O-N 3.16Å; S189-E192 WeakPolarHBondContact CB-OE2 3.48Å; S189-E192 PolarHBondContact N-OE2 2.8Å; S189-E192 PolarHBondContact O-N 3.42Å; S189-E192 VanDerWaalsContact O-N 3.08Å; S189-E192 WeakPolarHBondContact OG-CG 3.26Å; S189-E192 PolarHBondContact OG-N 3Å; S189-E192 PolarHBondContact OG-OE2 3.39Å; S189-R193 PolarHBondContact O-N 3.17Å; S189-R193 VanDerWaalsContact O-N 3.1Å
190	A	69.1	Low	67.8	Low	77 Å²	77	85.8 Å²	85.8	64%	0.636	47%	0.468	S	S	*	.	H	α-helix	trans	-57	-32.2	179.6	0	0	0	0	0	112.9	L194	A190-L194 WeakPolarHBondContact O-CG 3.26Å; A190-L194 PolarHBondContact O-N 3.33Å
191	A	64.6	Low	67.4	Low	64 Å²	64	79.1 Å²	79.1	53%	0.529	44%	0.442	S	S	.	.	H	α-helix	trans	-69.2	-40.8	176.7	0	0	0	0	0	112.7	S189 R193 L194 L195	S189-A191 PolarHBondContact O-N 3.3Å; S189-A191 VanDerWaalsContact O-N 3.16Å; A191-R193 VanDerWaalsContact C-N 3.34Å; A191-L194 PolarHBondContact O-N 3.41Å; A191-L195 PolarHBondContact O-N 3.07Å
192	E	72.8	Confident	66.9	Low	20 Å²	20	72.8 Å²	72.8	9%	0.093	41%	0.41	C	S	.	.	H	α-helix	trans	-65.9	-39.5	175.7	-72.9	166.6	116.3	0	0	111.1	F152 K179 H187 S189 L194 L195 A196	F152-E192 HydrophobicContact CE2-CB 3.75Å; F152-E192 WeakPolarHBondContact CE2-O 3.29Å; F152-E192 HydrophobicContact CZ-CB 3.48Å; F152-E192 VanDerWaalsContact CZ-CB 3.48Å; K179-E192 VanDerWaalsContact CE-OE1 3.25Å; K179-E192 WeakPolarHBondContact CE-OE1 3.21Å; K179-E192 IonicContact NZ-OE1 3.61Å; K179-E192 PolarHBondContact NZ-OE1 2.87Å; K179-E192 IonicContact NZ-OE2 3.74Å; K179-E192 PolarHBondContact NZ-OE2 3.26Å; H187-E192 IonicContact CE1-OE1 3.07Å; H187-E192 IonicContact ND1-OE1 3Å; H187-E192 PolarHBondContact ND1-OE1 3.47Å; S189-E192 WeakPolarHBondContact CB-OE2 3.48Å; S189-E192 PolarHBondContact N-OE2 2.8Å; S189-E192 PolarHBondContact O-N 3.42Å; S189-E192 VanDerWaalsContact O-N 3.08Å; S189-E192 WeakPolarHBondContact OG-CG 3.26Å; S189-E192 PolarHBondContact OG-N 3Å; S189-E192 PolarHBondContact OG-OE2 3.39Å; E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.36Å; E192-L195 PolarHBondContact O-N 3.07Å; E192-A196 WeakPolarHBondContact O-CB 3.26Å; E192-A196 PolarHBondContact O-N 2.99Å
193	R	77.4	Confident	66.2	Low	86 Å²	86	77.2 Å²	77.2	33%	0.325	43%	0.426	S	S	.	.	H	α-helix	trans	-59.1	-36.3	175.5	-69.6	171.9	-177.3	-87.8	2.5	113	F152 D156 Y176 G188 S189 A191 A196 A197	F152-R193 HydrophobicContact CB-CG 4.01Å; F152-R193 HydrophobicContact CD1-CG 4.08Å; F152-R193 HydrophobicContact CD2-CB 4.21Å; F152-R193 HydrophobicContact CD2-CG 3.73Å; F152-R193 HydrophobicContact CE2-CG 4.19Å; F152-R193 HydrophobicContact CG-CG 3.65Å; D156-R193 VanDerWaalsContact CG-NH2 3.34Å; D156-R193 IonicContact OD1-CZ 2.85Å; D156-R193 IonicContact OD1-NH2 3.18Å; D156-R193 PolarHBondContact OD1-NH2 2.82Å; D156-R193 IonicContact OD2-CZ 2.96Å; D156-R193 IonicContact OD2-NH1 3.98Å; D156-R193 PolarHBondContact OD2-NH1 3.42Å; D156-R193 IonicContact OD2-NH2 2.65Å; D156-R193 PolarHBondContact OD2-NH2 3.49Å; Y176-R193 PolarHBondContact OH-NH2 2.86Å; Y176-R193 VanDerWaalsContact OH-NH2 3.13Å; G188-R193 PolarHBondContact O-NE 3.42Å; S189-R193 PolarHBondContact O-N 3.17Å; S189-R193 VanDerWaalsContact O-N 3.1Å; A191-R193 VanDerWaalsContact C-N 3.34Å; R193-A196 WeakPolarHBondContact O-CB 3.2Å; R193-A197 PolarHBondContact O-N 2.76Å; R193-A197 VanDerWaalsContact O-N 3.16Å
194	L	71.3	Confident	66.2	Low	121 Å²	121	71 Å²	71	63%	0.634	42%	0.416	S	S	*	.	H	α-helix	trans	-73.1	-35.8	177.1	-70.2	171.7	0	0	0	113	A190 A191 E192 A196	A190-L194 WeakPolarHBondContact O-CG 3.26Å; A190-L194 PolarHBondContact O-N 3.33Å; A191-L194 PolarHBondContact O-N 3.41Å; E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.36Å; L194-A196 VanDerWaalsContact C-N 3.35Å
195	L	71.4	Confident	65.6	Low	125 Å²	125	72.7 Å²	72.7	65%	0.654	41%	0.412	S	S	*	.	H	α-helix	trans	-68.5	-37.4	174	-72.7	162.3	0	0	0	111.1	A191 E192 Q198	A191-L195 PolarHBondContact O-N 3.07Å; E192-L195 PolarHBondContact O-N 3.07Å; L195-Q198 PolarHBondContact O-N 3.35Å
196	A	68.1	Low	64.8	Low	4 Å²	4	75.6 Å²	75.6	3%	0.033	42%	0.418	C	S	.	.	H	α-helix	trans	-60.3	-43.8	174.6	0	0	0	0	0	114.2	V98 F152 E192 R193 L194 Q198 N199 S202	V98-A196 HydrophobicContact CB-CB 4.46Å; V98-A196 HydrophobicContact CG1-CB 2.98Å; F152-A196 HydrophobicContact CD2-CB 3.47Å; F152-A196 VanDerWaalsContact CD2-CB 3.47Å; F152-A196 HydrophobicContact CE2-CB 3.74Å; E192-A196 WeakPolarHBondContact O-CB 3.26Å; E192-A196 PolarHBondContact O-N 2.99Å; R193-A196 WeakPolarHBondContact O-CB 3.2Å; L194-A196 VanDerWaalsContact C-N 3.35Å; A196-Q198 PolarHBondContact O-N 3.24Å; A196-N199 VanDerWaalsContact O-CB 3.32Å; A196-N199 WeakPolarHBondContact O-CB 3.39Å; A196-N199 PolarHBondContact O-N 3.38Å; A196-S202 PolarHBondContact O-OG 3.47Å
