A0A087Y422_POEFO Loading...

Methylosome subunit pICln

Involved in both the assembly of spliceosomal snRNPs and the methylation of Sm proteins. Chaperone that regulates the assembly of spliceosomal U1, U2, U4 and U5 small nuclear ribonucleoproteins (snRNPs), the building blocks of the spliceosome, and thereby plays an important role in the splicing of cellular pre-mRNAs. Most spliceosomal snRNPs contain a common set of Sm proteins SNRPB, SNRPD1, SNRPD2, SNRPD3, SNRPE, SNRPF and SNRPG that assemble in a heptameric protein ring on the Sm site of the small nuclear RNA to form the core snRNP (Sm core). In the cytosol, the Sm proteins SNRPD1, SNRPD2, SNRPE, SNRPF and SNRPG are trapped in an inactive 6S pICln-Sm complex by the chaperone CLNS1A that controls the assembly of the core snRNP. Dissociation by the SMN complex of CLNS1A from the trapped Sm proteins and their transfer to an SMN-Sm complex triggers the assembly of core snRNPs and their transport to the nucleus.

AlphaFold DB , UniProt , Accession A0A087Y422, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	72.6	Confident	232 Å²	232	98.6 Å²	98.6	100%	1.143	52%	0.519	S	S	*	.				0	126.3	0	-78.6	-178.6	171.8	0	0	106.8
2	V	55.9	Low	73.5	Confident	37 Å²	37	104.4 Å²	104.4	22%	0.224	54%	0.541	C	S	.	.			trans	-76.5	126	-179.9	-174.7	0	0	0	0	109	L4 L25 L30	V2-L4 PolarHBondContact O-N 3.4Å; V2-L25 HydrophobicContact CB-CD2 4.43Å; V2-L25 HydrophobicContact CG1-CB 4.49Å; V2-L25 HydrophobicContact CG1-CD1 3.81Å; V2-L25 HydrophobicContact CG1-CD2 3.97Å; V2-L25 HydrophobicContact CG1-CG 4.32Å; V2-L25 HydrophobicContact CG2-CB 4.5Å; V2-L25 HydrophobicContact CG2-CD2 3.61Å; V2-L30 HydrophobicContact CB-CD2 4.06Å; V2-L30 HydrophobicContact CG1-CD1 4.35Å; V2-L30 HydrophobicContact CG1-CD2 4.02Å; V2-L30 HydrophobicContact CG2-CD2 4.26Å
3	L	64.6	Low	74.6	Confident	90 Å²	90	97.9 Å²	97.9	47%	0.471	52%	0.515	S	S	.	.			trans	-91.4	103.5	-177.7	-164.8	81.9	0	0	0	110	K5	L3-K5 HydrophobicContact CD2-CG 4.3Å
4	L	77.6	Confident	75.9	Confident	46 Å²	46	94.7 Å²	94.7	24%	0.241	50%	0.502	C	S	.	.			trans	-79.7	127.6	165.8	-63.3	171.4	0	0	0	108.8	V2 L30 W44 L50 G51 F52	V2-L4 PolarHBondContact O-N 3.4Å; L4-L30 HydrophobicContact CD2-CD1 4.34Å; L4-W44 HydrophobicContact CD2-CZ3 4.18Å; L4-L50 HydrophobicContact CB-CB 3.98Å; L4-L50 HydrophobicContact CD1-CB 4.36Å; L4-G51 CarbonylContact C-O 3.55Å; L4-F52 HydrophobicContact CD2-CD1 4.11Å
5	K	78.6	Confident	77.1	Confident	97 Å²	97	96.1 Å²	96.1	42%	0.422	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150	179.3	-64	-179.3	-179.1	-177	0	109.5	L3 I7 L50 G51	L3-K5 HydrophobicContact CD2-CG 4.3Å; K5-I7 HydrophobicContact CB-CD1 3.7Å; K5-I7 HydrophobicContact CB-CG1 3.67Å; K5-I7 HydrophobicContact CD-CD1 4.34Å; K5-I7 PolarHBondContact O-N 2.97Å; K5-L50 WeakPolarHBondContact O-CA 3.3Å; K5-G51 PolarHBondContact N-O 3.38Å; K5-G51 PolarHBondContact O-N 3.41Å
6	N	77.1	Confident	78.2	Confident	130 Å²	130	92.3 Å²	92.3	70%	0.695	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	94.3	171.4	-172.8	25.1	0	0	0	108.5	G49 L50	N6-G49 PolarHBondContact OD1-O 2.89Å; N6-L50 HydrophobicContact CB-CD2 4.28Å
7	I	76.6	Confident	79.2	Confident	53 Å²	53	93.3 Å²	93.3	27%	0.272	48%	0.478	S	S	.	.			trans	-120.7	148.8	-176.6	-51.8	169.1	0	0	0	107.6	K5 F45	K5-I7 HydrophobicContact CB-CD1 3.7Å; K5-I7 HydrophobicContact CB-CG1 3.67Å; K5-I7 HydrophobicContact CD-CD1 4.34Å; K5-I7 PolarHBondContact O-N 2.97Å; I7-F45 HydrophobicContact CB-CE1 3.99Å; I7-F45 HydrophobicContact CG2-CE1 4.49Å; I7-F45 WeakPolarHBondContact O-CE1 3.38Å
8	H	76.5	Confident	80.1	Confident	163 Å²	163	89.8 Å²	89.8	76%	0.755	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-82.8	140.6	173.3	-70.4	-74.3	0	0	0	110.9
9	P	81.8	Confident	80.9	Confident	57 Å²	57	87.7 Å²	87.7	37%	0.37	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-54.7	139.9	170.9	-24.2	33.5	0	0	0	111.1	T11 Y36 F45	P9-T11 PolarHBondContact O-N 2.66Å; P9-Y36 HydrophobicContact CB-CE1 4.44Å; P9-Y36 HydrophobicContact CB-CE2 4.12Å; P9-F45 HydrophobicContact CB-CE2 4.13Å; P9-F45 HydrophobicContact CB-CZ 4.43Å; P9-F45 HydrophobicContact CG-CD2 4.4Å; P9-F45 HydrophobicContact CG-CE2 4.3Å; P9-F45 HydrophobicContact CG-CZ 4.42Å
10	P	83.7	Confident	81.6	Confident	34 Å²	34	85.5 Å²	85.5	22%	0.221	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-61.9	131.6	177.3	25.6	-32.7	0	0	0	110.1	V14 Y36 A38	P10-V14 HydrophobicContact CB-CG2 4.2Å; P10-V14 HydrophobicContact CG-CG2 4.16Å; P10-V14 VanDerWaalsContact O-CG2 3.23Å; P10-V14 WeakPolarHBondContact O-CG2 3.46Å; P10-Y36 HydrophobicContact CG-CD1 4.42Å; P10-Y36 HydrophobicContact CG-CG 4.19Å; P10-A38 HydrophobicContact CB-CB 4.11Å; P10-A38 HydrophobicContact CG-CB 4.11Å
11	T	82.6	Confident	82.3	Confident	146 Å²	146	81.4 Å²	81.4	90%	0.896	43%	0.431	S	S	*	.			trans	-101.8	-11.4	177.6	51.8	0	0	0	0	113.6	P9	P9-T11 PolarHBondContact O-N 2.66Å
12	E	83.4	Confident	84.8	Confident	168 Å²	168	71.4 Å²	71.4	79%	0.785	38%	0.382	S	S	*	.	S	Bend	trans	-124.7	148.7	-176.9	-172.9	171.5	-168.5	0	0	110	V14	E12-V14 PolarHBondContact O-N 3.41Å; E12-V14 VanDerWaalsContact O-N 3.11Å
13	G	87	Confident	86.7	Confident	20 Å²	20	69.6 Å²	69.6	21%	0.206	37%	0.372	C	S	.	.	S	Bend	trans	64.9	14.2	176.9	0	0	0	0	0	114.8	R15 A38 E39	G13-R15 PolarHBondContact O-N 2.88Å; G13-A38 CarbonylContact O-C 3.39Å; G13-A38 VanDerWaalsContact O-CA 3.26Å; G13-A38 WeakPolarHBondContact O-CA 2.94Å; G13-E39 PolarHBondContact O-N 3.25Å
14	V	93.5	Very high	88.1	Confident	53 Å²	53	65.5 Å²	65.5	32%	0.321	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	116.5	178	-176.3	0	0	0	0	109.4	P10 E12 Y36 A38	P10-V14 HydrophobicContact CB-CG2 4.2Å; P10-V14 HydrophobicContact CG-CG2 4.16Å; P10-V14 VanDerWaalsContact O-CG2 3.23Å; P10-V14 WeakPolarHBondContact O-CG2 3.46Å; E12-V14 PolarHBondContact O-N 3.41Å; E12-V14 VanDerWaalsContact O-N 3.11Å; V14-Y36 HydrophobicContact CG1-CD1 4.39Å; V14-A38 HydrophobicContact CG2-CB 4.45Å
15	R	93.8	Very high	88.8	Confident	115 Å²	115	63.6 Å²	63.6	43%	0.434	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-37.4	176.6	-70.8	-69.4	-173.9	-92.1	-1.9	111.9	G13 V37 E39 A138	G13-R15 PolarHBondContact O-N 2.88Å; R15-V37 PolarHBondContact N-O 2.92Å; R15-E39 HydrophobicContact CG-CG 4.36Å; R15-E39 VanDerWaalsContact CZ-CG 3.47Å; R15-E39 IonicContact CZ-OE1 3.39Å; R15-E39 IonicContact NH1-OE1 2.76Å; R15-E39 PolarHBondContact NH1-OE1 2.81Å; R15-E39 IonicContact NH2-OE1 2.79Å; R15-E39 PolarHBondContact NH2-OE1 3.37Å; R15-E39 IonicContact NH2-OE2 2.71Å; R15-A138 HydrophobicContact CB-CB 4.31Å
16	H	94.7	Very high	89.4	Confident	35 Å²	35	63.2 Å²	63.2	16%	0.162	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	138.5	-179.9	-171.7	78.1	0	0	0	111.4	V37 M135 A138	H16-V37 HydrophobicContact CB-CB 4.04Å; H16-V37 HydrophobicContact CB-CG2 4.14Å; H16-V37 PolarHBondContact N-O 3.31Å; H16-V37 VanDerWaalsContact N-O 3.08Å; H16-V37 PolarHBondContact O-N 2.78Å; H16-M135 WeakPolarHBondContact NE2-CG 3.4Å; H16-A138 HydrophobicContact CB-CB 3.62Å
17	E	95.4	Very high	90	Very high	110 Å²	110	59.5 Å²	59.5	51%	0.514	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.5	173.2	176.5	177.2	-179.6	0	0	108.4	T34 L35 Y36	E17-T34 HydrophobicContact CG-CG2 3.72Å; E17-L35 WeakPolarHBondContact CA-O 3.17Å; E17-Y36 HydrophobicContact CB-CD1 4.2Å; E17-Y36 HydrophobicContact CB-CE1 4.2Å; E17-Y36 HydrophobicContact CG-CD1 3.94Å; E17-Y36 HydrophobicContact CG-CE1 3.52Å; E17-Y36 WeakPolarHBondContact OE1-CE1 3.4Å; E17-Y36 PolarHBondContact OE1-OH 2.96Å
18	Q	95.8	Very high	90.7	Very high	31 Å²	31	62 Å²	62	15%	0.145	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	100.2	178.6	-172.9	57.1	50.8	0	0	111.1	T21 T34 L35 P126 S131 M135	Q18-T21 VanDerWaalsContact CG-OG1 3.28Å; Q18-T21 WeakPolarHBondContact CG-OG1 3.31Å; Q18-T21 PolarHBondContact O-OG1 3.19Å; Q18-T34 WeakPolarHBondContact O-CA 3.26Å; Q18-L35 HydrophobicContact CB-CB 4.44Å; Q18-L35 PolarHBondContact N-O 2.9Å; Q18-L35 PolarHBondContact O-N 3.02Å; Q18-P126 HydrophobicContact CG-CB 4.28Å; Q18-S131 PolarHBondContact OE1-OG 3.43Å; Q18-M135 HydrophobicContact CB-CG 4.16Å; Q18-M135 HydrophobicContact CB-SD 4.22Å; Q18-M135 HydrophobicContact CG-CE 4.49Å; Q18-M135 HydrophobicContact CG-CG 4.33Å; Q18-M135 HydrophobicContact CG-SD 3.84Å
19	A	95	Very high	91.4	Very high	50 Å²	50	62.7 Å²	62.7	41%	0.413	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	164.2	170.9	0	0	0	0	0	111.8	T21 T34	A19-T21 VanDerWaalsContact C-N 3.29Å; A19-T21 PolarHBondContact O-N 2.99Å; A19-T34 HydrophobicContact CB-CG2 4.46Å
20	A	95	Very high	91.8	Very high	43 Å²	43	61.6 Å²	61.6	36%	0.355	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.2	41.5	178.3	0	0	0	0	0	113.5	C32 G33 T127	A20-C32 VanDerWaalsContact CA-SG 3.56Å; A20-G33 PolarHBondContact N-O 2.84Å; A20-T127 WeakPolarHBondContact O-CB 3.23Å; A20-T127 PolarHBondContact O-N 2.83Å; A20-T127 PolarHBondContact O-OG1 2.86Å
21	T	96.5	Very high	92.1	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.3	177.8	-57.4	0	0	0	0	110	Q18 A19 G33 L35 W44 F124 M135	Q18-T21 VanDerWaalsContact CG-OG1 3.28Å; Q18-T21 WeakPolarHBondContact CG-OG1 3.31Å; Q18-T21 PolarHBondContact O-OG1 3.19Å; A19-T21 VanDerWaalsContact C-N 3.29Å; A19-T21 PolarHBondContact O-N 2.99Å; T21-G33 PolarHBondContact N-O 3.13Å; T21-G33 PolarHBondContact O-N 3.48Å; T21-L35 HydrophobicContact CG2-CB 4.32Å; T21-W44 PolarHBondContact O-NE1 2.87Å; T21-F124 HydrophobicContact CG2-CB 3.78Å; T21-F124 HydrophobicContact CG2-CD1 4.24Å; T21-F124 HydrophobicContact CG2-CG 4.46Å; T21-M135 HydrophobicContact CG2-CE 4.3Å
22	T	96.1	Very high	92.7	Very high	21 Å²	21	57.5 Å²	57.5	13%	0.129	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.1	175.4	-61.5	0	0	0	0	110.5	R29 G31 V125	T22-R29 HydrophobicContact CG2-CG 3.7Å; T22-G31 WeakPolarHBondContact CA-O 3Å; T22-G31 WeakPolarHBondContact CG2-O 3.4Å; T22-V125 PolarHBondContact N-O 2.96Å; T22-V125 PolarHBondContact O-N 3.19Å
23	A	95.1	Very high	93.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.1	173.2	0	0	0	0	0	111.1	L30 G31 W44 F52 F124	A23-L30 HydrophobicContact CB-CB 4.41Å; A23-L30 HydrophobicContact CB-CD1 4.22Å; A23-L30 PolarHBondContact O-N 2.65Å; A23-G31 PolarHBondContact N-O 2.78Å; A23-G31 VanDerWaalsContact N-O 3.13Å; A23-W44 HydrophobicContact CB-CD2 3.57Å; A23-W44 VanDerWaalsContact CB-CE2 3.48Å; A23-W44 HydrophobicContact CB-CE3 4.01Å; A23-W44 HydrophobicContact CB-CG 3.97Å; A23-W44 HydrophobicContact CB-CH2 4.27Å; A23-W44 HydrophobicContact CB-CZ2 3.86Å; A23-W44 HydrophobicContact CB-CZ3 4.34Å; A23-F52 HydrophobicContact CB-CE1 4.42Å; A23-F124 HydrophobicContact CB-CD1 4.13Å; A23-F124 HydrophobicContact CB-CE1 4.09Å
24	V	94.6	Very high	93.6	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.4	172	-170.5	0	0	0	0	107.6	Q28 R29 I122 R123 V125	V24-Q28 CarbonylContact C-O 3.59Å; V24-Q28 WeakPolarHBondContact CA-O 3.49Å; V24-R29 HydrophobicContact CG2-CB 4.45Å; V24-R29 HydrophobicContact CG2-CG 4.13Å; V24-I122 CarbonylContact O-C 3.48Å; V24-I122 WeakPolarHBondContact O-CA 3.38Å; V24-R123 HydrophobicContact CB-CB 4.18Å; V24-R123 PolarHBondContact N-O 2.91Å; V24-R123 PolarHBondContact O-N 2.83Å; V24-V125 HydrophobicContact CG2-CG2 4.45Å