197	A	64.1	Low	63.4	Low	62 Å²	62	74.6 Å²	74.6	51%	0.512	43%	0.429	S	S	.	.	H	α-helix	trans	-66.7	-24.1	-176.7	0	0	0	0	0	112.4	R193 N199	R193-A197 PolarHBondContact O-N 2.76Å; R193-A197 VanDerWaalsContact O-N 3.16Å; A197-N199 VanDerWaalsContact C-N 3.33Å
198	Q	62.8	Low	62.1	Low	159 Å²	159	82.4 Å²	82.4	74%	0.743	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.1	174.8	-80.7	174.3	74.6	0	0	113.4	L195 A196 P200	L195-Q198 PolarHBondContact O-N 3.35Å; A196-Q198 PolarHBondContact O-N 3.24Å; Q198-P200 WeakPolarHBondContact O-CD 3.4Å
199	N	64.9	Low	61.2	Low	10 Å²	10	88 Å²	88	5%	0.053	49%	0.486	C	S	.	.			trans	-80.5	123.7	179.6	-175.4	32.9	0	0	0	111.2	L96 A196 A197 L201 S202	L96-N199 WeakPolarHBondContact CD1-OD1 3.46Å; A196-N199 VanDerWaalsContact O-CB 3.32Å; A196-N199 WeakPolarHBondContact O-CB 3.39Å; A196-N199 PolarHBondContact O-N 3.38Å; A197-N199 VanDerWaalsContact C-N 3.33Å; N199-L201 VanDerWaalsContact C-N 3.26Å; N199-L201 PolarHBondContact O-N 3.26Å; N199-S202 VanDerWaalsContact O-CB 3.29Å; N199-S202 WeakPolarHBondContact O-CB 3.3Å; N199-S202 PolarHBondContact O-N 3.09Å; N199-S202 PolarHBondContact O-OG 3.36Å
200	P	57.3	Low	60	Low	80 Å²	80	94 Å²	94	52%	0.519	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.9	-177.1	20.7	-33.1	0	0	0	115	Q198 S202 Q203 A204	Q198-P200 WeakPolarHBondContact O-CD 3.4Å; P200-S202 PolarHBondContact O-N 3.44Å; P200-Q203 PolarHBondContact O-N 3.02Å; P200-A204 PolarHBondContact O-N 2.9Å
201	L	57.3	Low	58.9	Low	56 Å²	56	100.4 Å²	100.4	29%	0.293	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-25.7	172.3	-84.1	106.4	0	0	0	112.7	K94 L96 L127 N199 Q203	K94-L201 HydrophobicContact CD-CD1 3.94Å; L96-L201 HydrophobicContact CD1-CD1 4.48Å; L127-L201 HydrophobicContact CD2-CD2 4.21Å; N199-L201 VanDerWaalsContact C-N 3.26Å; N199-L201 PolarHBondContact O-N 3.26Å; L201-Q203 VanDerWaalsContact C-N 3.31Å
202	S	54.5	Low	58.2	Low	22 Å²	22	101.3 Å²	101.3	15%	0.154	54%	0.536	C	S	.	.	H	α-helix	trans	-75.6	-19.7	177.2	-46.4	0	0	0	0	112.7	A150 A196 N199 P200	A150-S202 PolarHBondContact O-OG 3.09Å; A196-S202 PolarHBondContact O-OG 3.47Å; N199-S202 VanDerWaalsContact O-CB 3.29Å; N199-S202 WeakPolarHBondContact O-CB 3.3Å; N199-S202 PolarHBondContact O-N 3.09Å; N199-S202 PolarHBondContact O-OG 3.36Å; P200-S202 PolarHBondContact O-N 3.44Å
203	Q	51.2	Low	56.7	Low	133 Å²	133	106.9 Å²	106.9	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-90.8	-24.6	179.4	-75.3	-171.5	6.9	0	0	113.5	P200 L201 D205	P200-Q203 PolarHBondContact O-N 3.02Å; L201-Q203 VanDerWaalsContact C-N 3.31Å; Q203-D205 VanDerWaalsContact C-N 3.32Å; Q203-D205 PolarHBondContact O-N 2.87Å
204	A	51	Low	54.9	Low	90 Å²	90	106.8 Å²	106.8	74%	0.744	58%	0.583	S	S	*	*	H	α-helix	trans	-72.7	-22.9	-175.4	0	0	0	0	0	113.8	P200	P200-A204 PolarHBondContact O-N 2.9Å
205	D	52.9	Low	53.7	Low	94 Å²	94	106 Å²	106	50%	0.503	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.3	32.1	-172.9	-149.8	-109.2	0	0	0	113	V125 Q203 P207	V125-D205 HydrophobicContact CG2-CB 3.96Å; V125-D205 VanDerWaalsContact CG2-CG 3.42Å; Q203-D205 VanDerWaalsContact C-N 3.32Å; Q203-D205 PolarHBondContact O-N 2.87Å; D205-P207 WeakPolarHBondContact O-CD 3.19Å
206	R	54.3	Low	53	Low	171 Å²	171	105.3 Å²	105.3	65%	0.645	59%	0.588	S	S	*	*			trans	-86.8	98	166.1	-82.9	-175.2	172.5	150.3	-3	109.3	H208	R206-H208 PolarHBondContact O-N 3.11Å; R206-H208 VanDerWaalsContact O-N 3.17Å
207	P	47.3	Very low	52.4	Low	113 Å²	113	110.4 Å²	110.4	73%	0.734	62%	0.621	S	S	*	*			trans	-66.3	118	165.5	28.2	-32.1	0	0	0	108.5	D205	D205-P207 WeakPolarHBondContact O-CD 3.19Å
208	H	45.9	Very low	51.4	Low	180 Å²	180	113.5 Å²	113.5	83%	0.833	64%	0.636	S	S	*	*	S	Bend	trans	64.7	70.1	165.1	-78.4	71.7	0	0	0	118.3	R206	R206-H208 PolarHBondContact O-N 3.11Å; R206-H208 VanDerWaalsContact O-N 3.17Å
209	Q	51.2	Low	50.8	Low	135 Å²	135	112.5 Å²	112.5	63%	0.631	64%	0.641	S	S	*	*			trans	-128.6	3.8	154.2	-115.1	161.5	18.2	0	0	115.5	F211 A212	Q209-F211 PolarHBondContact O-N 3.41Å; Q209-F211 VanDerWaalsContact O-N 3.1Å; Q209-A212 PolarHBondContact O-N 2.79Å
210	L	50.4	Low	49.6	Very low	172 Å²	172	116.3 Å²	116.3	90%	0.901	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	5.4	176.9	-82.5	162.6	0	0	0	114.9
211	F	47.1	Very low	48.9	Very low	211 Å²	211	118.2 Å²	118.2	93%	0.925	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	6.1	173.4	-99	-84.4	0	0	0	114.5	Q209	Q209-F211 PolarHBondContact O-N 3.41Å; Q209-F211 VanDerWaalsContact O-N 3.1Å
212	A	48	Very low	48.3	Very low	84 Å²	84	121.9 Å²	121.9	69%	0.694	71%	0.711	S	S	*	*			trans	-119.1	20.2	176.3	0	0	0	0	0	113.9	Q209 A214	Q209-A212 PolarHBondContact O-N 2.79Å; A212-A214 PolarHBondContact O-N 3.48Å
213	D	41.4	Very low	47.6	Very low	137 Å²	137	126.6 Å²	126.6	73%	0.733	74%	0.741	S	S	*	*			trans	-84.8	84.3	165.4	-154.8	-98.6	0	0	0	108.5
214	A	40.8	Very low	47.1	Very low	83 Å²	83	126.5 Å²	126.5	69%	0.686	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-69.9	127.7	156.9	0	0	0	0	0	106.7	A212	A212-A214 PolarHBondContact O-N 3.48Å
215	P	46.8	Very low	46.4	Very low	106 Å²	106	130.2 Å²	130.2	69%	0.688	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-57.9	142.5	179.1	23.1	-31.4	0	0	0	109.4
216	P	56.6	Low	45.7	Very low	109 Å²	109	131.4 Å²	131.4	71%	0.708	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-56.5	137.3	174.5	23.5	-32	0	0	0	109
217	P	54	Low	45.3	Very low	112 Å²	112	127.3 Å²	127.3	73%	0.727	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.2	176.4	24.3	-32	0	0	0	108.9	T219	P217-T219 PolarHBondContact O-N 3.13Å
218	P	44.6	Very low	44.8	Very low	127 Å²	127	131 Å²	131	83%	0.825	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.7	117.4	-178.2	23.7	-31.9	0	0	0	109.2	A220	P218-A220 PolarHBondContact O-N 3.08Å; P218-A220 VanDerWaalsContact O-N 3.15Å
219	T	48.4	Very low	44.3	Very low	138 Å²	138	125.6 Å²	125.6	85%	0.847	77%	0.772	S	S	*	*			trans	-63.6	112.6	168.3	35.6	0	0	0	0	108.1	P217	P217-T219 PolarHBondContact O-N 3.13Å
220	A	41.2	Very low	43.6	Very low	89 Å²	89	126 Å²	126	74%	0.736	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.5	140.3	175.5	0	0	0	0	0	110.3	P218 T222	P218-A220 PolarHBondContact O-N 3.08Å; P218-A220 VanDerWaalsContact O-N 3.15Å; A220-T222 PolarHBondContact O-N 2.85Å
221	P	42.2	Very low	43	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.3	129.2	-180	26.7	-32	0	0	0	110.1	P223	P221-P223 WeakPolarHBondContact O-CD 3.5Å
222	T	44.7	Very low	42.9	Very low	133 Å²	133	120 Å²	120	82%	0.816	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.3	166.5	26.6	0	0	0	0	109.6	A220 V224	A220-T222 PolarHBondContact O-N 2.85Å; T222-V224 PolarHBondContact O-N 2.9Å
223	P	40.1	Very low	42.7	Very low	121 Å²	121	121.4 Å²	121.4	79%	0.786	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.6	121.9	173.5	28.7	-30.6	0	0	0	110	P221 L225	P221-P223 WeakPolarHBondContact O-CD 3.5Å; P223-L225 PolarHBondContact O-N 3Å
224	V	41.2	Very low	42.7	Very low	131 Å²	131	122.7 Å²	122.7	79%	0.794	78%	0.777	S	S	*	*			trans	-62.5	115.7	164.5	179.9	0	0	0	0	107.8	T222 T226	T222-V224 PolarHBondContact O-N 2.9Å; V224-T226 PolarHBondContact O-N 3.19Å; V224-T226 VanDerWaalsContact O-N 3.11Å
225	L	36.3	Very low	42.6	Very low	168 Å²	168	124.7 Å²	124.7	88%	0.88	78%	0.783	S	S	*	*			trans	-83.1	85.2	178.3	-156.1	136.6	0	0	0	109.2	P223 A227	P223-L225 PolarHBondContact O-N 3Å; L225-A227 PolarHBondContact O-N 2.71Å
226	T	37.5	Very low	43	Very low	120 Å²	120	123.2 Å²	123.2	74%	0.736	79%	0.787	S	S	*	*			trans	-76.2	118.1	166.7	-60.3	0	0	0	0	109	V224 M228	V224-T226 PolarHBondContact O-N 3.19Å; V224-T226 VanDerWaalsContact O-N 3.11Å; T226-M228 PolarHBondContact O-N 2.86Å
227	A	44.9	Very low	42.5	Very low	85 Å²	85	126 Å²	126	70%	0.702	80%	0.795	S	S	*	*			trans	-67.6	118	175.2	0	0	0	0	0	111.8	L225	L225-A227 PolarHBondContact O-N 2.71Å
228	M	37.7	Very low	42.4	Very low	191 Å²	191	125.7 Å²	125.7	94%	0.941	79%	0.793	S	S	*	*			trans	-172	110.6	153	-104.5	178.4	156.5	0	0	103.7	T226	T226-M228 PolarHBondContact O-N 2.86Å
229	G	36	Very low	42.7	Very low	66 Å²	66	125.4 Å²	125.4	68%	0.68	79%	0.791	S	S	*	*				106.4	107	60.3	0	0	0	0	0	108
230	T	36.1	Very low	42.4	Very low	143 Å²	143	125.5 Å²	125.5	88%	0.877	79%	0.794	S	S	*	*			trans	91	104.2	152	-26.7	0	0	0	0	119.2
231	A	36.5	Very low	43.2	Very low	80 Å²	80	124.8 Å²	124.8	66%	0.661	80%	0.796	S	S	*	*				66	119.2	129.6	0	0	0	0	0	122.5
232	M	45.8	Very low	43.3	Very low	176 Å²	176	123.5 Å²	123.5	87%	0.867	80%	0.795	S	S	*	*				151.1	146.3	109.3	-75.9	-57.4	-117.7	0	0	111.4
233	P	45	Very low	43.5	Very low	114 Å²	114	127 Å²	127	74%	0.74	80%	0.799	S	S	*	*			trans	-93.7	145.9	-169.4	36.2	-31.6	0	0	0	113.2
234	I	41.3	Very low	44.2	Very low	164 Å²	164	126.9 Å²	126.9	84%	0.841	80%	0.799	S	S	*	*			trans	-114.7	122.7	164.2	-56.5	-177.2	0	0	0	108.2
235	P	38.4	Very low	45	Very low	126 Å²	126	126.7 Å²	126.7	82%	0.818	80%	0.8	S	S	*	*			trans	-82.5	132.4	179.3	0.9	16.5	0	0	0	111.1
236	G	54.8	Low	45.8	Very low	74 Å²	74	125.4 Å²	125.4	76%	0.763	80%	0.799	S	S	*	*			trans	150.6	11.4	163.9	0	0	0	0	0	120.4
237	L	46.1	Very low	46.7	Very low	167 Å²	167	125.1 Å²	125.1	87%	0.874	80%	0.799	S	S	*	*			trans	-124.5	125.7	178.7	-97	143.4	0	0	0	112.1
238	P	52.6	Low	47.2	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	80%	0.803	S	S	*	*			trans	-72.4	143	170.7	29.1	-31.7	0	0	0	110.7
239	P	50.8	Low	47.5	Very low	120 Å²	120	124.2 Å²	124.2	78%	0.779	80%	0.8	S	S	*	*			trans	-71.9	141	-179.9	26.6	-31.5	0	0	0	111.9	G241	P239-G241 PolarHBondContact O-N 2.94Å