25	L	92.8	Very high	93.7	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.3	-179.8	-170.1	150	0	0	0	108.9	V2 G27 Q28 L30 L84 T120 E121 I122	V2-L25 HydrophobicContact CB-CD2 4.43Å; V2-L25 HydrophobicContact CG1-CB 4.49Å; V2-L25 HydrophobicContact CG1-CD1 3.81Å; V2-L25 HydrophobicContact CG1-CD2 3.97Å; V2-L25 HydrophobicContact CG1-CG 4.32Å; V2-L25 HydrophobicContact CG2-CB 4.5Å; V2-L25 HydrophobicContact CG2-CD2 3.61Å; L25-G27 PolarHBondContact O-N 2.83Å; L25-G27 VanDerWaalsContact O-N 3.13Å; L25-Q28 PolarHBondContact N-O 3.11Å; L25-Q28 WeakPolarHBondContact O-CA 3.48Å; L25-Q28 VanDerWaalsContact O-CB 3.3Å; L25-Q28 WeakPolarHBondContact O-CB 3.17Å; L25-Q28 PolarHBondContact O-N 2.8Å; L25-L30 HydrophobicContact CB-CD1 3.98Å; L25-L30 HydrophobicContact CB-CG 4.39Å; L25-L84 HydrophobicContact CD1-CB 4.43Å; L25-L84 HydrophobicContact CD1-CD1 4.19Å; L25-T120 HydrophobicContact CD1-CG2 4.35Å; L25-T120 HydrophobicContact CD2-CG2 3.92Å; L25-T120 HydrophobicContact CG-CG2 3.96Å; L25-E121 WeakPolarHBondContact CA-O 3.4Å; L25-I122 HydrophobicContact CD1-CD1 4.34Å; L25-I122 HydrophobicContact CD1-CG1 4.32Å; L25-I122 HydrophobicContact CG-CG1 4.33Å
26	D	90.7	Very high	93.8	Very high	89 Å²	89	43.7 Å²	43.7	48%	0.476	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	39.2	-175.4	-59.2	-36.5	0	0	0	113.5	Q28 E121	D26-Q28 PolarHBondContact O-N 3.21Å; D26-E121 PolarHBondContact N-O 2.79Å; D26-E121 PolarHBondContact OD1-N 3.08Å
27	G	88.8	Confident	93.9	Very high	53 Å²	53	42 Å²	42	55%	0.546	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	-9.9	-176.2	0	0	0	0	0	114.9	L25 R29	L25-G27 PolarHBondContact O-N 2.83Å; L25-G27 VanDerWaalsContact O-N 3.13Å; G27-R29 PolarHBondContact O-N 2.85Å
28	Q	91.1	Very high	93.9	Very high	105 Å²	105	36.8 Å²	36.8	49%	0.491	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	115.6	173.4	-167.6	178.8	-77.1	0	0	110.9	V24 L25 D26 L30	V24-Q28 CarbonylContact C-O 3.59Å; V24-Q28 WeakPolarHBondContact CA-O 3.49Å; L25-Q28 PolarHBondContact N-O 3.11Å; L25-Q28 WeakPolarHBondContact O-CA 3.48Å; L25-Q28 VanDerWaalsContact O-CB 3.3Å; L25-Q28 WeakPolarHBondContact O-CB 3.17Å; L25-Q28 PolarHBondContact O-N 2.8Å; D26-Q28 PolarHBondContact O-N 3.21Å; Q28-L30 PolarHBondContact O-N 2.63Å
29	R	92.1	Very high	93.8	Very high	177 Å²	177	38.5 Å²	38.5	67%	0.668	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	116.9	178	-163.7	168.7	100.5	159.8	7.9	110.6	T22 V24 G27	T22-R29 HydrophobicContact CG2-CG 3.7Å; V24-R29 HydrophobicContact CG2-CB 4.45Å; V24-R29 HydrophobicContact CG2-CG 4.13Å; G27-R29 PolarHBondContact O-N 2.85Å
30	L	90.1	Very high	93.5	Very high	34 Å²	34	40.3 Å²	40.3	18%	0.178	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-31.4	-176.9	-58.8	178.4	0	0	0	112.4	V2 L4 A23 L25 Q28 W44 F52	V2-L30 HydrophobicContact CB-CD2 4.06Å; V2-L30 HydrophobicContact CG1-CD1 4.35Å; V2-L30 HydrophobicContact CG1-CD2 4.02Å; V2-L30 HydrophobicContact CG2-CD2 4.26Å; L4-L30 HydrophobicContact CD2-CD1 4.34Å; A23-L30 HydrophobicContact CB-CB 4.41Å; A23-L30 HydrophobicContact CB-CD1 4.22Å; A23-L30 PolarHBondContact O-N 2.65Å; L25-L30 HydrophobicContact CB-CD1 3.98Å; L25-L30 HydrophobicContact CB-CG 4.39Å; Q28-L30 PolarHBondContact O-N 2.63Å; L30-W44 HydrophobicContact CB-CH2 3.96Å; L30-W44 HydrophobicContact CB-CZ3 4.05Å; L30-W44 HydrophobicContact CD1-CZ3 4.37Å; L30-F52 HydrophobicContact CD1-CD1 4.29Å; L30-F52 HydrophobicContact CD1-CE1 3.82Å
31	G	90.8	Very high	93.4	Very high	22 Å²	22	43.5 Å²	43.5	23%	0.227	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.6	-176.1	179.2	0	0	0	0	0	112.2	T22 A23 W44	T22-G31 WeakPolarHBondContact CA-O 3Å; T22-G31 WeakPolarHBondContact CG2-O 3.4Å; A23-G31 PolarHBondContact N-O 2.78Å; A23-G31 VanDerWaalsContact N-O 3.13Å; G31-W44 VanDerWaalsContact O-CZ2 3.27Å; G31-W44 WeakPolarHBondContact O-CZ2 3.28Å
32	C	94	Very high	93.3	Very high	72 Å²	72	43.6 Å²	43.6	49%	0.486	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.6	175.8	-173	0	0	0	0	109.3	A20	A20-C32 VanDerWaalsContact CA-SG 3.56Å
33	G	94.6	Very high	93.2	Very high	8 Å²	8	42.8 Å²	42.8	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	-160.7	-173	0	0	0	0	0	112.7	A20 T21 F45	A20-G33 PolarHBondContact N-O 2.84Å; T21-G33 PolarHBondContact N-O 3.13Å; T21-G33 PolarHBondContact O-N 3.48Å; G33-F45 CarbonylContact C-O 3.6Å; G33-F45 WeakPolarHBondContact CA-O 3.46Å
34	T	95.5	Very high	93.2	Very high	28 Å²	28	42.8 Å²	42.8	17%	0.172	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127	177.2	-54.7	0	0	0	0	110.1	E17 Q18 A19 Y36 W44 F45	E17-T34 HydrophobicContact CG-CG2 3.72Å; Q18-T34 WeakPolarHBondContact O-CA 3.26Å; A19-T34 HydrophobicContact CB-CG2 4.46Å; T34-Y36 HydrophobicContact CG2-CD2 4.08Å; T34-Y36 HydrophobicContact CG2-CE1 4.22Å; T34-Y36 HydrophobicContact CG2-CE2 3.42Å; T34-Y36 VanDerWaalsContact CG2-CE2 3.42Å; T34-Y36 VanDerWaalsContact CG2-CZ 3.47Å; T34-Y36 WeakPolarHBondContact CG2-OH 3.43Å; T34-W44 WeakPolarHBondContact O-CA 3.27Å; T34-F45 PolarHBondContact N-O 3.02Å; T34-F45 PolarHBondContact O-N 2.79Å
35	L	95.9	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.7	171.3	-176.8	71.5	0	0	0	109.6	E17 Q18 T21 V37 L42 S43 W44 F124 M135	E17-L35 WeakPolarHBondContact CA-O 3.17Å; Q18-L35 HydrophobicContact CB-CB 4.44Å; Q18-L35 PolarHBondContact N-O 2.9Å; Q18-L35 PolarHBondContact O-N 3.02Å; T21-L35 HydrophobicContact CG2-CB 4.32Å; L35-V37 HydrophobicContact CD2-CG2 4.36Å; L35-L42 HydrophobicContact CD1-CD1 3.89Å; L35-L42 HydrophobicContact CD1-CG 4.16Å; L35-L42 HydrophobicContact CD2-CD1 4.47Å; L35-L42 HydrophobicContact CG-CD1 4.3Å; L35-S43 CarbonylContact C-O 3.5Å; L35-W44 HydrophobicContact CD1-CB 4.17Å; L35-F124 HydrophobicContact CD1-CD1 3.87Å; L35-F124 HydrophobicContact CD1-CD2 4.4Å; L35-F124 HydrophobicContact CD1-CE1 3.62Å; L35-F124 HydrophobicContact CD1-CE2 4.17Å; L35-F124 HydrophobicContact CD1-CG 4.24Å; L35-F124 HydrophobicContact CD1-CZ 3.77Å; L35-F124 HydrophobicContact CD2-CG 4.29Å; L35-M135 HydrophobicContact CD2-CE 3.32Å
36	Y	95.4	Very high	93	Very high	31 Å²	31	45 Å²	45	12%	0.122	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.9	173.4	-64.9	-91.1	0	0	0	108.9	P9 P10 V14 E17 T34 S43 F45	P9-Y36 HydrophobicContact CB-CE1 4.44Å; P9-Y36 HydrophobicContact CB-CE2 4.12Å; P10-Y36 HydrophobicContact CG-CD1 4.42Å; P10-Y36 HydrophobicContact CG-CG 4.19Å; V14-Y36 HydrophobicContact CG1-CD1 4.39Å; E17-Y36 HydrophobicContact CB-CD1 4.2Å; E17-Y36 HydrophobicContact CB-CE1 4.2Å; E17-Y36 HydrophobicContact CG-CD1 3.94Å; E17-Y36 HydrophobicContact CG-CE1 3.52Å; E17-Y36 WeakPolarHBondContact OE1-CE1 3.4Å; E17-Y36 PolarHBondContact OE1-OH 2.96Å; T34-Y36 HydrophobicContact CG2-CD2 4.08Å; T34-Y36 HydrophobicContact CG2-CE1 4.22Å; T34-Y36 HydrophobicContact CG2-CE2 3.42Å; T34-Y36 VanDerWaalsContact CG2-CE2 3.42Å; T34-Y36 VanDerWaalsContact CG2-CZ 3.47Å; T34-Y36 WeakPolarHBondContact CG2-OH 3.43Å; Y36-S43 PolarHBondContact N-O 3.5Å; Y36-S43 PolarHBondContact O-N 2.71Å; Y36-F45 AromaticContact CD2-CD2 3.5Å; Y36-F45 HydrophobicContact CD2-CD2 3.5Å; Y36-F45 VanDerWaalsContact CD2-CD2 3.5Å; Y36-F45 AromaticContact CD2-CE2 3.66Å; Y36-F45 HydrophobicContact CD2-CE2 3.66Å; Y36-F45 AromaticContact CE2-CD2 3.58Å; Y36-F45 HydrophobicContact CE2-CD2 3.58Å; Y36-F45 HydrophobicContact CE2-CE2 4.05Å
37	V	96	Very high	92.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	103.8	168.9	-169.7	0	0	0	0	106.5	R15 H16 L35 L42 Y56 A138 M139	R15-V37 PolarHBondContact N-O 2.92Å; H16-V37 HydrophobicContact CB-CB 4.04Å; H16-V37 HydrophobicContact CB-CG2 4.14Å; H16-V37 PolarHBondContact N-O 3.31Å; H16-V37 VanDerWaalsContact N-O 3.08Å; H16-V37 PolarHBondContact O-N 2.78Å; L35-V37 HydrophobicContact CD2-CG2 4.36Å; V37-L42 HydrophobicContact CB-CD1 4.22Å; V37-L42 HydrophobicContact CG1-CD1 4.32Å; V37-L42 HydrophobicContact CG2-CD1 3.71Å; V37-Y56 WeakPolarHBondContact CG1-OH 3.32Å; V37-A138 HydrophobicContact CB-CB 4.28Å; V37-A138 HydrophobicContact CG1-CB 3.96Å; V37-M139 HydrophobicContact CG1-CG 3.83Å; V37-M139 HydrophobicContact CG2-CG 4.14Å
38	A	95.1	Very high	92.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	161.2	174.6	0	0	0	0	0	110.2	P10 G13 V14 T40 R41 Y56	P10-A38 HydrophobicContact CB-CB 4.11Å; P10-A38 HydrophobicContact CG-CB 4.11Å; G13-A38 CarbonylContact O-C 3.39Å; G13-A38 VanDerWaalsContact O-CA 3.26Å; G13-A38 WeakPolarHBondContact O-CA 2.94Å; V14-A38 HydrophobicContact CG2-CB 4.45Å; A38-T40 PolarHBondContact O-N 2.95Å; A38-R41 PolarHBondContact N-O 2.76Å; A38-Y56 WeakPolarHBondContact O-CE2 3.07Å; A38-Y56 PolarHBondContact O-OH 2.69Å
39	E	93.8	Very high	91.9	Very high	66 Å²	66	41.8 Å²	41.8	31%	0.308	24%	0.243	S	C	.	.	S	Bend	trans	-54.4	-38.9	179.5	-72.5	174.6	-145	0	0	112.7	G13 R15 Y56 L145 H146	G13-E39 PolarHBondContact O-N 3.25Å; R15-E39 HydrophobicContact CG-CG 4.36Å; R15-E39 VanDerWaalsContact CZ-CG 3.47Å; R15-E39 IonicContact CZ-OE1 3.39Å; R15-E39 IonicContact NH1-OE1 2.76Å; R15-E39 PolarHBondContact NH1-OE1 2.81Å; R15-E39 IonicContact NH2-OE1 2.79Å; R15-E39 PolarHBondContact NH2-OE1 3.37Å; R15-E39 IonicContact NH2-OE2 2.71Å; E39-Y56 WeakPolarHBondContact O-CE2 3.33Å; E39-L145 HydrophobicContact CB-CD1 4.35Å; E39-L145 HydrophobicContact CG-CD1 4.13Å; E39-H146 PolarHBondContact O-NE2 2.87Å
40	T	90.1	Very high	91.7	Very high	89 Å²	89	36.5 Å²	36.5	55%	0.546	23%	0.228	S	C	.	.	S	Bend	trans	-90.6	-33.3	-173	55	0	0	0	0	113.5	A38	A38-T40 PolarHBondContact O-N 2.95Å
41	R	92.4	Very high	91.7	Very high	110 Å²	110	34.9 Å²	34.9	42%	0.415	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	149.3	-171.4	-62.1	-179.3	-172.6	-106.1	-9.6	111.6	A38 L54 E55	A38-R41 PolarHBondContact N-O 2.76Å; R41-L54 CarbonylContact C-O 3.29Å; R41-L54 VanDerWaalsContact CA-O 3.23Å; R41-L54 WeakPolarHBondContact CA-O 3.49Å; R41-L54 VanDerWaalsContact CB-O 3.3Å; R41-L54 WeakPolarHBondContact CB-O 3.32Å; R41-E55 HydrophobicContact CG-CG 4.42Å; R41-E55 IonicContact CZ-OE1 3.43Å; R41-E55 VanDerWaalsContact NH1-CG 3.33Å; R41-E55 IonicContact NH1-OE1 3.62Å; R41-E55 PolarHBondContact NH1-OE1 3.09Å; R41-E55 IonicContact NH2-OE1 3.36Å; R41-E55 PolarHBondContact NH2-OE1 3.22Å
42	L	94.1	Very high	91.8	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.4	165.7	-175.9	71.8	0	0	0	108.8	L35 V37 S53 L54 I59 F124 M139	L35-L42 HydrophobicContact CD1-CD1 3.89Å; L35-L42 HydrophobicContact CD1-CG 4.16Å; L35-L42 HydrophobicContact CD2-CD1 4.47Å; L35-L42 HydrophobicContact CG-CD1 4.3Å; V37-L42 HydrophobicContact CB-CD1 4.22Å; V37-L42 HydrophobicContact CG1-CD1 4.32Å; V37-L42 HydrophobicContact CG2-CD1 3.71Å; L42-S53 CarbonylContact O-C 3.59Å; L42-S53 VanDerWaalsContact O-CA 3.28Å; L42-S53 WeakPolarHBondContact O-CA 3.36Å; L42-L54 HydrophobicContact CB-CB 4.37Å; L42-L54 HydrophobicContact CD2-CD1 4.05Å; L42-L54 PolarHBondContact N-O 2.68Å; L42-L54 PolarHBondContact O-N 2.89Å; L42-I59 HydrophobicContact CB-CD1 4.34Å; L42-I59 HydrophobicContact CD2-CD1 4.23Å; L42-F124 HydrophobicContact CD2-CE2 3.87Å; L42-F124 HydrophobicContact CD2-CZ 4.26Å; L42-M139 HydrophobicContact CD1-CG 4.14Å; L42-M139 HydrophobicContact CD1-SD 3.95Å; L42-M139 HydrophobicContact CD2-CE 3.74Å; L42-M139 HydrophobicContact CD2-SD 3.87Å
43	S	94	Very high	91.6	Very high	5 Å²	5	32.6 Å²	32.6	4%	0.035	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.3	-176.8	-55.9	0	0	0	0	112.5	L35 Y36 F52 S53	L35-S43 CarbonylContact C-O 3.5Å; Y36-S43 PolarHBondContact N-O 3.5Å; Y36-S43 PolarHBondContact O-N 2.71Å; S43-F52 WeakPolarHBondContact CA-O 3.26Å; S43-S53 WeakPolarHBondContact CB-OG 3.38Å; S43-S53 WeakPolarHBondContact OG-CB 3.48Å; S43-S53 PolarHBondContact OG-OG 2.75Å