240	P	42.1	Very low	48.3	Very low	141 Å²	141	124.3 Å²	124.3	92%	0.916	80%	0.802	S	S	*	*			trans	-73.7	109.2	172.3	10.4	-1.5	0	0	0	110.4
241	G	56.3	Low	48.8	Very low	74 Å²	74	124.5 Å²	124.5	76%	0.763	80%	0.803	S	S	*	*			trans	-164.3	74.5	176.2	0	0	0	0	0	110.5	P239	P239-G241 PolarHBondContact O-N 2.94Å
242	A	45.8	Very low	49.4	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	82%	0.816	S	S	*	*			trans	-163.9	89.6	167.8	0	0	0	0	0	110.6
243	F	48.3	Very low	49.5	Very low	206 Å²	206	127.2 Å²	127.2	90%	0.904	81%	0.812	S	S	*	*			trans	-115.4	131.6	156.1	-70.5	-77.6	0	0	0	107.8
244	P	54.4	Low	50.1	Low	119 Å²	119	127.6 Å²	127.6	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-77.4	148.4	-179.1	30.4	-32.9	0	0	0	111.7
245	P	58.3	Low	50	Low	127 Å²	127	124.5 Å²	124.5	83%	0.825	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-82.4	147.1	179.7	32.4	-32.4	0	0	0	112.6
246	V	53.7	Low	50	Low	140 Å²	140	127.4 Å²	127.4	85%	0.848	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.9	135.5	176	-140.1	0	0	0	0	110
247	P	57	Low	50	Low	114 Å²	114	129 Å²	129	74%	0.74	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-86.1	147.8	179.6	31.8	-31.5	0	0	0	112.8
248	P	54.8	Low	50.7	Low	121 Å²	121	126.3 Å²	126.3	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.6	162.6	173.8	11.5	1.8	0	0	0	113.2
249	P	43.7	Very low	50.1	Low	136 Å²	136	126.8 Å²	126.8	88%	0.883	81%	0.814	S	S	*	*	S	Bend	trans	-84.5	132.5	-166.9	27.6	-21.5	0	0	0	112.9
250	G	53	Low	49.6	Very low	69 Å²	69	130.4 Å²	130.4	71%	0.711	82%	0.823	S	S	*	*			trans	120	86.2	163.2	0	0	0	0	0	115.2
251	T	46.9	Very low	49.3	Very low	147 Å²	147	127.4 Å²	127.4	90%	0.902	82%	0.818	S	S	*	*			trans	-161.5	132.2	150.6	37.6	0	0	0	0	109.6
252	M	48.9	Very low	48.3	Very low	189 Å²	189	132.4 Å²	132.4	93%	0.931	82%	0.823	S	S	*	*			trans	-83.2	157	178.7	-58.5	179	-123.3	0	0	111.7
253	P	48.3	Very low	48.8	Very low	123 Å²	123	133 Å²	133	80%	0.799	82%	0.819	S	S	*	*			trans	-117	162.2	155.8	34.1	-21.7	0	0	0	113.9
254	P	55.7	Low	49.5	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	81%	0.807	S	S	*	*			trans	-108.6	152.9	-162	35.7	-23.2	0	0	0	117.1
255	A	40.2	Very low	48.6	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	81%	0.811	S	S	*	*			trans	54	107.8	145.7	0	0	0	0	0	124.7
256	M	39	Very low	47.5	Very low	187 Å²	187	127.6 Å²	127.6	92%	0.921	81%	0.811	S	S	*	*				25.9	167.3	126.4	-86.6	-165.8	-173.4	0	0	124.4
257	P	55	Low	46.7	Very low	107 Å²	107	125 Å²	125	70%	0.695	81%	0.812	S	S	*	*			cis	-143.5	-151.5	0	36.4	-11.3	0	0	0	114.6
258	P	60.1	Low	45.6	Very low	111 Å²	111	123.4 Å²	123.4	72%	0.721	82%	0.817	S	S	*	*			cis	-130.8	-179.5	-39.4	24.1	-1.4	0	0	0	116.4
259	S	39.9	Very low	44.9	Very low	118 Å²	118	124.4 Å²	124.4	83%	0.825	82%	0.82	S	S	*	*			trans	100.4	135.6	156.2	79	0	0	0	0	116.1
260	M	39.8	Very low	45.2	Very low	195 Å²	195	123.6 Å²	123.6	96%	0.961	82%	0.815	S	S	*	*			cis	-165.1	144.8	10	-154.8	169.2	-174.3	0	0	108.2
261	G	36	Very low	45.1	Very low	78 Å²	78	126.2 Å²	126.2	80%	0.804	82%	0.82	S	S	*	*			trans	118.7	114.8	158.6	0	0	0	0	0	118.3
262	M	34.9	Very low	44.9	Very low	179 Å²	179	126.2 Å²	126.2	88%	0.882	82%	0.819	S	S	*	*			trans	-141.6	170.5	171.9	-107.5	-82.6	-175.8	0	0	106
263	P	56.3	Low	44.3	Very low	106 Å²	106	122.6 Å²	122.6	69%	0.688	81%	0.813	S	S	*	*			cis	-143.1	-146.4	-0.6	37	-11.8	0	0	0	112.5
264	P	63	Low	44	Very low	99 Å²	99	121.6 Å²	121.6	64%	0.643	81%	0.814	S	S	*	*				-131.3	171.3	-50.6	25	-5.1	0	0	0	115.5
265	T	36.1	Very low	43.1	Very low	140 Å²	140	119.9 Å²	119.9	86%	0.859	82%	0.819	S	S	*	*				155.2	149.7	122.4	47.6	0	0	0	0	109.5
266	A	35.7	Very low	43.2	Very low	99 Å²	99	118.5 Å²	118.5	82%	0.818	82%	0.815	S	S	*	*			cis	-167.8	148.7	-17.8	0	0	0	0	0	106.4
267	G	36.6	Very low	44.1	Very low	85 Å²	85	115.6 Å²	115.6	88%	0.876	81%	0.81	S	S	*	*			trans	118.4	94.1	157.9	0	0	0	0	0	117.2
268	G	34.4	Very low	44.4	Very low	82 Å²	82	116.3 Å²	116.3	85%	0.845	82%	0.815	S	S	*	*			trans	-93.2	166.4	175.7	0	0	0	0	0	115.2
269	V	40.4	Very low	44.3	Very low	141 Å²	141	117.2 Å²	117.2	86%	0.855	82%	0.82	S	S	*	*			trans	-97.4	165.1	167.5	-68.9	0	0	0	0	110.7
270	P	48.8	Very low	45.3	Very low	120 Å²	120	114.7 Å²	114.7	78%	0.779	81%	0.813	S	S	*	*				-147.3	172.1	108.3	33.3	-13.9	0	0	0	115.7
271	P	51.9	Low	46.7	Very low	124 Å²	124	111.4 Å²	111.4	81%	0.805	81%	0.806	S	S	*	*			trans	-101.5	161.7	-169.2	38.2	-30.9	0	0	0	114.5
272	V	42.9	Very low	48	Very low	147 Å²	147	113 Å²	113	89%	0.891	80%	0.803	S	S	*	*			trans	-135.2	146.6	170.6	-25.6	0	0	0	0	112.6
273	S	36.5	Very low	49.2	Very low	113 Å²	113	110.6 Å²	110.6	79%	0.79	80%	0.8	S	S	*	*			trans	-73.7	162.6	-175.3	-67.3	0	0	0	0	117.3