44	W	95.3	Very high	91.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.4	174.5	178.6	90.5	0	0	0	111.1	L4 T21 A23 L30 G31 T34 L35 D46 G51 F52 F124	L4-W44 HydrophobicContact CD2-CZ3 4.18Å; T21-W44 PolarHBondContact O-NE1 2.87Å; A23-W44 HydrophobicContact CB-CD2 3.57Å; A23-W44 VanDerWaalsContact CB-CE2 3.48Å; A23-W44 HydrophobicContact CB-CE3 4.01Å; A23-W44 HydrophobicContact CB-CG 3.97Å; A23-W44 HydrophobicContact CB-CH2 4.27Å; A23-W44 HydrophobicContact CB-CZ2 3.86Å; A23-W44 HydrophobicContact CB-CZ3 4.34Å; L30-W44 HydrophobicContact CB-CH2 3.96Å; L30-W44 HydrophobicContact CB-CZ3 4.05Å; L30-W44 HydrophobicContact CD1-CZ3 4.37Å; G31-W44 VanDerWaalsContact O-CZ2 3.27Å; G31-W44 WeakPolarHBondContact O-CZ2 3.28Å; T34-W44 WeakPolarHBondContact O-CA 3.27Å; L35-W44 HydrophobicContact CD1-CB 4.17Å; W44-D46 HydrophobicContact CH2-CB 3.64Å; W44-D46 HydrophobicContact CZ2-CB 4.49Å; W44-D46 HydrophobicContact CZ3-CB 3.93Å; W44-G51 CarbonylContact O-C 3.51Å; W44-G51 WeakPolarHBondContact O-CA 3.46Å; W44-F52 HydrophobicContact CB-CE1 4.04Å; W44-F52 HydrophobicContact CB-CZ 4.09Å; W44-F52 HydrophobicContact CD2-CE1 4.32Å; W44-F52 HydrophobicContact CE3-CD1 4.15Å; W44-F52 AromaticContact CE3-CE1 3.83Å; W44-F52 HydrophobicContact CE3-CE1 3.83Å; W44-F52 HydrophobicContact CG-CE1 4.45Å; W44-F52 PolarHBondContact N-O 3.41Å; W44-F52 PolarHBondContact O-N 3.14Å; W44-F124 HydrophobicContact CB-CE1 3.81Å; W44-F124 HydrophobicContact CG-CE1 4.02Å
45	F	93.6	Very high	91.3	Very high	7 Å²	7	35.3 Å²	35.3	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138.8	-178.2	-57.9	-88.8	0	0	0	111.9	I7 P9 G33 T34 Y36 G47 L50	I7-F45 HydrophobicContact CB-CE1 3.99Å; I7-F45 HydrophobicContact CG2-CE1 4.49Å; I7-F45 WeakPolarHBondContact O-CE1 3.38Å; P9-F45 HydrophobicContact CB-CE2 4.13Å; P9-F45 HydrophobicContact CB-CZ 4.43Å; P9-F45 HydrophobicContact CG-CD2 4.4Å; P9-F45 HydrophobicContact CG-CE2 4.3Å; P9-F45 HydrophobicContact CG-CZ 4.42Å; G33-F45 CarbonylContact C-O 3.6Å; G33-F45 WeakPolarHBondContact CA-O 3.46Å; T34-F45 PolarHBondContact N-O 3.02Å; T34-F45 PolarHBondContact O-N 2.79Å; Y36-F45 AromaticContact CD2-CD2 3.5Å; Y36-F45 HydrophobicContact CD2-CD2 3.5Å; Y36-F45 VanDerWaalsContact CD2-CD2 3.5Å; Y36-F45 AromaticContact CD2-CE2 3.66Å; Y36-F45 HydrophobicContact CD2-CE2 3.66Å; Y36-F45 AromaticContact CE2-CD2 3.58Å; Y36-F45 HydrophobicContact CE2-CD2 3.58Å; Y36-F45 HydrophobicContact CE2-CE2 4.05Å; F45-G47 PolarHBondContact O-N 3.18Å; F45-L50 CarbonylContact C-O 3.59Å; F45-L50 WeakPolarHBondContact CA-O 3.23Å
46	D	90	Very high	91.2	Very high	47 Å²	47	35.3 Å²	35.3	25%	0.251	21%	0.208	S	C	.	.			trans	-78.9	3.6	-178.2	75.3	-9.3	0	0	0	114.8	W44 S48 L50	W44-D46 HydrophobicContact CH2-CB 3.64Å; W44-D46 HydrophobicContact CZ2-CB 4.49Å; W44-D46 HydrophobicContact CZ3-CB 3.93Å; D46-S48 VanDerWaalsContact C-N 3.28Å; D46-S48 PolarHBondContact O-N 2.93Å; D46-S48 WeakPolarHBondContact OD1-CA 3.37Å; D46-S48 VanDerWaalsContact OD1-CB 3.31Å; D46-S48 WeakPolarHBondContact OD1-CB 3.28Å; D46-S48 PolarHBondContact OD1-N 2.94Å; D46-S48 PolarHBondContact OD1-OG 2.74Å; D46-S48 PolarHBondContact OD2-OG 2.89Å; D46-L50 PolarHBondContact N-O 3.47Å; D46-L50 PolarHBondContact OD1-N 3.29Å; D46-L50 VanDerWaalsContact OD1-O 3.11Å
47	G	83.6	Confident	90.9	Very high	72 Å²	72	37.8 Å²	37.8	74%	0.742	23%	0.228	S	C	*	.	S	Bend	trans	83.8	-11.9	-176.2	0	0	0	0	0	115.1	F45	F45-G47 PolarHBondContact O-N 3.18Å
48	S	84.6	Confident	90.6	Very high	85 Å²	85	39.6 Å²	39.6	59%	0.594	24%	0.24	S	C	*	.	S	Bend	trans	-87.8	-7.4	170.4	79.8	0	0	0	0	113.2	D46	D46-S48 VanDerWaalsContact C-N 3.28Å; D46-S48 PolarHBondContact O-N 2.93Å; D46-S48 WeakPolarHBondContact OD1-CA 3.37Å; D46-S48 VanDerWaalsContact OD1-CB 3.31Å; D46-S48 WeakPolarHBondContact OD1-CB 3.28Å; D46-S48 PolarHBondContact OD1-N 2.94Å; D46-S48 PolarHBondContact OD1-OG 2.74Å; D46-S48 PolarHBondContact OD2-OG 2.89Å
49	G	78.9	Confident	90.5	Very high	24 Å²	24	39.9 Å²	39.9	25%	0.247	24%	0.242	C	C	.	.	S	Bend	trans	97.3	-2.5	-173.8	0	0	0	0	0	113.2	N6	N6-G49 PolarHBondContact OD1-O 2.89Å
50	L	87.7	Confident	90.4	Very high	66 Å²	66	38.6 Å²	38.6	35%	0.346	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	135.4	173.5	-69.8	172.3	0	0	0	109.9	L4 K5 N6 F45 D46	L4-L50 HydrophobicContact CB-CB 3.98Å; L4-L50 HydrophobicContact CD1-CB 4.36Å; K5-L50 WeakPolarHBondContact O-CA 3.3Å; N6-L50 HydrophobicContact CB-CD2 4.28Å; F45-L50 CarbonylContact C-O 3.59Å; F45-L50 WeakPolarHBondContact CA-O 3.23Å; D46-L50 PolarHBondContact N-O 3.47Å; D46-L50 PolarHBondContact OD1-N 3.29Å; D46-L50 VanDerWaalsContact OD1-O 3.11Å
51	G	90.9	Very high	90.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-175.3	-174.7	0	0	0	0	0	113.2	L4 K5 W44	L4-G51 CarbonylContact C-O 3.55Å; K5-G51 PolarHBondContact N-O 3.38Å; K5-G51 PolarHBondContact O-N 3.41Å; W44-G51 CarbonylContact O-C 3.51Å; W44-G51 WeakPolarHBondContact O-CA 3.46Å
52	F	91.4	Very high	90.7	Very high	12 Å²	12	34 Å²	34	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.6	169.5	65.7	-89	0	0	0	109.5	L4 A23 L30 S43 W44 L54 I122 F124	L4-F52 HydrophobicContact CD2-CD1 4.11Å; A23-F52 HydrophobicContact CB-CE1 4.42Å; L30-F52 HydrophobicContact CD1-CD1 4.29Å; L30-F52 HydrophobicContact CD1-CE1 3.82Å; S43-F52 WeakPolarHBondContact CA-O 3.26Å; W44-F52 HydrophobicContact CB-CE1 4.04Å; W44-F52 HydrophobicContact CB-CZ 4.09Å; W44-F52 HydrophobicContact CD2-CE1 4.32Å; W44-F52 HydrophobicContact CE3-CD1 4.15Å; W44-F52 AromaticContact CE3-CE1 3.83Å; W44-F52 HydrophobicContact CE3-CE1 3.83Å; W44-F52 HydrophobicContact CG-CE1 4.45Å; W44-F52 PolarHBondContact N-O 3.41Å; W44-F52 PolarHBondContact O-N 3.14Å; F52-L54 HydrophobicContact CD2-CD2 3.86Å; F52-L54 HydrophobicContact CD2-CG 4.08Å; F52-L54 HydrophobicContact CE2-CD1 4.11Å; F52-L54 HydrophobicContact CE2-CD2 4.09Å; F52-L54 HydrophobicContact CE2-CG 4.04Å; F52-I122 HydrophobicContact CE2-CD1 3.73Å; F52-I122 HydrophobicContact CZ-CD1 4.14Å; F52-I122 HydrophobicContact CZ-CG2 4.05Å; F52-F124 HydrophobicContact CE2-CZ 4.19Å; F52-F124 AromaticContact CZ-CE1 3.94Å; F52-F124 HydrophobicContact CZ-CE1 3.94Å; F52-F124 AromaticContact CZ-CZ 3.89Å; F52-F124 HydrophobicContact CZ-CZ 3.89Å
53	S	91.8	Very high	90.8	Very high	33 Å²	33	35.8 Å²	35.8	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.6	178.4	-61	0	0	0	0	109.1	L42 S43	L42-S53 CarbonylContact O-C 3.59Å; L42-S53 VanDerWaalsContact O-CA 3.28Å; L42-S53 WeakPolarHBondContact O-CA 3.36Å; S43-S53 WeakPolarHBondContact CB-OG 3.38Å; S43-S53 WeakPolarHBondContact OG-CB 3.48Å; S43-S53 PolarHBondContact OG-OG 2.75Å
54	L	91.8	Very high	91	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.9	178.2	-48.4	174.6	0	0	0	108.5	R41 L42 F52 I59 V78 V80 L84 I122	R41-L54 CarbonylContact C-O 3.29Å; R41-L54 VanDerWaalsContact CA-O 3.23Å; R41-L54 WeakPolarHBondContact CA-O 3.49Å; R41-L54 VanDerWaalsContact CB-O 3.3Å; R41-L54 WeakPolarHBondContact CB-O 3.32Å; L42-L54 HydrophobicContact CB-CB 4.37Å; L42-L54 HydrophobicContact CD2-CD1 4.05Å; L42-L54 PolarHBondContact N-O 2.68Å; L42-L54 PolarHBondContact O-N 2.89Å; F52-L54 HydrophobicContact CD2-CD2 3.86Å; F52-L54 HydrophobicContact CD2-CG 4.08Å; F52-L54 HydrophobicContact CE2-CD1 4.11Å; F52-L54 HydrophobicContact CE2-CD2 4.09Å; F52-L54 HydrophobicContact CE2-CG 4.04Å; L54-I59 HydrophobicContact CB-CD1 4.42Å; L54-I59 HydrophobicContact CB-CG1 4.42Å; L54-V78 HydrophobicContact CD1-CG1 4.42Å; L54-V80 HydrophobicContact CD1-CG2 3.84Å; L54-V80 HydrophobicContact CD2-CG2 4.21Å; L54-L84 HydrophobicContact CD2-CD1 3.68Å; L54-L84 HydrophobicContact CD2-CD2 3.54Å; L54-L84 HydrophobicContact CD2-CG 4.22Å; L54-I122 HydrophobicContact CD1-CD1 3.58Å; L54-I122 HydrophobicContact CD2-CD1 4.12Å; L54-I122 HydrophobicContact CG-CD1 4.42Å
55	E	91.2	Very high	91	Very high	89 Å²	89	39.1 Å²	39.1	42%	0.416	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	145.2	170.5	-62.5	-178.8	171.2	0	0	108.4	R41 S58	R41-E55 HydrophobicContact CG-CG 4.42Å; R41-E55 IonicContact CZ-OE1 3.43Å; R41-E55 VanDerWaalsContact NH1-CG 3.33Å; R41-E55 IonicContact NH1-OE1 3.62Å; R41-E55 PolarHBondContact NH1-OE1 3.09Å; R41-E55 IonicContact NH2-OE1 3.36Å; R41-E55 PolarHBondContact NH2-OE1 3.22Å; E55-S58 PolarHBondContact O-N 3.48Å; E55-S58 VanDerWaalsContact O-N 3.16Å; E55-S58 PolarHBondContact O-OG 3.14Å
56	Y	92.9	Very high	91.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-60.2	-40.1	-179.5	-73.8	-80	0	0	0	113.8	V37 A38 E39 S58 I59 C142 Q143 H146	V37-Y56 WeakPolarHBondContact CG1-OH 3.32Å; A38-Y56 WeakPolarHBondContact O-CE2 3.07Å; A38-Y56 PolarHBondContact O-OH 2.69Å; E39-Y56 WeakPolarHBondContact O-CE2 3.33Å; Y56-S58 PolarHBondContact O-N 2.73Å; Y56-I59 HydrophobicContact CD1-CD1 4.12Å; Y56-I59 HydrophobicContact CE1-CD1 4.46Å; Y56-I59 WeakPolarHBondContact O-CB 3.13Å; Y56-I59 PolarHBondContact O-N 3.11Å; Y56-C142 HydrophobicContact CD1-CB 4.2Å; Y56-C142 HydrophobicContact CD2-CB 4.33Å; Y56-C142 HydrophobicContact CE1-CB 3.44Å; Y56-C142 VanDerWaalsContact CE1-CB 3.44Å; Y56-C142 HydrophobicContact CE2-CB 3.59Å; Y56-C142 WeakPolarHBondContact OH-CB 3.5Å; Y56-C142 PolarHBondContact OH-SG 3.23Å; Y56-Q143 HydrophobicContact CD1-CB 4.35Å; Y56-Q143 PolarHBondContact O-NE2 3.45Å; Y56-H146 AromaticContact CD2-CD2 3.53Å; Y56-H146 AromaticContact CD2-NE2 3.56Å; Y56-H146 AromaticContact CG-CD2 3.78Å
57	P	90.8	Very high	91.2	Very high	84 Å²	84	46.3 Å²	46.3	55%	0.545	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-58.9	-26.8	175.9	-27.4	36.4	0	0	0	114.3	I59 H146	P57-I59 VanDerWaalsContact C-N 3.33Å; P57-H146 HydrophobicContact CG-CB 4.19Å
58	S	89.8	Confident	91.5	Very high	37 Å²	37	47.3 Å²	47.3	26%	0.259	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-82.6	-11.2	177.1	73.6	0	0	0	0	113.4	E55 Y56 G60 V80 N81	E55-S58 PolarHBondContact O-N 3.48Å; E55-S58 VanDerWaalsContact O-N 3.16Å; E55-S58 PolarHBondContact O-OG 3.14Å; Y56-S58 PolarHBondContact O-N 2.73Å; S58-G60 PolarHBondContact O-N 3.04Å; S58-V80 CarbonylContact O-C 3.54Å; S58-V80 VanDerWaalsContact O-CA 3.31Å; S58-V80 WeakPolarHBondContact O-CA 3.37Å; S58-V80 WeakPolarHBondContact O-CG1 3.43Å; S58-N81 PolarHBondContact O-N 3.46Å
59	I	92.9	Very high	91.9	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	105.3	176.6	-61.6	172	0	0	0	108.5	L42 L54 Y56 P57 V78 M79 M139 Q143	L42-I59 HydrophobicContact CB-CD1 4.34Å; L42-I59 HydrophobicContact CD2-CD1 4.23Å; L54-I59 HydrophobicContact CB-CD1 4.42Å; L54-I59 HydrophobicContact CB-CG1 4.42Å; Y56-I59 HydrophobicContact CD1-CD1 4.12Å; Y56-I59 HydrophobicContact CE1-CD1 4.46Å; Y56-I59 WeakPolarHBondContact O-CB 3.13Å; Y56-I59 PolarHBondContact O-N 3.11Å; P57-I59 VanDerWaalsContact C-N 3.33Å; I59-V78 HydrophobicContact CD1-CG1 4.43Å; I59-V78 HydrophobicContact CG1-CG1 4.21Å; I59-V78 HydrophobicContact CG2-CG1 3.77Å; I59-M79 CarbonylContact C-O 3.6Å; I59-M139 HydrophobicContact CD1-CE 4.04Å; I59-Q143 PolarHBondContact O-NE2 2.92Å
60	G	90.9	Very high	92.4	Very high	40 Å²	40	50.9 Å²	50.9	41%	0.412	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	-42.2	177.3	0	0	0	0	0	112.6	S58 M79	S58-G60 PolarHBondContact O-N 3.04Å; G60-M79 PolarHBondContact N-O 3.01Å
61	L	93.7	Very high	92.5	Very high	72 Å²	72	50.5 Å²	50.5	38%	0.377	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	158.4	170.1	71.2	85.5	0	0	0	112.8	Y77 V78 M79	L61-Y77 HydrophobicContact CD1-CD1 3.85Å; L61-Y77 HydrophobicContact CD1-CE1 3.89Å; L61-V78 WeakPolarHBondContact O-CA 3.31Å; L61-M79 HydrophobicContact CD1-CB 4.35Å; L61-M79 HydrophobicContact CD2-CE 3.65Å; L61-M79 HydrophobicContact CD2-SD 4.3Å; L61-M79 HydrophobicContact CG-CB 3.89Å; L61-M79 HydrophobicContact CG-CE 4.08Å; L61-M79 HydrophobicContact CG-SD 4.4Å; L61-M79 PolarHBondContact N-O 3.31Å; L61-M79 PolarHBondContact O-N 2.76Å
62	H	95.7	Very high	92.5	Very high	30 Å²	30	55.6 Å²	55.6	14%	0.139	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.9	168.7	61	-86.8	0	0	0	110.8	Y77 V78 F136 M139 C140 Q143	H62-Y77 CarbonylContact C-O 3.49Å; H62-Y77 VanDerWaalsContact CA-O 3.23Å; H62-Y77 WeakPolarHBondContact CA-O 3.32Å; H62-V78 HydrophobicContact CB-CG2 4.11Å; H62-F136 AromaticContact CD2-CD2 3.63Å; H62-F136 AromaticContact CD2-CE2 3.53Å; H62-F136 AromaticContact NE2-CE2 3.96Å; H62-M139 HydrophobicContact CB-CE 3.65Å; H62-C140 PolarHBondContact NE2-SG 2.86Å; H62-Q143 PolarHBondContact CE1-OE1 2.98Å; H62-Q143 PolarHBondContact ND1-OE1 3.25Å; H62-Q143 VanDerWaalsContact ND1-OE1 3.14Å
63	A	96.4	Very high	92.6	Very high	39 Å²	39	59.3 Å²	59.3	32%	0.322	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	150	-177	0	0	0	0	0	112.3	Y77	A63-Y77 PolarHBondContact N-O 3.35Å; A63-Y77 PolarHBondContact O-N 2.9Å
64	I	97.2	Very high	92.8	Very high	41 Å²	41	59.4 Å²	59.4	21%	0.21	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121.5	169.4	-55.3	176.9	0	0	0	108.9	R66 L76 L132 F136	I64-R66 HydrophobicContact CG2-CG 3.88Å; I64-L76 HydrophobicContact CG1-CD1 4.2Å; I64-L132 HydrophobicContact CD1-CB 4.36Å; I64-L132 HydrophobicContact CG2-CB 4.26Å; I64-L132 HydrophobicContact CG2-CD1 4.22Å; I64-F136 HydrophobicContact CD1-CB 3.62Å; I64-F136 HydrophobicContact CD1-CD1 4.35Å; I64-F136 HydrophobicContact CD1-CD2 4.46Å; I64-F136 HydrophobicContact CD1-CG 3.9Å; I64-F136 HydrophobicContact CG1-CB 3.72Å; I64-F136 HydrophobicContact CG1-CD2 3.92Å; I64-F136 HydrophobicContact CG1-CG 3.85Å
65	S	95.4	Very high	93.1	Very high	33 Å²	33	59.4 Å²	59.4	23%	0.231	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.6	171.1	-176.5	0	0	0	0	110.4	E74 H75	S65-E74 WeakPolarHBondContact O-CA 3.37Å; S65-H75 VanDerWaalsContact CB-CE1 3.5Å; S65-H75 WeakPolarHBondContact CB-CE1 3.35Å; S65-H75 PolarHBondContact N-O 3.03Å; S65-H75 PolarHBondContact O-N 3.44Å
66	R	95.1	Very high	93.3	Very high	126 Å²	126	55.1 Å²	55.1	48%	0.475	33%	0.328	S	S	.	.			trans	-111	0.3	177.2	-56.7	-179.1	-174.2	-108	8	113.3	I64 V68 E74 E133	I64-R66 HydrophobicContact CG2-CG 3.88Å; R66-V68 PolarHBondContact O-N 2.83Å; R66-V68 VanDerWaalsContact O-N 3.11Å; R66-E74 HydrophobicContact CB-CG 4.24Å; R66-E74 HydrophobicContact CG-CG 4.45Å; R66-E74 IonicContact NH1-OE2 3.51Å; R66-E74 PolarHBondContact NH1-OE2 2.95Å; R66-E133 IonicContact NH2-OE2 2.95Å; R66-E133 PolarHBondContact NH2-OE2 3.34Å
67	D	92.3	Very high	93.5	Very high	79 Å²	79	56.9 Å²	56.9	42%	0.422	34%	0.335	S	S	.	.			trans	-78.3	98.6	-176.2	-177.6	9.2	0	0	0	111.2	S69 A70 Y71	D67-S69 VanDerWaalsContact CG-OG 3.25Å; D67-S69 PolarHBondContact O-N 2.86Å; D67-S69 VanDerWaalsContact OD1-CB 3.32Å; D67-S69 WeakPolarHBondContact OD1-CB 3.31Å; D67-S69 PolarHBondContact OD1-N 2.76Å; D67-S69 PolarHBondContact OD1-OG 2.88Å; D67-S69 PolarHBondContact OD2-OG 3.16Å; D67-A70 HydrophobicContact CB-CB 4.23Å; D67-A70 PolarHBondContact O-N 2.78Å; D67-A70 WeakPolarHBondContact OD2-CB 3.34Å; D67-Y71 PolarHBondContact O-N 3.42Å
68	V	90.5	Very high	93.8	Very high	94 Å²	94	52.9 Å²	52.9	57%	0.57	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-15	177.9	-64.9	0	0	0	0	113.9	R66 Y71	R66-V68 PolarHBondContact O-N 2.83Å; R66-V68 VanDerWaalsContact O-N 3.11Å; V68-Y71 VanDerWaalsContact CA-O 3.26Å; V68-Y71 WeakPolarHBondContact CA-O 3.4Å
69	S	91.9	Very high	94	Very high	105 Å²	105	53 Å²	53	73%	0.734	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-33.1	175.2	76	0	0	0	0	112.1	D67	D67-S69 VanDerWaalsContact CG-OG 3.25Å; D67-S69 PolarHBondContact O-N 2.86Å; D67-S69 VanDerWaalsContact OD1-CB 3.32Å; D67-S69 WeakPolarHBondContact OD1-CB 3.31Å; D67-S69 PolarHBondContact OD1-N 2.76Å; D67-S69 PolarHBondContact OD1-OG 2.88Å; D67-S69 PolarHBondContact OD2-OG 3.16Å
70	A	89.4	Confident	94	Very high	78 Å²	78	53 Å²	53	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-39.7	175.3	0	0	0	0	0	112.6	D67	D67-A70 HydrophobicContact CB-CB 4.23Å; D67-A70 PolarHBondContact O-N 2.78Å; D67-A70 WeakPolarHBondContact OD2-CB 3.34Å
71	Y	90.7	Very high	93.9	Very high	59 Å²	59	55.4 Å²	55.4	23%	0.231	31%	0.31	C	S	.	.	S	Bend	trans	-145.2	132.6	177	-170.1	-91.9	0	0	0	111.1	D67 V68 Q73 H75 V125	D67-Y71 PolarHBondContact O-N 3.42Å; V68-Y71 VanDerWaalsContact CA-O 3.26Å; V68-Y71 WeakPolarHBondContact CA-O 3.4Å; Y71-Q73 HydrophobicContact CD1-CB 4.35Å; Y71-Q73 VanDerWaalsContact CD1-O 3.29Å; Y71-Q73 WeakPolarHBondContact CD1-O 3.23Å; Y71-Q73 HydrophobicContact CE1-CB 4.14Å; Y71-Q73 PolarHBondContact O-N 3.45Å; Y71-H75 AromaticContact CD1-CE1 3.58Å; Y71-H75 AromaticContact CD1-ND1 3.42Å; Y71-H75 WeakPolarHBondContact CD1-ND1 3.39Å; Y71-H75 AromaticContact CG-CE1 3.65Å; Y71-H75 AromaticContact CG-ND1 3.99Å; Y71-V125 HydrophobicContact CE1-CG2 4.36Å
72	P	91.6	Very high	93.4	Very high	106 Å²	106	52.9 Å²	52.9	69%	0.688	30%	0.301	S	S	*	.	S	Bend	trans	-60.6	-13.1	-167.6	-25.8	33.9	0	0	0	117.3
73	Q	93.4	Very high	92.3	Very high	91 Å²	91	55.4 Å²	55.4	43%	0.425	31%	0.312	S	S	.	.	S	Bend	trans	-134.1	141.8	-173.9	-59.4	-178.2	-1.2	0	0	111.1	Y71 H75 V125	Y71-Q73 HydrophobicContact CD1-CB 4.35Å; Y71-Q73 VanDerWaalsContact CD1-O 3.29Å; Y71-Q73 WeakPolarHBondContact CD1-O 3.23Å; Y71-Q73 HydrophobicContact CE1-CB 4.14Å; Y71-Q73 PolarHBondContact O-N 3.45Å; Q73-H75 PolarHBondContact O-N 3.5Å; Q73-H75 PolarHBondContact O-ND1 3.26Å; Q73-V125 HydrophobicContact CB-CG1 3.6Å; Q73-V125 HydrophobicContact CG-CG1 4.4Å
74	E	96	Very high	91	Very high	34 Å²	34	56 Å²	56	16%	0.159	31%	0.309	C	S	.	.			trans	-67.8	131.2	173.5	-58.3	174.5	-126.9	0	0	109.2	S65 R66 K129 L132	S65-E74 WeakPolarHBondContact O-CA 3.37Å; R66-E74 HydrophobicContact CB-CG 4.24Å; R66-E74 HydrophobicContact CG-CG 4.45Å; R66-E74 IonicContact NH1-OE2 3.51Å; R66-E74 PolarHBondContact NH1-OE2 2.95Å; E74-K129 WeakPolarHBondContact OE1-CD 3.23Å; E74-K129 WeakPolarHBondContact OE1-CE 3.46Å; E74-K129 IonicContact OE1-NZ 3.87Å; E74-K129 PolarHBondContact OE1-NZ 3.46Å; E74-L132 HydrophobicContact CB-CD1 3.7Å
75	H	96.6	Very high	88.9	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.019	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.6	-170.8	63.1	-81.4	0	0	0	112.1	S65 Y71 Q73 F124 V125	S65-H75 VanDerWaalsContact CB-CE1 3.5Å; S65-H75 WeakPolarHBondContact CB-CE1 3.35Å; S65-H75 PolarHBondContact N-O 3.03Å; S65-H75 PolarHBondContact O-N 3.44Å; Y71-H75 AromaticContact CD1-CE1 3.58Å; Y71-H75 AromaticContact CD1-ND1 3.42Å; Y71-H75 WeakPolarHBondContact CD1-ND1 3.39Å; Y71-H75 AromaticContact CG-CE1 3.65Å; Y71-H75 AromaticContact CG-ND1 3.99Å; Q73-H75 PolarHBondContact O-N 3.5Å; Q73-H75 PolarHBondContact O-ND1 3.26Å; H75-F124 WeakPolarHBondContact CA-O 3.29Å; H75-F124 WeakPolarHBondContact CB-O 3.48Å; H75-V125 HydrophobicContact CB-CB 4.37Å; H75-V125 HydrophobicContact CB-CG1 4.49Å; H75-V125 HydrophobicContact CB-CG2 3.84Å
76	L	97.1	Very high	86.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	114.5	166.5	-175.9	69.1	0	0	0	107.7	I64 V78 R123 F124 L132 M135 F136 M139	I64-L76 HydrophobicContact CG1-CD1 4.2Å; L76-V78 HydrophobicContact CG-CG2 4.39Å; L76-R123 WeakPolarHBondContact O-CA 3.42Å; L76-F124 HydrophobicContact CB-CB 4.27Å; L76-F124 PolarHBondContact N-O 2.76Å; L76-F124 PolarHBondContact O-N 2.82Å; L76-L132 HydrophobicContact CB-CD2 4.09Å; L76-M135 HydrophobicContact CB-CE 4.41Å; L76-M135 HydrophobicContact CD2-CB 4.07Å; L76-M135 HydrophobicContact CD2-CE 4.1Å; L76-F136 HydrophobicContact CD1-CB 4.17Å; L76-F136 HydrophobicContact CD1-CD2 4.03Å; L76-M139 HydrophobicContact CD2-SD 3.54Å; L76-M139 VanDerWaalsContact CD2-SD 3.54Å; L76-M139 HydrophobicContact CG-SD 4.46Å
77	Y	96.8	Very high	84.4	Confident	37 Å²	37	55.6 Å²	55.6	15%	0.145	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	135.3	174.8	178.8	-95.3	0	0	0	109.3	L61 H62 A63 M79 E121 R123	L61-Y77 HydrophobicContact CD1-CD1 3.85Å; L61-Y77 HydrophobicContact CD1-CE1 3.89Å; H62-Y77 CarbonylContact C-O 3.49Å; H62-Y77 VanDerWaalsContact CA-O 3.23Å; H62-Y77 WeakPolarHBondContact CA-O 3.32Å; A63-Y77 PolarHBondContact N-O 3.35Å; A63-Y77 PolarHBondContact O-N 2.9Å; Y77-M79 HydrophobicContact CE1-CB 4.04Å; Y77-E121 HydrophobicContact CE2-CB 4.19Å; Y77-E121 HydrophobicContact CE2-CG 4.23Å; Y77-E121 WeakPolarHBondContact CE2-OE1 3.35Å; Y77-E121 WeakPolarHBondContact OH-CG 3.44Å; Y77-E121 PolarHBondContact OH-OE1 3.05Å; Y77-R123 HydrophobicContact CD2-CG 4.06Å
78	V	96.2	Very high	82	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.3	177.6	-178.6	0	0	0	0	107.7	L54 I59 L61 H62 L76 V80 I122 F124 M139	L54-V78 HydrophobicContact CD1-CG1 4.42Å; I59-V78 HydrophobicContact CD1-CG1 4.43Å; I59-V78 HydrophobicContact CG1-CG1 4.21Å; I59-V78 HydrophobicContact CG2-CG1 3.77Å; L61-V78 WeakPolarHBondContact O-CA 3.31Å; H62-V78 HydrophobicContact CB-CG2 4.11Å; L76-V78 HydrophobicContact CG-CG2 4.39Å; V78-V80 HydrophobicContact CG1-CG2 4.24Å; V78-I122 HydrophobicContact CB-CB 4.34Å; V78-I122 PolarHBondContact N-O 2.85Å; V78-I122 PolarHBondContact O-N 2.9Å; V78-F124 HydrophobicContact CB-CE2 4.4Å; V78-F124 HydrophobicContact CG2-CD2 3.99Å; V78-F124 HydrophobicContact CG2-CE2 3.87Å; V78-M139 HydrophobicContact CG2-CE 3.96Å; V78-M139 HydrophobicContact CG2-SD 4.36Å
79	M	94.5	Very high	80	Confident	40 Å²	40	59.6 Å²	59.6	20%	0.197	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.9	172.7	-173.1	-163.6	-69.6	0	0	108.1	I59 G60 L61 Y77 I119	I59-M79 CarbonylContact C-O 3.6Å; G60-M79 PolarHBondContact N-O 3.01Å; L61-M79 HydrophobicContact CD1-CB 4.35Å; L61-M79 HydrophobicContact CD2-CE 3.65Å; L61-M79 HydrophobicContact CD2-SD 4.3Å; L61-M79 HydrophobicContact CG-CB 3.89Å; L61-M79 HydrophobicContact CG-CE 4.08Å; L61-M79 HydrophobicContact CG-SD 4.4Å; L61-M79 PolarHBondContact N-O 3.31Å; L61-M79 PolarHBondContact O-N 2.76Å; Y77-M79 HydrophobicContact CE1-CB 4.04Å; M79-I119 HydrophobicContact CG-CG2 3.21Å; M79-I119 HydrophobicContact SD-CD1 4.08Å; M79-I119 HydrophobicContact SD-CG1 4.48Å; M79-I119 HydrophobicContact SD-CG2 3.89Å
80	V	92.6	Very high	77.6	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.5	177.4	-176.1	0	0	0	0	108.7	L54 S58 V78 L84 I119 T120 I122	L54-V80 HydrophobicContact CD1-CG2 3.84Å; L54-V80 HydrophobicContact CD2-CG2 4.21Å; S58-V80 CarbonylContact O-C 3.54Å; S58-V80 VanDerWaalsContact O-CA 3.31Å; S58-V80 WeakPolarHBondContact O-CA 3.37Å; S58-V80 WeakPolarHBondContact O-CG1 3.43Å; V78-V80 HydrophobicContact CG1-CG2 4.24Å; V80-L84 HydrophobicContact CB-CD1 4.28Å; V80-L84 HydrophobicContact CG1-CD1 4.29Å; V80-L84 HydrophobicContact CG2-CD1 4.17Å; V80-I119 WeakPolarHBondContact O-CA 3.09Å; V80-T120 PolarHBondContact N-O 3.24Å; V80-T120 PolarHBondContact O-N 3.49Å; V80-I122 HydrophobicContact CG2-CD1 3.91Å; V80-I122 HydrophobicContact CG2-CG1 4.48Å