274	A	39.9	Very low	49.1	Very low	101 Å²	101	115 Å²	115	84%	0.835	81%	0.808	S	S	*	*			trans	76.3	117.9	138.6	0	0	0	0	0	121.7
275	G	37.7	Very low	48.8	Very low	87 Å²	87	115.6 Å²	115.6	90%	0.897	81%	0.813	S	S	*	*				79	103.9	120.8	0	0	0	0	0	120.2
276	G	41.4	Very low	49.3	Very low	70 Å²	70	115.3 Å²	115.3	72%	0.722	81%	0.813	S	S	*	*			trans	162.5	136.2	157	0	0	0	0	0	114.1
277	P	58.8	Low	49.6	Very low	125 Å²	125	113.5 Å²	113.5	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-73.2	156.4	174.4	30	-32.2	0	0	0	112
278	P	61.1	Low	50.2	Low	123 Å²	123	117.5 Å²	117.5	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.3	148.3	-167.8	28.4	-34.6	0	0	0	113.2
279	P	58.2	Low	50.9	Low	130 Å²	130	122.5 Å²	122.5	84%	0.844	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.8	142.3	178.1	29	-31.7	0	0	0	112
280	G	61.9	Low	51.3	Low	65 Å²	65	121.4 Å²	121.4	67%	0.67	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.5	166.8	176.1	0	0	0	0	0	113.9
281	P	67.2	Low	51.4	Low	125 Å²	125	122.2 Å²	122.2	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.6	152.5	-174.2	28.1	-33.3	0	0	0	112.9
282	P	65	Low	51.6	Low	113 Å²	113	119.8 Å²	119.8	73%	0.734	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.9	153.8	-177.3	29.8	-33.7	0	0	0	112.7
283	P	58.3	Low	52	Low	127 Å²	127	121.5 Å²	121.5	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.5	146.7	-180	30.5	-33	0	0	0	112.6
284	F	55.8	Low	52.5	Low	198 Å²	198	122.1 Å²	122.1	87%	0.868	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71.6	147.7	176.2	-70.3	-84.9	0	0	0	112.5
285	P	56.6	Low	52.9	Low	113 Å²	113	126.6 Å²	126.6	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-71.6	146.3	175.6	28.7	-33	0	0	0	112.1
286	P	47.1	Very low	53.5	Low	134 Å²	134	130.7 Å²	130.7	87%	0.87	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-85.7	119.2	-177.1	31.7	-29.8	0	0	0	111.2
287	G	40.9	Very low	54	Low	61 Å²	61	133.5 Å²	133.5	63%	0.629	82%	0.816	S	S	*	*			trans	180	124.6	169.7	0	0	0	0	0	113.1
288	N	49.1	Very low	53.9	Low	168 Å²	168	135.9 Å²	135.9	90%	0.898	82%	0.818	S	S	*	*			trans	94.9	70.3	164.8	-57.5	53.4	0	0	0	117.7
289	M	50.2	Low	53.8	Low	188 Å²	188	135.2 Å²	135.2	93%	0.926	81%	0.814	S	S	*	*			trans	-115.9	139	153.6	-87.2	169	174	0	0	111.5
290	P	48.5	Very low	54.1	Low	118 Å²	118	134.7 Å²	134.7	77%	0.766	81%	0.811	S	S	*	*			trans	-75.3	153.9	-175.7	30.2	-34.1	0	0	0	112.8
291	P	51.1	Low	54	Low	137 Å²	137	137.8 Å²	137.8	89%	0.89	82%	0.819	S	S	*	*	S	Bend	trans	-85.6	129.7	-171.6	31.1	-29.4	0	0	0	112.5
292	G	55.6	Low	53.4	Low	72 Å²	72	136.1 Å²	136.1	74%	0.742	82%	0.816	S	S	*	*			trans	150.5	69.6	161.4	0	0	0	0	0	116.6
293	M	50.8	Low	52.8	Low	183 Å²	183	136.5 Å²	136.5	90%	0.901	82%	0.818	S	S	*	*			trans	-154.4	147.2	149.5	-79.3	-144.7	169.1	0	0	111.5
294	P	48.2	Very low	52.2	Low	126 Å²	126	136.9 Å²	136.9	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.5	136.5	-176.6	6.9	6.3	0	0	0	112.5
295	Q	46.8	Very low	52.2	Low	195 Å²	195	131 Å²	131	91%	0.911	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69.5	133.5	177	-76.1	-162.1	-16.3	0	0	112.6
296	M	50.8	Low	51.8	Low	174 Å²	174	134.6 Å²	134.6	86%	0.857	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90.4	143.3	159	-75.2	-172.8	176.9	0	0	109.9
297	P	51.9	Low	52.3	Low	128 Å²	128	134.9 Å²	134.9	83%	0.831	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.4	-178.6	8.7	3.1	0	0	0	111.5
298	M	56.7	Low	52.9	Low	175 Å²	175	137.5 Å²	137.5	86%	0.862	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.6	143.1	171.1	-71.2	-81.2	-83.4	0	0	110.9
299	P	59.8	Low	53.4	Low	109 Å²	109	135 Å²	135	71%	0.708	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.5	154	171.6	31.4	-32.2	0	0	0	111.8
300	P	63.1	Low	53.9	Low	119 Å²	119	131.7 Å²	131.7	77%	0.773	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.3	155.5	-177.4	29.6	-34.2	0	0	0	112.9
301	P	59.5	Low	54.2	Low	130 Å²	130	132.2 Å²	132.2	84%	0.844	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75.1	141.8	-179.6	30	-32.6	0	0	0	112.2
302	A	56.5	Low	54.4	Low	91 Å²	91	130 Å²	130	75%	0.752	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.5	150.1	175.3	0	0	0	0	0	111.9
303	P	51.1	Low	54	Low	120 Å²	120	132.3 Å²	132.3	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.1	156.6	-178.9	28.6	-33.3	0	0	0	112.8
304	P	46.5	Very low	53.5	Low	135 Å²	135	130.1 Å²	130.1	88%	0.877	81%	0.814	S	S	*	*	S	Bend	trans	-84.7	131	-172.6	11.8	4.3	0	0	0	111.7
305	G	54.6	Low	53.5	Low	74 Å²	74	127.7 Å²	127.7	76%	0.763	81%	0.811	S	S	*	*			trans	157.1	18.1	166.6	0	0	0	0	0	120.8
306	M	48.6	Very low	53.3	Low	189 Å²	189	123.4 Å²	123.4	93%	0.931	80%	0.803	S	S	*	*			trans	-133.7	120.3	173.3	-71.7	-174.8	172.8	0	0	112.1
307	V	57.4	Low	52.7	Low	141 Å²	141	120.1 Å²	120.1	86%	0.855	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65.4	135.6	169.8	-85.9	0	0	0	0	110.3