81	N	88.9	Confident	75.4	Confident	91 Å²	91	62.8 Å²	62.8	49%	0.487	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.8	172.8	-59	-12.2	0	0	0	107.7	S58	S58-N81 PolarHBondContact O-N 3.46Å
82	G	83.1	Confident	73.2	Confident	19 Å²	19	68 Å²	68	20%	0.196	37%	0.369	C	S	.	.	S	Bend	trans	97.2	168.1	-174.5	0	0	0	0	0	114.3	M118 T120	G82-M118 CarbonylContact C-O 3.56Å; G82-M118 VanDerWaalsContact C-O 3.29Å; G82-M118 WeakPolarHBondContact CA-O 3.24Å; G82-M118 PolarHBondContact N-O 3.05Å; G82-T120 PolarHBondContact O-OG1 2.78Å
83	K	72.6	Confident	70.9	Confident	84 Å²	84	66.9 Å²	66.9	37%	0.365	37%	0.369	S	S	.	.			trans	-87.2	125.7	-179.6	-161.6	-178.5	172.1	-162.6	0	110.7	S85 E87 M118	K83-S85 WeakPolarHBondContact CD-OG 3.3Å; K83-S85 VanDerWaalsContact CE-OG 3.24Å; K83-S85 WeakPolarHBondContact CE-OG 3.4Å; K83-S85 WeakPolarHBondContact CG-OG 3.39Å; K83-S85 PolarHBondContact O-N 3.36Å; K83-E87 IonicContact NZ-OE1 2.9Å; K83-E87 PolarHBondContact NZ-OE1 3.09Å; K83-E87 IonicContact NZ-OE2 3.74Å; K83-E87 PolarHBondContact NZ-OE2 3.41Å; K83-M118 HydrophobicContact CB-CE 4.32Å; K83-M118 HydrophobicContact CB-CG 4.12Å; K83-M118 HydrophobicContact CB-SD 3.7Å; K83-M118 HydrophobicContact CD-CE 3.7Å; K83-M118 HydrophobicContact CD-SD 3.4Å; K83-M118 WeakPolarHBondContact CD-SD 2.96Å; K83-M118 HydrophobicContact CG-CE 3.57Å; K83-M118 HydrophobicContact CG-CG 4.39Å; K83-M118 HydrophobicContact CG-SD 3.52Å; K83-M118 VanDerWaalsContact CG-SD 3.52Å
84	L	68.5	Low	68.5	Low	50 Å²	50	70.6 Å²	70.6	26%	0.262	39%	0.386	S	S	.	.			trans	-78.2	28.9	169.6	-81.5	152.1	0	0	0	113.2	L25 L54 V80 T120 I122	L25-L84 HydrophobicContact CD1-CB 4.43Å; L25-L84 HydrophobicContact CD1-CD1 4.19Å; L54-L84 HydrophobicContact CD2-CD1 3.68Å; L54-L84 HydrophobicContact CD2-CD2 3.54Å; L54-L84 HydrophobicContact CD2-CG 4.22Å; V80-L84 HydrophobicContact CB-CD1 4.28Å; V80-L84 HydrophobicContact CG1-CD1 4.29Å; V80-L84 HydrophobicContact CG2-CD1 4.17Å; L84-T120 HydrophobicContact CB-CG2 4.15Å; L84-T120 HydrophobicContact CD1-CG2 3.59Å; L84-T120 HydrophobicContact CG-CG2 4.35Å; L84-T120 PolarHBondContact N-OG1 2.53Å; L84-I122 HydrophobicContact CD1-CD1 3.65Å; L84-I122 HydrophobicContact CD1-CG1 4.4Å
85	S	54	Low	65.9	Low	31 Å²	31	79.5 Å²	79.5	22%	0.217	43%	0.425	C	S	.	.	S	Bend	trans	-80.9	151.4	169.8	52.3	0	0	0	0	110.2	K83 E87	K83-S85 WeakPolarHBondContact CD-OG 3.3Å; K83-S85 VanDerWaalsContact CE-OG 3.24Å; K83-S85 WeakPolarHBondContact CE-OG 3.4Å; K83-S85 WeakPolarHBondContact CG-OG 3.39Å; K83-S85 PolarHBondContact O-N 3.36Å; S85-E87 WeakPolarHBondContact CB-OE2 3.35Å; S85-E87 PolarHBondContact O-N 2.89Å; S85-E87 PolarHBondContact OG-OE2 3.23Å
86	G	50.5	Low	63.2	Low	42 Å²	42	82.5 Å²	82.5	43%	0.433	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	35.7	-176.5	0	0	0	0	0	116
87	E	44.9	Very low	60.6	Low	119 Å²	119	87.4 Å²	87.4	56%	0.556	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-21.2	-177.4	-68	160.4	154	0	0	111.5	K83 S85 E89	K83-E87 IonicContact NZ-OE1 2.9Å; K83-E87 PolarHBondContact NZ-OE1 3.09Å; K83-E87 IonicContact NZ-OE2 3.74Å; K83-E87 PolarHBondContact NZ-OE2 3.41Å; S85-E87 WeakPolarHBondContact CB-OE2 3.35Å; S85-E87 PolarHBondContact O-N 2.89Å; S85-E87 PolarHBondContact OG-OE2 3.23Å; E87-E89 PolarHBondContact O-N 3.47Å
88	N	43.3	Very low	57.7	Low	112 Å²	112	89.3 Å²	89.3	60%	0.599	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	22.8	-178.5	-153.7	10.2	0	0	0	115.2
89	E	47.5	Very low	55.1	Low	145 Å²	145	96.3 Å²	96.3	68%	0.678	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-7.9	174.2	-137	169.3	158.8	0	0	112.5	E87	E87-E89 PolarHBondContact O-N 3.47Å
90	A	41.8	Very low	52.6	Low	85 Å²	85	101.6 Å²	101.6	70%	0.702	59%	0.594	S	S	*	*	S	Bend	trans	-85.2	-19.8	178.9	0	0	0	0	0	114.4
91	E	42.9	Very low	50.4	Low	165 Å²	165	105 Å²	105	77%	0.771	63%	0.63	S	S	*	*	S	Bend	trans	-103.8	-12.8	-172.1	-58.6	-151.4	147.5	0	0	115.4
92	M	43.8	Very low	48	Very low	169 Å²	169	108.3 Å²	108.3	83%	0.833	65%	0.648	S	S	*	*	S	Bend	trans	-102.6	6.5	-175.1	-71.7	-70.7	-174.7	0	0	114.9
93	A	44.2	Very low	46.3	Very low	82 Å²	82	113.9 Å²	113.9	68%	0.678	67%	0.673	S	S	*	*	S	Bend	trans	-106.1	-7.1	-178.6	0	0	0	0	0	115.6
94	E	42.7	Very low	44.9	Very low	170 Å²	170	115 Å²	115	79%	0.794	69%	0.692	S	S	*	*			trans	-123.4	47.4	-173	-79.8	-71.4	171.7	0	0	113.6
95	K	41.3	Very low	43.9	Very low	221 Å²	221	116.6 Å²	116.6	96%	0.961	72%	0.72	S	S	*	*			trans	-125.5	63.2	158.2	-95.4	-175.5	177.9	172.1	0	110.4
96	G	40.4	Very low	42.9	Very low	67 Å²	67	118.9 Å²	118.9	69%	0.691	75%	0.749	S	S	*	*	S	Bend	trans	-157.2	55.7	-179.2	0	0	0	0	0	114.3
97	A	42.4	Very low	42.8	Very low	103 Å²	103	123 Å²	123	85%	0.851	77%	0.771	S	S	*	*			trans	149.4	120.7	138.5	0	0	0	0	0	113.7
98	G	36.3	Very low	42.6	Very low	76 Å²	76	122.4 Å²	122.4	78%	0.784	78%	0.78	S	S	*	*			trans	64.5	103.7	134.7	0	0	0	0	0	121
99	D	40.8	Very low	42.4	Very low	148 Å²	148	123.7 Å²	123.7	79%	0.791	79%	0.786	S	S	*	*				37.1	107.9	124	-161.5	45.3	0	0	0	119.6
100	D	43.1	Very low	42.3	Very low	151 Å²	151	120.7 Å²	120.7	81%	0.807	79%	0.794	S	S	*	*				173.1	134.2	115.7	-105	-39.9	0	0	0	110.5
101	G	46.4	Very low	42.5	Very low	76 Å²	76	123.7 Å²	123.7	78%	0.784	80%	0.799	S	S	*	*			trans	-76.3	159.8	-166.7	0	0	0	0	0	117.1
102	N	38.2	Very low	42.6	Very low	160 Å²	160	121.3 Å²	121.3	86%	0.856	79%	0.791	S	S	*	*			trans	-178.5	126.2	132	-177.4	75.3	0	0	0	111.3
103	D	46	Very low	42.8	Very low	135 Å²	135	121.6 Å²	121.6	72%	0.722	80%	0.796	S	S	*	*			trans	-61.9	133.6	172.9	172.1	36.8	0	0	0	114.1
104	S	43.2	Very low	43.2	Very low	109 Å²	109	123 Å²	123	76%	0.762	79%	0.793	S	S	*	*			trans	177	126.5	133.2	-81.8	0	0	0	0	111.5
105	G	47.5	Very low	43.7	Very low	83 Å²	83	119.5 Å²	119.5	86%	0.856	78%	0.779	S	S	*	*			trans	-75.5	171.1	-169.8	0	0	0	0	0	117.5
106	G	34.5	Very low	44.3	Very low	79 Å²	79	118.1 Å²	118.1	81%	0.814	78%	0.776	S	S	*	*			trans	-177	79.2	178.7	0	0	0	0	0	111.3
107	S	47.2	Very low	45.1	Very low	128 Å²	128	117.8 Å²	117.8	90%	0.895	77%	0.773	S	S	*	*			trans	0.1	119.2	158.9	-160.3	0	0	0	0	117.7
108	S	40.9	Very low	46.9	Very low	106 Å²	106	116.7 Å²	116.7	74%	0.741	75%	0.751	S	S	*	*			trans	-155.5	114.9	144.1	-156	0	0	0	0	109.4
109	D	40	Very low	49.3	Very low	139 Å²	139	117.2 Å²	117.2	74%	0.743	74%	0.735	S	S	*	*			trans	46.7	109.8	157.7	-62.3	-31.4	0	0	0	119.1	D111	D109-D111 PolarHBondContact O-N 3.07Å
110	G	45.8	Very low	51.8	Low	82 Å²	82	110.2 Å²	110.2	85%	0.845	70%	0.698	S	S	*	*			trans	-66	106.7	150.9	0	0	0	0	0	108.9
111	D	44	Very low	54.2	Low	149 Å²	149	106 Å²	106	80%	0.797	67%	0.673	S	S	*	*			trans	-106.9	93.6	148.5	-100	-17.2	0	0	0	103.8	D109	D109-D111 PolarHBondContact O-N 3.07Å
112	D	46.4	Very low	56.5	Low	114 Å²	114	102.4 Å²	102.4	61%	0.61	64%	0.636	S	S	*	*				81.1	84.7	112	-99.9	-0	0	0	0	112.3	D114	D112-D114 HydrophobicContact CB-CB 4.09Å; D112-D114 PolarHBondContact O-N 3.35Å
113	D	47.7	Very low	59.2	Low	175 Å²	175	96.8 Å²	96.8	94%	0.936	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	44.3	152.8	-71.3	-48.5	0	0	0	110.6
114	D	52.5	Low	61.6	Low	113 Å²	113	90.4 Å²	90.4	60%	0.604	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	6.4	-176.4	-111.1	-3.3	0	0	0	111.9	D112 E116 G117	D112-D114 HydrophobicContact CB-CB 4.09Å; D112-D114 PolarHBondContact O-N 3.35Å; D114-E116 PolarHBondContact O-N 2.95Å; D114-G117 PolarHBondContact O-N 3.28Å
115	D	53.2	Low	64.2	Low	95 Å²	95	85.5 Å²	85.5	51%	0.508	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-69.6	-22.1	170.9	-93.1	-39.6	0	0	0	112.4	G117 M118	D115-G117 PolarHBondContact O-N 2.82Å; D115-G117 VanDerWaalsContact O-N 3.1Å; D115-M118 PolarHBondContact O-N 3.15Å; D115-M118 VanDerWaalsContact O-N 3.14Å
116	E	53.1	Low	66.5	Low	192 Å²	192	81.9 Å²	81.9	90%	0.897	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-63.7	-14	177	-158.8	67.5	-141.3	0	0	112.9	D114	D114-E116 PolarHBondContact O-N 2.95Å
117	G	59	Low	69.4	Low	61 Å²	61	83.3 Å²	83.3	63%	0.629	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-110.8	-6.6	176.7	0	0	0	0	0	114.8	D114 D115 I119	D114-G117 PolarHBondContact O-N 3.28Å; D115-G117 PolarHBondContact O-N 2.82Å; D115-G117 VanDerWaalsContact O-N 3.1Å; G117-I119 PolarHBondContact O-N 3.39Å
118	M	78.4	Confident	71.6	Confident	80 Å²	80	80.8 Å²	80.8	39%	0.394	47%	0.465	S	S	.	.			trans	-85.4	117	-174	-169.3	156.3	-171.9	0	0	110.8	G82 K83 D115	G82-M118 CarbonylContact C-O 3.56Å; G82-M118 VanDerWaalsContact C-O 3.29Å; G82-M118 WeakPolarHBondContact CA-O 3.24Å; G82-M118 PolarHBondContact N-O 3.05Å; K83-M118 HydrophobicContact CB-CE 4.32Å; K83-M118 HydrophobicContact CB-CG 4.12Å; K83-M118 HydrophobicContact CB-SD 3.7Å; K83-M118 HydrophobicContact CD-CE 3.7Å; K83-M118 HydrophobicContact CD-SD 3.4Å; K83-M118 WeakPolarHBondContact CD-SD 2.96Å; K83-M118 HydrophobicContact CG-CE 3.57Å; K83-M118 HydrophobicContact CG-CG 4.39Å; K83-M118 HydrophobicContact CG-SD 3.52Å; K83-M118 VanDerWaalsContact CG-SD 3.52Å; D115-M118 PolarHBondContact O-N 3.15Å; D115-M118 VanDerWaalsContact O-N 3.14Å
119	I	88.3	Confident	74.1	Confident	87 Å²	87	80.9 Å²	80.9	45%	0.446	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.8	-179.8	-65.9	168.1	0	0	0	109.4	M79 V80 G117	M79-I119 HydrophobicContact CG-CG2 3.21Å; M79-I119 HydrophobicContact SD-CD1 4.08Å; M79-I119 HydrophobicContact SD-CG1 4.48Å; M79-I119 HydrophobicContact SD-CG2 3.89Å; V80-I119 WeakPolarHBondContact O-CA 3.09Å; G117-I119 PolarHBondContact O-N 3.39Å
120	T	91.6	Very high	76.6	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.006	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.8	168.8	-53.9	0	0	0	0	110.4	L25 V80 G82 L84 I122	L25-T120 HydrophobicContact CD1-CG2 4.35Å; L25-T120 HydrophobicContact CD2-CG2 3.92Å; L25-T120 HydrophobicContact CG-CG2 3.96Å; V80-T120 PolarHBondContact N-O 3.24Å; V80-T120 PolarHBondContact O-N 3.49Å; G82-T120 PolarHBondContact O-OG1 2.78Å; L84-T120 HydrophobicContact CB-CG2 4.15Å; L84-T120 HydrophobicContact CD1-CG2 3.59Å; L84-T120 HydrophobicContact CG-CG2 4.35Å; L84-T120 PolarHBondContact N-OG1 2.53Å; T120-I122 HydrophobicContact CG2-CG1 4.34Å
121	E	93.6	Very high	79	Confident	63 Å²	63	75.9 Å²	75.9	29%	0.294	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.2	177.1	-60.7	-164.2	124.8	0	0	111.8	L25 D26 Y77 R123	L25-E121 WeakPolarHBondContact CA-O 3.4Å; D26-E121 PolarHBondContact N-O 2.79Å; D26-E121 PolarHBondContact OD1-N 3.08Å; Y77-E121 HydrophobicContact CE2-CB 4.19Å; Y77-E121 HydrophobicContact CE2-CG 4.23Å; Y77-E121 WeakPolarHBondContact CE2-OE1 3.35Å; Y77-E121 WeakPolarHBondContact OH-CG 3.44Å; Y77-E121 PolarHBondContact OH-OE1 3.05Å; E121-R123 IonicContact OE1-NH2 3.01Å; E121-R123 IonicContact OE2-CZ 2.65Å; E121-R123 IonicContact OE2-NH1 2.68Å; E121-R123 IonicContact OE2-NH2 2.63Å; E121-R123 PolarHBondContact OE2-NH2 3.13Å
122	I	95.1	Very high	81.4	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.4	176.7	-46.9	179.7	0	0	0	109.9	V24 L25 F52 L54 V78 V80 L84 T120 F124	V24-I122 CarbonylContact O-C 3.48Å; V24-I122 WeakPolarHBondContact O-CA 3.38Å; L25-I122 HydrophobicContact CD1-CD1 4.34Å; L25-I122 HydrophobicContact CD1-CG1 4.32Å; L25-I122 HydrophobicContact CG-CG1 4.33Å; F52-I122 HydrophobicContact CE2-CD1 3.73Å; F52-I122 HydrophobicContact CZ-CD1 4.14Å; F52-I122 HydrophobicContact CZ-CG2 4.05Å; L54-I122 HydrophobicContact CD1-CD1 3.58Å; L54-I122 HydrophobicContact CD2-CD1 4.12Å; L54-I122 HydrophobicContact CG-CD1 4.42Å; V78-I122 HydrophobicContact CB-CB 4.34Å; V78-I122 PolarHBondContact N-O 2.85Å; V78-I122 PolarHBondContact O-N 2.9Å; V80-I122 HydrophobicContact CG2-CD1 3.91Å; V80-I122 HydrophobicContact CG2-CG1 4.48Å; L84-I122 HydrophobicContact CD1-CD1 3.65Å; L84-I122 HydrophobicContact CD1-CG1 4.4Å; T120-I122 HydrophobicContact CG2-CG1 4.34Å; I122-F124 HydrophobicContact CB-CE2 4.47Å; I122-F124 HydrophobicContact CG2-CD2 4.29Å; I122-F124 HydrophobicContact CG2-CE1 3.97Å; I122-F124 HydrophobicContact CG2-CE2 3.72Å; I122-F124 HydrophobicContact CG2-CZ 3.55Å
123	R	96	Very high	83.8	Confident	42 Å²	42	68.3 Å²	68.3	16%	0.158	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	122.1	173.5	-57	176.8	179.1	85.5	6.3	109.2	V24 L76 Y77 E121	V24-R123 HydrophobicContact CB-CB 4.18Å; V24-R123 PolarHBondContact N-O 2.91Å; V24-R123 PolarHBondContact O-N 2.83Å; L76-R123 WeakPolarHBondContact O-CA 3.42Å; Y77-R123 HydrophobicContact CD2-CG 4.06Å; E121-R123 IonicContact OE1-NH2 3.01Å; E121-R123 IonicContact OE2-CZ 2.65Å; E121-R123 IonicContact OE2-NH1 2.68Å; E121-R123 IonicContact OE2-NH2 2.63Å; E121-R123 PolarHBondContact OE2-NH2 3.13Å
124	F	96.9	Very high	86.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	112.7	172.3	-62.4	-70.6	0	0	0	109.5	T21 A23 L35 L42 W44 F52 H75 L76 V78 I122 P126 M135	T21-F124 HydrophobicContact CG2-CB 3.78Å; T21-F124 HydrophobicContact CG2-CD1 4.24Å; T21-F124 HydrophobicContact CG2-CG 4.46Å; A23-F124 HydrophobicContact CB-CD1 4.13Å; A23-F124 HydrophobicContact CB-CE1 4.09Å; L35-F124 HydrophobicContact CD1-CD1 3.87Å; L35-F124 HydrophobicContact CD1-CD2 4.4Å; L35-F124 HydrophobicContact CD1-CE1 3.62Å; L35-F124 HydrophobicContact CD1-CE2 4.17Å; L35-F124 HydrophobicContact CD1-CG 4.24Å; L35-F124 HydrophobicContact CD1-CZ 3.77Å; L35-F124 HydrophobicContact CD2-CG 4.29Å; L42-F124 HydrophobicContact CD2-CE2 3.87Å; L42-F124 HydrophobicContact CD2-CZ 4.26Å; W44-F124 HydrophobicContact CB-CE1 3.81Å; W44-F124 HydrophobicContact CG-CE1 4.02Å; F52-F124 HydrophobicContact CE2-CZ 4.19Å; F52-F124 AromaticContact CZ-CE1 3.94Å; F52-F124 HydrophobicContact CZ-CE1 3.94Å; F52-F124 AromaticContact CZ-CZ 3.89Å; F52-F124 HydrophobicContact CZ-CZ 3.89Å; H75-F124 WeakPolarHBondContact CA-O 3.29Å; H75-F124 WeakPolarHBondContact CB-O 3.48Å; L76-F124 HydrophobicContact CB-CB 4.27Å; L76-F124 PolarHBondContact N-O 2.76Å; L76-F124 PolarHBondContact O-N 2.82Å; V78-F124 HydrophobicContact CB-CE2 4.4Å; V78-F124 HydrophobicContact CG2-CD2 3.99Å; V78-F124 HydrophobicContact CG2-CE2 3.87Å; I122-F124 HydrophobicContact CB-CE2 4.47Å; I122-F124 HydrophobicContact CG2-CD2 4.29Å; I122-F124 HydrophobicContact CG2-CE1 3.97Å; I122-F124 HydrophobicContact CG2-CE2 3.72Å; I122-F124 HydrophobicContact CG2-CZ 3.55Å; F124-P126 VanDerWaalsContact O-CD 3.23Å; F124-P126 WeakPolarHBondContact O-CD 3.33Å; F124-M135 HydrophobicContact CB-CE 4.19Å
125	V	96.7	Very high	88.2	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.036	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	94	-176.1	-164.3	0	0	0	0	109.4	T22 V24 Y71 Q73 H75	T22-V125 PolarHBondContact N-O 2.96Å; T22-V125 PolarHBondContact O-N 3.19Å; V24-V125 HydrophobicContact CG2-CG2 4.45Å; Y71-V125 HydrophobicContact CE1-CG2 4.36Å; Q73-V125 HydrophobicContact CB-CG1 3.6Å; Q73-V125 HydrophobicContact CG-CG1 4.4Å; H75-V125 HydrophobicContact CB-CB 4.37Å; H75-V125 HydrophobicContact CB-CG1 4.49Å; H75-V125 HydrophobicContact CB-CG2 3.84Å
126	P	96.1	Very high	90.2	Very high	8 Å²	8	56 Å²	56	5%	0.052	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145.9	177.6	31.5	-35.2	0	0	0	110.8	Q18 F124 D128 L132 M135	Q18-P126 HydrophobicContact CG-CB 4.28Å; F124-P126 VanDerWaalsContact O-CD 3.23Å; F124-P126 WeakPolarHBondContact O-CD 3.33Å; P126-D128 WeakPolarHBondContact CB-O 3.31Å; P126-D128 WeakPolarHBondContact CG-O 3.33Å; P126-D128 PolarHBondContact O-N 2.8Å; P126-L132 HydrophobicContact CG-CD2 3.54Å; P126-L132 HydrophobicContact CG-CG 3.72Å; P126-M135 HydrophobicContact CB-SD 4.12Å; P126-M135 HydrophobicContact CG-SD 4Å
127	T	94.8	Very high	92.3	Very high	109 Å²	109	49.5 Å²	49.5	67%	0.669	28%	0.279	S	S	*	.	S	Bend	trans	-65.9	-34.4	171.9	-56.4	0	0	0	0	110.9	A20	A20-T127 WeakPolarHBondContact O-CB 3.23Å; A20-T127 PolarHBondContact O-N 2.83Å; A20-T127 PolarHBondContact O-OG1 2.86Å
128	D	93.8	Very high	94.1	Very high	75 Å²	75	46.9 Å²	46.9	40%	0.401	25%	0.251	S	S	.	.	S	Bend	trans	-94	113.7	172.1	-176	1.1	0	0	0	110.3	P126 T130 S131	P126-D128 WeakPolarHBondContact CB-O 3.31Å; P126-D128 WeakPolarHBondContact CG-O 3.33Å; P126-D128 PolarHBondContact O-N 2.8Å; D128-T130 VanDerWaalsContact C-N 3.26Å; D128-T130 VanDerWaalsContact CG-OG1 3.26Å; D128-T130 PolarHBondContact O-N 2.81Å; D128-T130 WeakPolarHBondContact OD1-CB 3.45Å; D128-T130 PolarHBondContact OD1-N 2.97Å; D128-T130 PolarHBondContact OD1-OG1 2.76Å; D128-T130 PolarHBondContact OD2-OG1 2.86Å; D128-T130 VanDerWaalsContact OD2-OG1 3.14Å; D128-S131 PolarHBondContact O-N 2.95Å; D128-S131 PolarHBondContact O-OG 2.91Å
129	K	93.4	Very high	94.9	Very high	107 Å²	107	43 Å²	43	47%	0.465	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-23.1	-179.3	-60.4	172.1	165.3	-154.8	0	112.9	E74 S131 L132	E74-K129 WeakPolarHBondContact OE1-CD 3.23Å; E74-K129 WeakPolarHBondContact OE1-CE 3.46Å; E74-K129 IonicContact OE1-NZ 3.87Å; E74-K129 PolarHBondContact OE1-NZ 3.46Å; K129-S131 PolarHBondContact O-N 2.79Å; K129-L132 PolarHBondContact O-N 2.85Å
130	T	93.4	Very high	95.2	Very high	110 Å²	110	41.1 Å²	41.1	68%	0.675	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-20.8	-178	68.7	0	0	0	0	111.8	D128 L132	D128-T130 VanDerWaalsContact C-N 3.26Å; D128-T130 VanDerWaalsContact CG-OG1 3.26Å; D128-T130 PolarHBondContact O-N 2.81Å; D128-T130 WeakPolarHBondContact OD1-CB 3.45Å; D128-T130 PolarHBondContact OD1-N 2.97Å; D128-T130 PolarHBondContact OD1-OG1 2.76Å; D128-T130 PolarHBondContact OD2-OG1 2.86Å; D128-T130 VanDerWaalsContact OD2-OG1 3.14Å; T130-L132 VanDerWaalsContact C-N 3.3Å; T130-L132 PolarHBondContact O-N 3.47Å
131	S	94.9	Very high	95.3	Very high	7 Å²	7	46.2 Å²	46.2	5%	0.049	25%	0.25	C	S	.	.	H	α-helix	trans	-75.2	-16.4	177.8	73.8	0	0	0	0	114	Q18 D128 K129 E133 S134 M135	Q18-S131 PolarHBondContact OE1-OG 3.43Å; D128-S131 PolarHBondContact O-N 2.95Å; D128-S131 PolarHBondContact O-OG 2.91Å; K129-S131 PolarHBondContact O-N 2.79Å; S131-E133 PolarHBondContact O-N 2.85Å; S131-S134 PolarHBondContact O-N 2.86Å; S131-S134 VanDerWaalsContact O-N 3.09Å; S131-M135 VanDerWaalsContact O-CG 3.26Å; S131-M135 WeakPolarHBondContact O-CG 3.09Å; S131-M135 PolarHBondContact O-N 2.94Å
132	L	95.8	Very high	95.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-55.3	-39.7	-178.1	-76.2	170.4	0	0	0	112.4	I64 E74 L76 P126 K129 T130 M135 F136	I64-L132 HydrophobicContact CD1-CB 4.36Å; I64-L132 HydrophobicContact CG2-CB 4.26Å; I64-L132 HydrophobicContact CG2-CD1 4.22Å; E74-L132 HydrophobicContact CB-CD1 3.7Å; L76-L132 HydrophobicContact CB-CD2 4.09Å; P126-L132 HydrophobicContact CG-CD2 3.54Å; P126-L132 HydrophobicContact CG-CG 3.72Å; K129-L132 PolarHBondContact O-N 2.85Å; T130-L132 VanDerWaalsContact C-N 3.3Å; T130-L132 PolarHBondContact O-N 3.47Å; L132-M135 HydrophobicContact CD2-SD 4.39Å; L132-M135 PolarHBondContact O-N 3.43Å; L132-F136 VanDerWaalsContact O-CB 3.31Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 PolarHBondContact O-N 2.98Å
133	E	95.9	Very high	95.2	Very high	104 Å²	104	45.5 Å²	45.5	49%	0.486	25%	0.247	S	C	.	.	H	α-helix	trans	-66.5	-42.8	179.4	-160.6	66.1	-147.8	0	0	111.5	R66 S131 F136 S137	R66-E133 IonicContact NH2-OE2 2.95Å; R66-E133 PolarHBondContact NH2-OE2 3.34Å; S131-E133 PolarHBondContact O-N 2.85Å; E133-F136 PolarHBondContact O-N 3.27Å; E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 3.31Å
134	S	96.1	Very high	95	Very high	65 Å²	65	47.4 Å²	47.4	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-68.2	-39.4	177.7	-58.2	0	0	0	0	112.2	S131 A138	S131-S134 PolarHBondContact O-N 2.86Å; S131-S134 VanDerWaalsContact O-N 3.09Å; S134-A138 VanDerWaalsContact O-CB 3.31Å; S134-A138 WeakPolarHBondContact O-CB 3.5Å; S134-A138 PolarHBondContact O-N 3.17Å
135	M	95.7	Very high	94.8	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-46.9	174.3	-65.4	161.1	71.3	0	0	110.9	H16 Q18 T21 L35 L76 F124 P126 S131 L132 A138 M139	H16-M135 WeakPolarHBondContact NE2-CG 3.4Å; Q18-M135 HydrophobicContact CB-CG 4.16Å; Q18-M135 HydrophobicContact CB-SD 4.22Å; Q18-M135 HydrophobicContact CG-CE 4.49Å; Q18-M135 HydrophobicContact CG-CG 4.33Å; Q18-M135 HydrophobicContact CG-SD 3.84Å; T21-M135 HydrophobicContact CG2-CE 4.3Å; L35-M135 HydrophobicContact CD2-CE 3.32Å; L76-M135 HydrophobicContact CB-CE 4.41Å; L76-M135 HydrophobicContact CD2-CB 4.07Å; L76-M135 HydrophobicContact CD2-CE 4.1Å; F124-M135 HydrophobicContact CB-CE 4.19Å; P126-M135 HydrophobicContact CB-SD 4.12Å; P126-M135 HydrophobicContact CG-SD 4Å; S131-M135 VanDerWaalsContact O-CG 3.26Å; S131-M135 WeakPolarHBondContact O-CG 3.09Å; S131-M135 PolarHBondContact O-N 2.94Å; L132-M135 HydrophobicContact CD2-SD 4.39Å; L132-M135 PolarHBondContact O-N 3.43Å; M135-A138 PolarHBondContact O-N 3.36Å; M135-M139 PolarHBondContact O-N 3.14Å
136	F	96.8	Very high	94.4	Very high	59 Å²	59	54.5 Å²	54.5	26%	0.259	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-50.1	179.1	178.1	-98.8	0	0	0	111.8	H62 I64 L76 L132 E133 A138 M139 C140	H62-F136 AromaticContact CD2-CD2 3.63Å; H62-F136 AromaticContact CD2-CE2 3.53Å; H62-F136 AromaticContact NE2-CE2 3.96Å; I64-F136 HydrophobicContact CD1-CB 3.62Å; I64-F136 HydrophobicContact CD1-CD1 4.35Å; I64-F136 HydrophobicContact CD1-CD2 4.46Å; I64-F136 HydrophobicContact CD1-CG 3.9Å; I64-F136 HydrophobicContact CG1-CB 3.72Å; I64-F136 HydrophobicContact CG1-CD2 3.92Å; I64-F136 HydrophobicContact CG1-CG 3.85Å; L76-F136 HydrophobicContact CD1-CB 4.17Å; L76-F136 HydrophobicContact CD1-CD2 4.03Å; L132-F136 VanDerWaalsContact O-CB 3.31Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 PolarHBondContact O-N 2.98Å; E133-F136 PolarHBondContact O-N 3.27Å; F136-A138 VanDerWaalsContact C-N 3.31Å; F136-A138 PolarHBondContact O-N 3.1Å; F136-M139 PolarHBondContact O-N 3.36Å; F136-M139 VanDerWaalsContact O-N 3.09Å; F136-C140 WeakPolarHBondContact CE1-SG 3.26Å; F136-C140 VanDerWaalsContact CZ-SG 3.51Å; F136-C140 PolarHBondContact O-N 3.19Å; F136-C140 PolarHBondContact O-SG 3.38Å; F136-C140 VanDerWaalsContact O-SG 3.36Å
137	S	96.6	Very high	93.9	Very high	55 Å²	55	59.1 Å²	59.1	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-57.6	-44.2	178.1	-170.2	0	0	0	0	111.8	E133 M139 C140 E141	E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 3.31Å; S137-M139 VanDerWaalsContact C-N 3.33Å; S137-M139 PolarHBondContact O-N 2.95Å; S137-C140 PolarHBondContact O-N 3.45Å; S137-E141 WeakPolarHBondContact O-CG 3.44Å; S137-E141 PolarHBondContact O-N 2.73Å
138	A	96.1	Very high	93.1	Very high	6 Å²	6	57.9 Å²	57.9	5%	0.05	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-38.3	177.4	0	0	0	0	0	112.2	R15 H16 V37 S134 M135 F136 C142	R15-A138 HydrophobicContact CB-CB 4.31Å; H16-A138 HydrophobicContact CB-CB 3.62Å; V37-A138 HydrophobicContact CB-CB 4.28Å; V37-A138 HydrophobicContact CG1-CB 3.96Å; S134-A138 VanDerWaalsContact O-CB 3.31Å; S134-A138 WeakPolarHBondContact O-CB 3.5Å; S134-A138 PolarHBondContact O-N 3.17Å; M135-A138 PolarHBondContact O-N 3.36Å; F136-A138 VanDerWaalsContact C-N 3.31Å; F136-A138 PolarHBondContact O-N 3.1Å; A138-C142 PolarHBondContact O-N 3.14Å; A138-C142 VanDerWaalsContact O-N 3.11Å; A138-C142 PolarHBondContact O-SG 3.11Å