308	P	53.4	Low	52.1	Low	116 Å²	116	123.1 Å²	123.1	75%	0.753	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-75.2	143.8	174.7	29.4	-31.3	0	0	0	111
309	P	60.6	Low	51.2	Low	115 Å²	115	126 Å²	126	75%	0.747	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-74.7	157.1	175.3	30.4	-33.2	0	0	0	112.1
310	P	61.3	Low	50.3	Low	118 Å²	118	125 Å²	125	77%	0.766	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.5	154.8	-178	29.7	-34.4	0	0	0	112.6
311	P	54.1	Low	49.3	Very low	130 Å²	130	125.5 Å²	125.5	84%	0.844	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-76.4	138.5	-178.2	30.2	-32	0	0	0	112.1
312	A	55.4	Low	48.7	Very low	89 Å²	89	126.8 Å²	126.8	74%	0.736	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.3	153.4	176.5	0	0	0	0	0	112.3
313	P	46.6	Very low	48.2	Very low	121 Å²	121	128 Å²	128	79%	0.786	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.5	151.5	-176.2	28.4	-33.6	0	0	0	113	G315	P313-G315 PolarHBondContact O-N 3.34Å
314	P	40.2	Very low	48.2	Very low	138 Å²	138	128.2 Å²	128.2	90%	0.896	81%	0.812	S	S	*	*	S	Bend	trans	-83.2	116	-174.6	31	-30.3	0	0	0	111.4
315	G	49.3	Very low	48.1	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	81%	0.812	S	S	*	*			trans	157.9	66.9	168.3	0	0	0	0	0	116.4	P313	P313-G315 PolarHBondContact O-N 3.34Å
316	S	40.9	Very low	47.7	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	82%	0.819	S	S	*	*			trans	-173.9	92.8	152.4	53.6	0	0	0	0	110.5	Q318	S316-Q318 PolarHBondContact O-N 2.74Å
317	A	39.2	Very low	48	Very low	104 Å²	104	131.3 Å²	131.3	86%	0.86	81%	0.81	S	S	*	*			trans	-70.4	109.4	166.3	0	0	0	0	0	108.8	R319	A317-R319 PolarHBondContact O-N 3.25Å
318	Q	39.8	Very low	47.9	Very low	192 Å²	192	130.4 Å²	130.4	90%	0.897	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.7	119.7	169.1	-88.1	158.2	-53.2	0	0	109.9	S316	S316-Q318 PolarHBondContact O-N 2.74Å
319	R	37.6	Very low	47.9	Very low	236 Å²	236	130.5 Å²	130.5	89%	0.891	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-67.1	130.2	167.6	-79.6	168.9	72.2	-171.4	4	109.4	A317	A317-R319 PolarHBondContact O-N 3.25Å
320	A	40	Very low	47.4	Very low	87 Å²	87	131.3 Å²	131.3	72%	0.719	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.2	142.3	160.2	0	0	0	0	0	110
321	P	42.1	Very low	46.9	Very low	130 Å²	130	135.2 Å²	135.2	84%	0.844	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-79.2	136.4	179.5	28.9	-29.9	0	0	0	112
322	L	47.3	Very low	46.5	Very low	156 Å²	156	132.3 Å²	132.3	82%	0.817	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-88.2	150.1	172	-75.6	162	0	0	0	110.6
323	P	45.6	Very low	46.1	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.9	150.9	-179.9	30.2	-33.8	0	0	0	112.7
324	P	51.7	Low	46.3	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	82%	0.823	S	S	*	*			trans	-99.2	109.3	-171.6	33.6	-25.8	0	0	0	112.4
325	N	43.3	Very low	46.5	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	82%	0.821	S	S	*	*			trans	-176.1	104.5	140.3	-129.5	9.1	0	0	0	112.6
326	M	46.3	Very low	46.3	Very low	186 Å²	186	143.5 Å²	143.5	92%	0.916	83%	0.825	S	S	*	*			trans	-171.1	139.3	146.3	-109.2	179.3	178.6	0	0	110.6
327	P	56.2	Low	46.4	Very low	114 Å²	114	142.6 Å²	142.6	74%	0.74	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-76.2	155.6	-177.7	31	-33.5	0	0	0	112.5
328	P	54.2	Low	46.7	Very low	122 Å²	122	143.7 Å²	143.7	79%	0.792	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.6	148	-173.9	31.7	-34	0	0	0	112.9
329	P	53.1	Low	47.1	Very low	118 Å²	118	144.2 Å²	144.2	77%	0.766	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-85.9	160.3	171.5	33.6	-31.8	0	0	0	112.5
330	P	51.1	Low	47.6	Very low	132 Å²	132	139 Å²	139	86%	0.857	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78.8	150.6	-169.5	32.4	-34	0	0	0	112.9
331	M	49.9	Very low	48	Very low	201 Å²	201	143.9 Å²	143.9	99%	0.99	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-85.5	127.3	-177.6	-159.1	160.2	-161.2	0	0	110.8
332	G	45.8	Very low	48.4	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	82%	0.818	S	S	*	*			trans	151.4	92.7	164.4	0	0	0	0	0	115
333	M	47.3	Very low	49	Very low	186 Å²	186	139.7 Å²	139.7	92%	0.916	81%	0.814	S	S	*	*			trans	-178.2	144.8	139.9	-100.3	-166.3	-178.2	0	0	110.3
334	P	50.2	Low	49.3	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.4	148.1	-178.2	31.8	-33.2	0	0	0	111.8
335	P	44.5	Very low	49.5	Very low	131 Å²	131	140.7 Å²	140.7	85%	0.851	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.3	130.6	-174.6	28	-32.1	0	0	0	112.8
336	R	46.1	Very low	50	Low	228 Å²	228	138.1 Å²	138.1	86%	0.86	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.8	138.5	163.5	-77.9	173.8	73	124.3	-3.7	109.8