139	M	95.1	Very high	92.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-66.7	-42.4	174.6	-79.8	-170.6	62.7	0	0	112.1	V37 L42 I59 H62 L76 V78 M135 F136 S137 E141 C142 Q143	V37-M139 HydrophobicContact CG1-CG 3.83Å; V37-M139 HydrophobicContact CG2-CG 4.14Å; L42-M139 HydrophobicContact CD1-CG 4.14Å; L42-M139 HydrophobicContact CD1-SD 3.95Å; L42-M139 HydrophobicContact CD2-CE 3.74Å; L42-M139 HydrophobicContact CD2-SD 3.87Å; I59-M139 HydrophobicContact CD1-CE 4.04Å; H62-M139 HydrophobicContact CB-CE 3.65Å; L76-M139 HydrophobicContact CD2-SD 3.54Å; L76-M139 VanDerWaalsContact CD2-SD 3.54Å; L76-M139 HydrophobicContact CG-SD 4.46Å; V78-M139 HydrophobicContact CG2-CE 3.96Å; V78-M139 HydrophobicContact CG2-SD 4.36Å; M135-M139 PolarHBondContact O-N 3.14Å; F136-M139 PolarHBondContact O-N 3.36Å; F136-M139 VanDerWaalsContact O-N 3.09Å; S137-M139 VanDerWaalsContact C-N 3.33Å; S137-M139 PolarHBondContact O-N 2.95Å; M139-E141 PolarHBondContact O-N 2.92Å; M139-C142 PolarHBondContact O-N 2.93Å; M139-Q143 WeakPolarHBondContact O-CB 3.49Å; M139-Q143 PolarHBondContact O-N 3.02Å
140	C	94.4	Very high	91.1	Very high	47 Å²	47	60.2 Å²	60.2	32%	0.318	35%	0.349	S	S	.	.	H	α-helix	trans	-58.4	-46.8	175.3	-67.7	0	0	0	0	111.8	H62 F136 S137 C142 Q143 A144	H62-C140 PolarHBondContact NE2-SG 2.86Å; F136-C140 WeakPolarHBondContact CE1-SG 3.26Å; F136-C140 VanDerWaalsContact CZ-SG 3.51Å; F136-C140 PolarHBondContact O-N 3.19Å; F136-C140 PolarHBondContact O-SG 3.38Å; F136-C140 VanDerWaalsContact O-SG 3.36Å; S137-C140 PolarHBondContact O-N 3.45Å; C140-C142 VanDerWaalsContact C-N 3.3Å; C140-C142 PolarHBondContact O-N 2.82Å; C140-Q143 PolarHBondContact O-N 2.9Å; C140-A144 PolarHBondContact O-N 2.62Å; C140-A144 VanDerWaalsContact O-N 3.07Å
141	E	95.2	Very high	89.8	Confident	108 Å²	108	60.5 Å²	60.5	51%	0.505	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-40.6	177.5	-74.5	174.8	-160.1	0	0	112	S137 M139	S137-E141 WeakPolarHBondContact O-CG 3.44Å; S137-E141 PolarHBondContact O-N 2.73Å; M139-E141 PolarHBondContact O-N 2.92Å
142	C	93.9	Very high	88.1	Confident	0 Å²	0	68 Å²	68	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-73.8	-40	178.5	-61.5	0	0	0	0	111.9	Y56 A138 M139 C140 A144 L145 H146	Y56-C142 HydrophobicContact CD1-CB 4.2Å; Y56-C142 HydrophobicContact CD2-CB 4.33Å; Y56-C142 HydrophobicContact CE1-CB 3.44Å; Y56-C142 VanDerWaalsContact CE1-CB 3.44Å; Y56-C142 HydrophobicContact CE2-CB 3.59Å; Y56-C142 WeakPolarHBondContact OH-CB 3.5Å; Y56-C142 PolarHBondContact OH-SG 3.23Å; A138-C142 PolarHBondContact O-N 3.14Å; A138-C142 VanDerWaalsContact O-N 3.11Å; A138-C142 PolarHBondContact O-SG 3.11Å; M139-C142 PolarHBondContact O-N 2.93Å; C140-C142 VanDerWaalsContact C-N 3.3Å; C140-C142 PolarHBondContact O-N 2.82Å; C142-A144 PolarHBondContact O-N 3.25Å; C142-L145 WeakPolarHBondContact O-CB 3.32Å; C142-L145 PolarHBondContact O-N 3.07Å; C142-H146 PolarHBondContact O-CD2 3.39Å; C142-H146 VanDerWaalsContact O-CD2 3.26Å
143	Q	92.6	Very high	86	Confident	47 Å²	47	75 Å²	75	22%	0.22	42%	0.418	C	S	.	.	H	α-helix	trans	-57.2	-38.7	175.8	-164	95.3	52.6	0	0	111.1	Y56 I59 H62 M139 C140 L145 H146	Y56-Q143 HydrophobicContact CD1-CB 4.35Å; Y56-Q143 PolarHBondContact O-NE2 3.45Å; I59-Q143 PolarHBondContact O-NE2 2.92Å; H62-Q143 PolarHBondContact CE1-OE1 2.98Å; H62-Q143 PolarHBondContact ND1-OE1 3.25Å; H62-Q143 VanDerWaalsContact ND1-OE1 3.14Å; M139-Q143 WeakPolarHBondContact O-CB 3.49Å; M139-Q143 PolarHBondContact O-N 3.02Å; C140-Q143 PolarHBondContact O-N 2.9Å; Q143-L145 PolarHBondContact O-N 3.13Å; Q143-L145 VanDerWaalsContact O-N 3.15Å; Q143-H146 PolarHBondContact O-N 3.24Å
144	A	91.4	Very high	84.1	Confident	82 Å²	82	74.9 Å²	74.9	68%	0.678	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.2	176.3	0	0	0	0	0	114.4	C140 C142	C140-A144 PolarHBondContact O-N 2.62Å; C140-A144 VanDerWaalsContact O-N 3.07Å; C142-A144 PolarHBondContact O-N 3.25Å
145	L	92.1	Very high	82.1	Confident	97 Å²	97	79.4 Å²	79.4	51%	0.508	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.1	174.9	-58.8	174.3	0	0	0	113.2	E39 C142 Q143	E39-L145 HydrophobicContact CB-CD1 4.35Å; E39-L145 HydrophobicContact CG-CD1 4.13Å; C142-L145 WeakPolarHBondContact O-CB 3.32Å; C142-L145 PolarHBondContact O-N 3.07Å; Q143-L145 PolarHBondContact O-N 3.13Å; Q143-L145 VanDerWaalsContact O-N 3.15Å
146	H	89	Confident	79.9	Confident	58 Å²	58	85 Å²	85	27%	0.269	48%	0.478	S	S	.	.			trans	-127.7	70.6	-178.3	-59.4	-94.2	0	0	0	110.7	E39 Y56 P57 C142 Q143	E39-H146 PolarHBondContact O-NE2 2.87Å; Y56-H146 AromaticContact CD2-CD2 3.53Å; Y56-H146 AromaticContact CD2-NE2 3.56Å; Y56-H146 AromaticContact CG-CD2 3.78Å; P57-H146 HydrophobicContact CG-CB 4.19Å; C142-H146 PolarHBondContact O-CD2 3.39Å; C142-H146 VanDerWaalsContact O-CD2 3.26Å; Q143-H146 PolarHBondContact O-N 3.24Å
147	P	85.5	Confident	77.9	Confident	106 Å²	106	90 Å²	90	69%	0.688	51%	0.507	S	S	*	.			trans	-64.1	152.2	170.4	29.7	-34.6	0	0	0	110.8
148	D	77.6	Confident	75.8	Confident	82 Å²	82	96.6 Å²	96.6	44%	0.439	53%	0.529	S	S	.	.			trans	-69.5	127.3	175.1	-164.1	-37.5	0	0	0	109.3	D150 D151	D148-D150 PolarHBondContact O-N 2.84Å; D148-D150 PolarHBondContact OD1-N 3.47Å; D148-D151 HydrophobicContact CB-CB 4.01Å; D148-D151 PolarHBondContact O-N 3.19Å
149	P	74.9	Confident	73.7	Confident	95 Å²	95	103.3 Å²	103.3	62%	0.617	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-59.6	-24.7	176.1	25.5	-37	0	0	0	114.1
150	D	70.2	Confident	71.9	Confident	137 Å²	137	105.6 Å²	105.6	73%	0.733	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-88.9	-7.2	180	-67	-38.4	0	0	0	112.9	D148 E152	D148-D150 PolarHBondContact O-N 2.84Å; D148-D150 PolarHBondContact OD1-N 3.47Å; D150-E152 VanDerWaalsContact C-N 3.34Å
151	D	67	Low	69.7	Low	116 Å²	116	110.7 Å²	110.7	62%	0.62	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-85.3	-0.5	176.7	-85.8	-21.4	0	0	0	113.4	D148 D153	D148-D151 HydrophobicContact CB-CB 4.01Å; D148-D151 PolarHBondContact O-N 3.19Å; D151-D153 PolarHBondContact O-N 3.45Å
152	E	57.5	Low	67.8	Low	164 Å²	164	114.6 Å²	114.6	77%	0.766	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-64.6	-11.2	-178.5	-65.1	-165.7	162.8	0	0	114.1	D150	D150-E152 VanDerWaalsContact C-N 3.34Å
153	D	53.5	Low	65.7	Low	148 Å²	148	124.3 Å²	124.3	79%	0.791	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-96.8	-6	-174.2	-74.5	-28.9	0	0	0	115.1	D151	D151-D153 PolarHBondContact O-N 3.45Å
154	S	54.8	Low	63.9	Low	100 Å²	100	128.1 Å²	128.1	70%	0.699	68%	0.68	S	S	*	*	S	Bend	trans	-89.5	-8.7	-174.8	-166.8	0	0	0	0	115.3
155	D	54.7	Low	62.1	Low	160 Å²	160	130.3 Å²	130.3	86%	0.856	69%	0.685	S	S	*	*	S	Bend	trans	-98.2	1.8	-174.8	-87.9	-14.1	0	0	0	114.5
156	N	49.8	Very low	60.1	Low	119 Å²	119	133.8 Å²	133.8	64%	0.636	70%	0.699	S	S	*	*	S	Bend	trans	-113.8	7.7	-174.8	-142.3	54.7	0	0	0	115.8
157	D	53.7	Low	58.2	Low	163 Å²	163	139.4 Å²	139.4	87%	0.872	73%	0.725	S	S	*	*	S	Bend	trans	-109.7	11.9	176.6	-101.1	-9	0	0	0	113.5
158	F	53.7	Low	56.3	Low	193 Å²	193	138.6 Å²	138.6	85%	0.846	73%	0.727	S	S	*	*			trans	-114.9	50.9	163.7	-158.2	-99.2	0	0	0	110.3	G160	F158-G160 PolarHBondContact O-N 2.61Å
159	E	52.1	Low	54.8	Low	148 Å²	148	142.9 Å²	142.9	69%	0.692	75%	0.745	S	S	*	*			trans	-63.6	91.9	152.2	-72.9	-171.2	-166	0	0	106.6	E161	E159-E161 PolarHBondContact O-N 3.17Å
160	G	56.1	Low	53.5	Low	48 Å²	48	146.6 Å²	146.6	50%	0.495	75%	0.754	S	S	.	*			trans	-56.8	97.4	163.4	0	0	0	0	0	107.3	F158 E162	F158-G160 PolarHBondContact O-N 2.61Å; G160-E162 PolarHBondContact O-N 2.9Å
161	E	49	Very low	52	Low	154 Å²	154	143.4 Å²	143.4	72%	0.72	75%	0.753	S	S	*	*			trans	-50.4	96.3	160.9	-64.9	-101.6	171.3	0	0	105.7	E159 Y163	E159-E161 PolarHBondContact O-N 3.17Å; E161-Y163 HydrophobicContact CB-CD2 4.47Å; E161-Y163 HydrophobicContact CB-CE2 4.27Å; E161-Y163 WeakPolarHBondContact O-CD2 3.43Å; E161-Y163 PolarHBondContact O-N 2.91Å
162	E	54.6	Low	51.1	Low	190 Å²	190	147.2 Å²	147.2	89%	0.888	77%	0.766	S	S	*	*			trans	-64.9	87.1	168.7	26.4	-173.1	145.7	0	0	105.5	G160 D164	G160-E162 PolarHBondContact O-N 2.9Å; E162-D164 PolarHBondContact O-N 2.78Å
163	Y	50.1	Low	50.3	Low	203 Å²	203	143.3 Å²	143.3	80%	0.796	76%	0.762	S	S	*	*			trans	-51.5	106.4	172.6	-77.5	-92.5	0	0	0	107.6	E161 V165	E161-Y163 HydrophobicContact CB-CD2 4.47Å; E161-Y163 HydrophobicContact CB-CE2 4.27Å; E161-Y163 WeakPolarHBondContact O-CD2 3.43Å; E161-Y163 PolarHBondContact O-N 2.91Å; Y163-V165 WeakPolarHBondContact O-CG2 3.16Å; Y163-V165 PolarHBondContact O-N 2.82Å
164	D	53.7	Low	50.1	Low	127 Å²	127	143.8 Å²	143.8	68%	0.679	77%	0.765	S	S	*	*			trans	-62.5	103.6	170.4	-170.1	3.4	0	0	0	107.9	E162 E166	E162-D164 PolarHBondContact O-N 2.78Å; D164-E166 PolarHBondContact O-N 2.75Å; D164-E166 VanDerWaalsContact O-N 3.09Å
165	V	54.5	Low	49.9	Very low	129 Å²	129	145.8 Å²	145.8	78%	0.782	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-2	-174.4	174.3	0	0	0	0	112.2	Y163	Y163-V165 WeakPolarHBondContact O-CG2 3.16Å; Y163-V165 PolarHBondContact O-N 2.82Å
166	E	50.5	Low	49.8	Very low	170 Å²	170	143.4 Å²	143.4	79%	0.794	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	2.9	-172.1	-65.4	-84.1	-139.2	0	0	115	D164	D164-E166 PolarHBondContact O-N 2.75Å; D164-E166 VanDerWaalsContact O-N 3.09Å
167	E	48	Very low	50.4	Low	176 Å²	176	142.1 Å²	142.1	82%	0.822	76%	0.756	S	S	*	*	S	Bend	trans	-115.4	0.9	179.6	-152.9	168.9	-175.5	0	0	115.2	E169	E167-E169 PolarHBondContact O-N 3Å
168	A	47	Very low	50.6	Low	88 Å²	88	143.8 Å²	143.8	73%	0.727	76%	0.756	S	S	*	*			trans	-92.7	20.4	-177.7	0	0	0	0	0	115.4	H170	A168-H170 PolarHBondContact O-N 2.9Å; A168-H170 VanDerWaalsContact O-N 3.08Å
169	E	46.3	Very low	51.1	Low	173 Å²	173	141 Å²	141	81%	0.808	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	13.5	173.8	-153.8	-167.7	130.1	0	0	113.8	E167	E167-E169 PolarHBondContact O-N 3Å
170	H	45.9	Very low	51.7	Low	173 Å²	173	138 Å²	138	80%	0.801	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	17.8	-168	-76.1	91.1	0	0	0	118.2	A168	A168-H170 PolarHBondContact O-N 2.9Å; A168-H170 VanDerWaalsContact O-N 3.08Å
171	G	40.4	Very low	51.9	Low	70 Å²	70	141.1 Å²	141.1	72%	0.722	75%	0.746	S	S	*	*			trans	-156.4	100.1	-179.7	0	0	0	0	0	116.3	A173	G171-A173 PolarHBondContact O-N 3.09Å
172	H	47.2	Very low	52.5	Low	195 Å²	195	140.1 Å²	140.1	90%	0.903	75%	0.745	S	S	*	*			trans	-45.3	117.3	163.6	-117.2	-92.7	0	0	0	112.9
173	A	40.3	Very low	53.2	Low	82 Å²	82	136.4 Å²	136.4	68%	0.678	73%	0.728	S	S	*	*			trans	-164.7	124.7	144	0	0	0	0	0	109.8	G171 I175	G171-A173 PolarHBondContact O-N 3.09Å; A173-I175 PolarHBondContact O-N 3.08Å
174	D	49.3	Very low	54	Low	158 Å²	158	127.9 Å²	127.9	85%	0.845	70%	0.702	S	S	*	*			trans	-55.5	109.2	-170	-61.7	-63.8	0	0	0	114.3
175	I	50.8	Low	54.6	Low	143 Å²	143	126 Å²	126	73%	0.733	69%	0.691	S	S	*	*			trans	-84.8	132.3	161.2	-51	168.6	0	0	0	106.1	A173 T177	A173-I175 PolarHBondContact O-N 3.08Å; I175-T177 VanDerWaalsContact C-N 3.34Å; I175-T177 PolarHBondContact O-N 3.44Å
176	P	52.2	Low	55.4	Low	110 Å²	110	124.1 Å²	124.1	71%	0.714	68%	0.684	S	S	*	*			trans	-70.9	94.5	176.3	4.2	9	0	0	0	108.8	F178	P176-F178 PolarHBondContact O-N 3.01Å