337	A	42.8	Very low	50	Low	86 Å²	86	135.9 Å²	135.9	71%	0.711	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-59.9	140.3	174.3	0	0	0	0	0	112.1
338	P	45.4	Very low	49.9	Very low	128 Å²	128	134.1 Å²	134.1	83%	0.831	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.6	131.8	175.2	27.2	-23.9	0	0	0	111.7
339	Y	48.6	Very low	50	Low	202 Å²	202	137.5 Å²	137.5	79%	0.792	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-68.4	148.3	164	-70.5	-91.4	0	0	0	110.1	M341	Y339-M341 PolarHBondContact O-N 3.12Å
340	P	48.6	Very low	49.8	Very low	126 Å²	126	143.9 Å²	143.9	82%	0.818	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-71.3	122.6	178.1	27.7	-31.3	0	0	0	111
341	M	46.8	Very low	50.2	Low	190 Å²	190	140.5 Å²	140.5	94%	0.936	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.1	135.4	167.7	-92.9	-147.7	-179.2	0	0	110.6	Y339	Y339-M341 PolarHBondContact O-N 3.12Å
342	A	51.6	Low	50.7	Low	85 Å²	85	136.9 Å²	136.9	70%	0.702	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.1	149	168.2	0	0	0	0	0	111.3
343	P	59.2	Low	51.2	Low	114 Å²	114	139.4 Å²	139.4	74%	0.74	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.5	152.6	-179.7	28.3	-33.3	0	0	0	112.7
344	P	52.4	Low	51.7	Low	128 Å²	128	136 Å²	136	83%	0.831	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.7	139.7	-176.3	29.4	-33.6	0	0	0	112.8
345	V	56.7	Low	52	Low	134 Å²	134	136.7 Å²	136.7	81%	0.812	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-83.9	137	175.8	-176.7	0	0	0	0	109.9
346	P	52.5	Low	52.4	Low	109 Å²	109	139 Å²	139	71%	0.708	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-66.5	153.1	178.6	-12.2	23.4	0	0	0	113.4	G348	P346-G348 PolarHBondContact O-N 2.85Å
347	P	46.8	Very low	52.9	Low	139 Å²	139	133.7 Å²	133.7	90%	0.903	81%	0.805	S	S	*	*	S	Bend	trans	-79.7	117.5	-177.5	5.4	11.3	0	0	0	110.8
348	G	54.6	Low	53.4	Low	76 Å²	76	135.2 Å²	135.2	78%	0.784	81%	0.808	S	S	*	*	S	Bend	trans	166.2	-11.1	172.7	0	0	0	0	0	118.8	P346	P346-G348 PolarHBondContact O-N 2.85Å
349	M	55.1	Low	53.6	Low	194 Å²	194	135.7 Å²	135.7	96%	0.956	81%	0.811	S	S	*	*			trans	-130.3	79.3	179.4	-77.4	-169.8	163.9	0	0	111.8
350	R	48.9	Very low	53.6	Low	252 Å²	252	129.1 Å²	129.1	95%	0.951	81%	0.805	S	S	*	*			trans	-95.9	94.8	163.7	-123.5	-179.7	169.2	-162.2	-3.5	107.4
351	G	59.3	Low	53.5	Low	61 Å²	61	134.9 Å²	134.9	63%	0.629	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.1	154.9	166.3	0	0	0	0	0	110.8
352	P	60.7	Low	53.3	Low	125 Å²	125	129.3 Å²	129.3	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-62.6	148.8	179.8	26	-32.5	0	0	0	111.2
353	P	57	Low	53.2	Low	120 Å²	120	130.4 Å²	130.4	78%	0.779	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.9	149.4	-177.3	27.9	-34.1	0	0	0	111.5
354	P	57.3	Low	52.6	Low	116 Å²	116	129.4 Å²	129.4	75%	0.753	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-66.6	151.1	175.8	28	-33	0	0	0	111.4
355	P	56.2	Low	52.8	Low	126 Å²	126	128.9 Å²	128.9	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.1	142.5	-177.7	28.3	-32.7	0	0	0	111.6
356	M	54.5	Low	52.8	Low	179 Å²	179	128.8 Å²	128.8	88%	0.882	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.3	142.7	173.2	-70.8	-166.6	-77.9	0	0	111.1
357	P	56.8	Low	52.9	Low	117 Å²	117	126.5 Å²	126.5	76%	0.76	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.4	148	171.4	29.8	-31.8	0	0	0	111.3
358	P	52.4	Low	53.6	Low	119 Å²	119	125.7 Å²	125.7	77%	0.773	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70	153.8	-177	26.6	-32.7	0	0	0	113.1
359	P	49.4	Very low	53.8	Low	138 Å²	138	128 Å²	128	90%	0.896	81%	0.805	S	S	*	*	S	Bend	trans	-81.3	126.4	-171.5	27.7	-24.8	0	0	0	112
360	G	48.8	Very low	53.8	Low	64 Å²	64	130 Å²	130	66%	0.66	80%	0.802	S	S	*	*			trans	117.4	95.4	161.2	0	0	0	0	0	113.9
361	Y	46.1	Very low	54.2	Low	246 Å²	246	123.7 Å²	123.7	97%	0.965	79%	0.793	S	S	*	*			trans	-154.9	134.6	130.3	-99.8	-80	0	0	0	107.6
362	G	42.1	Very low	54.2	Low	74 Å²	74	126 Å²	126	76%	0.763	80%	0.797	S	S	*	*			trans	-68	171.9	-161.7	0	0	0	0	0	116.6	A364	G362-A364 PolarHBondContact O-N 3.14Å
363	A	49.6	Very low	53.6	Low	107 Å²	107	126.1 Å²	126.1	88%	0.884	80%	0.798	S	S	*	*			trans	-40.3	125.5	179.6	0	0	0	0	0	114.6
364	A	47	Very low	53.2	Low	93 Å²	93	131 Å²	131	77%	0.769	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-91.4	138.9	160.6	0	0	0	0	0	109.4	G362	G362-A364 PolarHBondContact O-N 3.14Å
365	P	57.7	Low	53.1	Low	117 Å²	117	128.6 Å²	128.6	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.9	156.1	-173.7	27.9	-34.1	0	0	0	112.5	G367	P365-G367 PolarHBondContact O-N 3.39Å
366	P	55.1	Low	52.6	Low	132 Å²	132	132.5 Å²	132.5	86%	0.857	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.7	121.8	178.5	25.8	-31.9	0	0	0	110.5
367	G	55.2	Low	52.2	Low	62 Å²	62	133.6 Å²	133.6	64%	0.639	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.1	159.7	170.5	0	0	0	0	0	112.2	P365	P365-G367 PolarHBondContact O-N 3.39Å
368	P	62.5	Low	51.7	Low	122 Å²	122	139.6 Å²	139.6	79%	0.792	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-64.7	151.6	-172.6	25.8	-33.4	0	0	0	112.7
369	P	57.1	Low	51.8	Low	125 Å²	125	138 Å²	138	81%	0.812	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65.9	141.6	-177	26.2	-32.7	0	0	0	111.9
370	R	56.6	Low	52.4	Low	235 Å²	235	136.8 Å²	136.8	89%	0.887	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.8	141.9	176.3	-64.7	176.1	176.3	-141.5	-1.4	110.6
371	P	57	Low	52.7	Low	119 Å²	119	140 Å²	140	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-70.1	150.5	173.9	28.6	-32.2	0	0	0	111.2
372	P	59.2	Low	53.3	Low	110 Å²	110	136.8 Å²	136.8	71%	0.714	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.9	155.8	179.2	28.6	-33.5	0	0	0	112
373	P	48.9	Very low	54.5	Low	127 Å²	127	138.7 Å²	138.7	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.5	135.9	179.3	26.6	-32.6	0	0	0	111.6	G375	P373-G375 PolarHBondContact O-N 3.05Å
374	F	47.4	Very low	55.1	Low	223 Å²	223	139.8 Å²	139.8	98%	0.978	81%	0.81	S	S	*	*	S	Bend	trans	-62.6	117.4	172.5	-92.7	-98.6	0	0	0	110.3
375	G	55.2	Low	55.5	Low	65 Å²	65	143.8 Å²	143.8	67%	0.67	81%	0.805	S	S	*	*			trans	178	0.7	178.5	0	0	0	0	0	117.2	P373	P373-G375 PolarHBondContact O-N 3.05Å
376	F	46	Very low	55.6	Low	209 Å²	209	143.2 Å²	143.2	92%	0.917	80%	0.802	S	S	*	*			trans	-126.3	88.7	170.1	-81.6	-86.5	0	0	0	110.1	R378	F376-R378 PolarHBondContact O-N 3.23Å; F376-R378 VanDerWaalsContact O-N 3.09Å
377	Q	45.9	Very low	55.3	Low	201 Å²	201	143.4 Å²	143.4	94%	0.939	80%	0.803	S	S	*	*			trans	-69.5	103.9	166.3	-150.3	151.1	25.2	0	0	107.2	A379	Q377-A379 PolarHBondContact O-N 2.73Å
378	R	47.1	Very low	55.5	Low	243 Å²	243	144.3 Å²	144.3	92%	0.917	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.6	116.6	168.5	-119.7	177.5	164.1	-157.7	-4	107.4	F376	F376-R378 PolarHBondContact O-N 3.23Å; F376-R378 VanDerWaalsContact O-N 3.09Å
379	A	54.3	Low	55.3	Low	86 Å²	86	141.1 Å²	141.1	71%	0.711	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-57.1	144.3	170.3	0	0	0	0	0	109.9	Q377	Q377-A379 PolarHBondContact O-N 2.73Å
380	P	61.4	Low	55.7	Low	113 Å²	113	140.4 Å²	140.4	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.7	149	174.2	26.5	-31.9	0	0	0	110.3	M382	P380-M382 PolarHBondContact O-N 3.41Å
381	P	55.3	Low	56	Low	130 Å²	130	135 Å²	135	84%	0.844	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.2	130.4	-179.1	25.6	-32.4	0	0	0	110.7
382	M	58.3	Low	55.9	Low	180 Å²	180	141.2 Å²	141.2	89%	0.887	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.3	146.3	174.8	-73.8	-167.2	-91.8	0	0	111.2	P380	P380-M382 PolarHBondContact O-N 3.41Å
383	P	66.8	Low	55.6	Low	113 Å²	113	142.1 Å²	142.1	73%	0.734	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67.1	156	174.6	28	-33.4	0	0	0	111.9
384	P	63.8	Low	56.1	Low	131 Å²	131	145.5 Å²	145.5	85%	0.851	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-64.1	140.5	-176.2	25.6	-33.1	0	0	0	112.1
385	R	53.8	Low	56.5	Low	176 Å²	176	141.6 Å²	141.6	66%	0.664	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.5	135	-176.6	-167.6	171.4	166.6	-120.5	5.6	110.4	A389	R385-A389 VanDerWaalsContact NH2-C 3.35Å; R385-A389 PolarHBondContact NH2-O 3.46Å
386	P	60.5	Low	56.6	Low	106 Å²	106	145.6 Å²	145.6	69%	0.688	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67.8	148.7	172.8	26	-31.2	0	0	0	111	G388	P386-G388 PolarHBondContact O-N 3.23Å
387	P	49.3	Very low	57.2	Low	136 Å²	136	142.1 Å²	142.1	88%	0.883	81%	0.814	S	S	*	*	S	Bend	trans	-69	127.1	-175.6	26.5	-31.6	0	0	0	111
388	G	59.1	Low	57.9	Low	80 Å²	80	138.6 Å²	138.6	83%	0.825	81%	0.806	S	S	*	*			trans	138.3	10.2	165.2	0	0	0	0	0	119.7	P386	P386-G388 PolarHBondContact O-N 3.23Å
389	A	57.3	Low	58.5	Low	55 Å²	55	132.1 Å²	132.1	46%	0.455	80%	0.799	S	S	.	*			trans	-109.4	133.2	179.7	0	0	0	0	0	113.6	R385	R385-A389 VanDerWaalsContact NH2-C 3.35Å; R385-A389 PolarHBondContact NH2-O 3.46Å
390	P	66.9	Low	58.8	Low	110 Å²	110	135.2 Å²	135.2	71%	0.714	81%	0.805	S	S	*	*			trans	-73.2	158	-173.8	29.8	-34.9	0	0	0	113
391	P	61.7	Low	58.6	Low	123 Å²	123	136.8 Å²	136.8	80%	0.799	81%	0.81	S	S	*	*			trans	-76.4	141.2	-177.3	30.4	-32.7	0	0	0	111.7
392	R	54.8	Low	58.9	Low	249 Å²	249	137.3 Å²	137.3	94%	0.94	81%	0.808	S	S	*	*			trans	-92.3	114.9	169.1	-146.5	169.9	176.2	-104.4	1.6	107.4
393	V	54.5	Low	58.9	Low	128 Å²	128	133.8 Å²	133.8	78%	0.776	80%	0.801	S	S	*	*			trans	-66	141.7	178.3	-139.6	0	0	0	0	108.6
394	P	58.7	Low	58.2	Low	198 Å²	198	135.6 Å²	135.6	100%	1.286	81%	0.807	S	S	*	*			trans	-61.6	0	-173.2	23.2	-35.5	0	0	0	115

Retrieved 394 of 394 residues in 423.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).