177	T	62.2	Low	56.6	Low	91 Å²	91	118.8 Å²	118.8	56%	0.558	67%	0.669	S	S	*	*			trans	-59.6	119	168.9	-56.9	0	0	0	0	108.1	I175 Y179	I175-T177 VanDerWaalsContact C-N 3.34Å; I175-T177 PolarHBondContact O-N 3.44Å; T177-Y179 VanDerWaalsContact O-CD2 3.22Å; T177-Y179 WeakPolarHBondContact O-CD2 3.46Å; T177-Y179 WeakPolarHBondContact O-CE2 3.41Å; T177-Y179 PolarHBondContact O-N 3.21Å
178	F	59.6	Low	58	Low	199 Å²	199	113.5 Å²	113.5	87%	0.873	65%	0.646	S	S	*	*			trans	-66.5	104.5	171.1	-65.6	-85.5	0	0	0	108.2	P176	P176-F178 PolarHBondContact O-N 3.01Å
179	Y	63.3	Low	59.9	Low	133 Å²	133	114 Å²	114	52%	0.522	64%	0.64	S	S	.	*			trans	-72.8	134.9	175.8	-63.3	-80.5	0	0	0	110	T177 E183 A187	T177-Y179 VanDerWaalsContact O-CD2 3.22Å; T177-Y179 WeakPolarHBondContact O-CD2 3.46Å; T177-Y179 WeakPolarHBondContact O-CE2 3.41Å; T177-Y179 PolarHBondContact O-N 3.21Å; Y179-E183 HydrophobicContact CD1-CG 4.11Å; Y179-A187 HydrophobicContact CE1-CB 4.35Å
180	T	65.4	Low	61.7	Low	87 Å²	87	113.9 Å²	113.9	53%	0.534	64%	0.639	S	S	.	*			trans	-65	155.2	166.1	63.8	0	0	0	0	109.6	D182 E183 G184	T180-D182 PolarHBondContact O-N 3.03Å; T180-E183 PolarHBondContact O-N 2.85Å; T180-E183 VanDerWaalsContact O-N 3.07Å; T180-G184 PolarHBondContact O-N 3.2Å
181	C	59.3	Low	63.8	Low	112 Å²	112	113 Å²	113	76%	0.757	64%	0.636	S	S	*	*	H	α-helix	trans	-54.6	-30.1	-171	52.7	0	0	0	0	114.5	L185	C181-L185 WeakPolarHBondContact O-CG 3.22Å
182	D	61.3	Low	66	Low	134 Å²	134	110.6 Å²	110.6	72%	0.717	61%	0.611	S	S	*	*	H	α-helix	trans	-81.7	-42.4	178.7	-127.4	-99.3	0	0	0	111.9	T180	T180-D182 PolarHBondContact O-N 3.03Å
183	E	68.9	Low	68	Low	111 Å²	111	105.6 Å²	105.6	52%	0.519	59%	0.588	S	S	.	*	H	α-helix	trans	-71.5	-36.2	-178.2	-164.5	170.9	-175	0	0	111.7	Y179 T180 L185 S186 A187	Y179-E183 HydrophobicContact CD1-CG 4.11Å; T180-E183 PolarHBondContact O-N 2.85Å; T180-E183 VanDerWaalsContact O-N 3.07Å; E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 2.91Å; E183-S186 PolarHBondContact O-N 3.28Å; E183-S186 PolarHBondContact O-OG 3.36Å; E183-A187 PolarHBondContact O-N 3.41Å
184	G	68.3	Low	70.3	Confident	24 Å²	24	104.5 Å²	104.5	25%	0.247	58%	0.579	C	S	.	*	H	α-helix	trans	-66.4	-28.2	179	0	0	0	0	0	114	T180 S186 A187	T180-G184 PolarHBondContact O-N 3.2Å; G184-S186 VanDerWaalsContact C-N 3.34Å; G184-A187 PolarHBondContact O-N 3.07Å
185	L	67	Low	72.3	Confident	87 Å²	87	100.5 Å²	100.5	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-69.3	-35	175.7	-70.8	172.1	0	0	0	111.9	C181 E183 A187 L188 Q193 L196	C181-L185 WeakPolarHBondContact O-CG 3.22Å; E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 2.91Å; L185-A187 VanDerWaalsContact C-N 3.32Å; L185-L188 HydrophobicContact CD2-CD1 4.1Å; L185-Q193 PolarHBondContact O-NE2 3.41Å; L185-L196 HydrophobicContact CD2-CD1 3.77Å
186	S	69.7	Low	74.1	Confident	90 Å²	90	96.1 Å²	96.1	63%	0.629	54%	0.538	S	S	*	.	H	α-helix	trans	-74.8	-22.2	178	73.7	0	0	0	0	113.3	E183 G184	E183-S186 PolarHBondContact O-N 3.28Å; E183-S186 PolarHBondContact O-OG 3.36Å; G184-S186 VanDerWaalsContact C-N 3.34Å
187	A	76.2	Confident	75.8	Confident	58 Å²	58	97.8 Å²	97.8	48%	0.479	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.7	178	0	0	0	0	0	114.1	Y179 E183 G184 L185	Y179-A187 HydrophobicContact CE1-CB 4.35Å; E183-A187 PolarHBondContact O-N 3.41Å; G184-A187 PolarHBondContact O-N 3.07Å; L185-A187 VanDerWaalsContact C-N 3.32Å
188	L	77.3	Confident	77.2	Confident	65 Å²	65	102.3 Å²	102.3	34%	0.34	54%	0.543	S	S	.	.	S	Bend	trans	-68.4	139	176.5	-78.9	156.5	0	0	0	111.2	L185 Q193 L196	L185-L188 HydrophobicContact CD2-CD1 4.1Å; L188-Q193 HydrophobicContact CB-CG 3.67Å; L188-L196 HydrophobicContact CD1-CD1 3.64Å
189	T	86.9	Confident	78.6	Confident	99 Å²	99	97.3 Å²	97.3	61%	0.607	53%	0.525	S	S	*	.			trans	-64.2	160.3	170.2	66.1	0	0	0	0	110.5	E191 G192 Q193	T189-E191 PolarHBondContact O-N 3.32Å; T189-G192 CarbonylContact O-C 3.57Å; T189-G192 WeakPolarHBondContact O-CA 3.39Å; T189-G192 PolarHBondContact O-N 2.7Å; T189-G192 PolarHBondContact OG1-N 3.2Å; T189-Q193 PolarHBondContact O-N 3.3Å
190	Q	85	Confident	79.7	Confident	170 Å²	170	96.7 Å²	96.7	79%	0.794	53%	0.527	S	S	*	.	H	α-helix	trans	-57.1	-34.3	180	-170	170.5	27.2	0	0	112.9	A194	Q190-A194 WeakPolarHBondContact O-CB 3.44Å; Q190-A194 PolarHBondContact O-N 3.32Å; Q190-A194 VanDerWaalsContact O-N 3.09Å
191	E	88.3	Confident	80.7	Confident	155 Å²	155	94 Å²	94	72%	0.724	52%	0.516	S	S	*	.	H	α-helix	trans	-70.4	-38.8	173.3	-172.9	178.3	-178	0	0	112.1	T189 A194 T195	T189-E191 PolarHBondContact O-N 3.32Å; E191-A194 PolarHBondContact O-N 3.2Å; E191-T195 WeakPolarHBondContact O-CB 3.26Å; E191-T195 PolarHBondContact O-N 3.48Å; E191-T195 PolarHBondContact O-OG1 3.29Å
192	G	87.6	Confident	81.9	Confident	19 Å²	19	93.6 Å²	93.6	20%	0.196	50%	0.504	C	S	.	.	H	α-helix	trans	-62.7	-43.9	174.2	0	0	0	0	0	112.3	T189 T195 L196	T189-G192 CarbonylContact O-C 3.57Å; T189-G192 WeakPolarHBondContact O-CA 3.39Å; T189-G192 PolarHBondContact O-N 2.7Å; T189-G192 PolarHBondContact OG1-N 3.2Å; G192-T195 PolarHBondContact O-N 3.04Å; G192-L196 WeakPolarHBondContact O-CB 3.3Å; G192-L196 PolarHBondContact O-N 3.31Å
193	Q	88.6	Confident	82.9	Confident	91 Å²	91	92.9 Å²	92.9	43%	0.425	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-45.1	175.4	-68.8	-179.3	-16	0	0	111.8	L185 L188 T189 T195 L196 E197	L185-Q193 PolarHBondContact O-NE2 3.41Å; L188-Q193 HydrophobicContact CB-CG 3.67Å; T189-Q193 PolarHBondContact O-N 3.3Å; Q193-T195 VanDerWaalsContact C-N 3.3Å; Q193-T195 PolarHBondContact O-N 2.98Å; Q193-L196 PolarHBondContact O-N 3.42Å; Q193-E197 PolarHBondContact O-N 2.79Å
194	A	89.1	Confident	83.3	Confident	59 Å²	59	90.5 Å²	90.5	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-36	177.5	0	0	0	0	0	112.7	Q190 E191 R198	Q190-A194 WeakPolarHBondContact O-CB 3.44Å; Q190-A194 PolarHBondContact O-N 3.32Å; Q190-A194 VanDerWaalsContact O-N 3.09Å; E191-A194 PolarHBondContact O-N 3.2Å; A194-R198 PolarHBondContact O-N 2.86Å; A194-R198 VanDerWaalsContact O-N 3.15Å
195	T	90.6	Very high	83.4	Confident	73 Å²	73	95.5 Å²	95.5	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-41.4	175.4	-58	0	0	0	0	111.1	E191 G192 Q193 R198 L199	E191-T195 WeakPolarHBondContact O-CB 3.26Å; E191-T195 PolarHBondContact O-N 3.48Å; E191-T195 PolarHBondContact O-OG1 3.29Å; G192-T195 PolarHBondContact O-N 3.04Å; Q193-T195 VanDerWaalsContact C-N 3.3Å; Q193-T195 PolarHBondContact O-N 2.98Å; T195-R198 PolarHBondContact O-N 2.84Å; T195-L199 HydrophobicContact CG2-CD1 4.25Å; T195-L199 WeakPolarHBondContact O-CG 3.25Å; T195-L199 PolarHBondContact O-N 3.14Å; T195-L199 VanDerWaalsContact O-N 3.11Å
196	L	89.2	Confident	83.1	Confident	52 Å²	52	92.9 Å²	92.9	27%	0.272	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-46.9	177.5	-163.2	155.4	0	0	0	111.1	L185 L188 G192 Q193 R198 L199 E200	L185-L196 HydrophobicContact CD2-CD1 3.77Å; L188-L196 HydrophobicContact CD1-CD1 3.64Å; G192-L196 WeakPolarHBondContact O-CB 3.3Å; G192-L196 PolarHBondContact O-N 3.31Å; Q193-L196 PolarHBondContact O-N 3.42Å; L196-R198 VanDerWaalsContact C-N 3.28Å; L196-R198 PolarHBondContact O-N 3.41Å; L196-L199 WeakPolarHBondContact O-CB 3.42Å; L196-L199 PolarHBondContact O-N 3.18Å; L196-E200 VanDerWaalsContact CD2-CD 3.47Å; L196-E200 HydrophobicContact CD2-CG 3.91Å; L196-E200 VanDerWaalsContact CD2-OE1 3.26Å; L196-E200 WeakPolarHBondContact CD2-OE1 3.41Å; L196-E200 PolarHBondContact O-N 3.45Å
197	E	88.9	Confident	82.6	Confident	144 Å²	144	94.6 Å²	94.6	67%	0.673	51%	0.511	S	S	*	.	H	α-helix	trans	-58.3	-40.2	176.3	-171.9	-173.2	148.8	0	0	112	Q193 L199 E200 G201	Q193-E197 PolarHBondContact O-N 2.79Å; E197-L199 PolarHBondContact O-N 3.11Å; E197-E200 PolarHBondContact O-N 3.24Å; E197-G201 PolarHBondContact O-N 2.88Å
198	R	89.6	Confident	81.6	Confident	186 Å²	186	96.6 Å²	96.6	70%	0.702	52%	0.522	S	S	*	.	H	α-helix	trans	-62.5	-42	175.2	175	-178.8	158.7	156.3	-3.7	112	A194 T195 L196 G201 M202	A194-R198 PolarHBondContact O-N 2.86Å; A194-R198 VanDerWaalsContact O-N 3.15Å; T195-R198 PolarHBondContact O-N 2.84Å; L196-R198 VanDerWaalsContact C-N 3.28Å; L196-R198 PolarHBondContact O-N 3.41Å; R198-G201 PolarHBondContact O-N 3.44Å; R198-M202 WeakPolarHBondContact O-CG 3.2Å; R198-M202 PolarHBondContact O-N 3.23Å; R198-M202 VanDerWaalsContact O-N 3.07Å
199	L	89.6	Confident	80.6	Confident	94 Å²	94	100.4 Å²	100.4	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-67.7	-41.7	179.1	-71.3	164.5	0	0	0	111.2	T195 L196 E197 G201 M202 L203	T195-L199 HydrophobicContact CG2-CD1 4.25Å; T195-L199 WeakPolarHBondContact O-CG 3.25Å; T195-L199 PolarHBondContact O-N 3.14Å; T195-L199 VanDerWaalsContact O-N 3.11Å; L196-L199 WeakPolarHBondContact O-CB 3.42Å; L196-L199 PolarHBondContact O-N 3.18Å; E197-L199 PolarHBondContact O-N 3.11Å; L199-G201 VanDerWaalsContact C-N 3.34Å; L199-G201 PolarHBondContact O-N 3.32Å; L199-M202 PolarHBondContact O-N 3.01Å; L199-L203 PolarHBondContact O-N 3.21Å
200	E	87.1	Confident	78.9	Confident	121 Å²	121	104.5 Å²	104.5	57%	0.565	55%	0.55	S	S	*	*	H	α-helix	trans	-62	-41.8	174	-71.9	-175.3	163.1	0	0	111.6	L196 E197 M202 L203 A204	L196-E200 VanDerWaalsContact CD2-CD 3.47Å; L196-E200 HydrophobicContact CD2-CG 3.91Å; L196-E200 VanDerWaalsContact CD2-OE1 3.26Å; L196-E200 WeakPolarHBondContact CD2-OE1 3.41Å; L196-E200 PolarHBondContact O-N 3.45Å; E197-E200 PolarHBondContact O-N 3.24Å; E200-M202 VanDerWaalsContact C-N 3.32Å; E200-M202 PolarHBondContact O-N 3.41Å; E200-L203 PolarHBondContact O-N 3.07Å; E200-A204 PolarHBondContact O-N 3.43Å
201	G	85.9	Confident	77.2	Confident	29 Å²	29	104.3 Å²	104.3	30%	0.299	54%	0.543	S	S	.	.	H	α-helix	trans	-61.4	-37.1	174.2	0	0	0	0	0	113.3	E197 R198 L199 Q205	E197-G201 PolarHBondContact O-N 2.88Å; R198-G201 PolarHBondContact O-N 3.44Å; L199-G201 VanDerWaalsContact C-N 3.34Å; L199-G201 PolarHBondContact O-N 3.32Å; G201-Q205 VanDerWaalsContact O-CG 3.25Å; G201-Q205 WeakPolarHBondContact O-CG 3.37Å; G201-Q205 PolarHBondContact O-N 2.92Å; G201-Q205 PolarHBondContact O-NE2 3.49Å
202	M	85.1	Confident	75.4	Confident	105 Å²	105	106 Å²	106	52%	0.517	55%	0.551	S	S	.	*	H	α-helix	trans	-68.3	-39.7	174.5	-73.7	177.3	56.2	0	0	112.3	R198 L199 E200 Q205 S206	R198-M202 WeakPolarHBondContact O-CG 3.2Å; R198-M202 PolarHBondContact O-N 3.23Å; R198-M202 VanDerWaalsContact O-N 3.07Å; L199-M202 PolarHBondContact O-N 3.01Å; E200-M202 VanDerWaalsContact C-N 3.32Å; E200-M202 PolarHBondContact O-N 3.41Å; M202-Q205 PolarHBondContact O-N 3.49Å; M202-S206 PolarHBondContact O-N 3.11Å; M202-S206 VanDerWaalsContact O-N 3.11Å
203	L	80.9	Confident	73.2	Confident	118 Å²	118	111.5 Å²	111.5	62%	0.618	57%	0.573	S	S	*	*	H	α-helix	trans	-68.2	-40.9	175.8	-103.3	111.7	0	0	0	112.6	L199 E200 Q205 S206 V207	L199-L203 PolarHBondContact O-N 3.21Å; E200-L203 PolarHBondContact O-N 3.07Å; L203-Q205 PolarHBondContact O-N 3.45Å; L203-S206 WeakPolarHBondContact CA-OG 3.48Å; L203-S206 PolarHBondContact O-N 3.48Å; L203-S206 PolarHBondContact O-OG 3.39Å; L203-V207 WeakPolarHBondContact O-CG2 3.43Å; L203-V207 PolarHBondContact O-N 2.91Å; L203-V207 VanDerWaalsContact O-N 3.14Å
204	A	77.6	Confident	71.4	Confident	61 Å²	61	112.5 Å²	112.5	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-62.5	-34.4	176.5	0	0	0	0	0	112	E200 S208	E200-A204 PolarHBondContact O-N 3.43Å; A204-S208 PolarHBondContact O-N 3.3Å; A204-S208 PolarHBondContact O-OG 2.93Å
205	Q	70.3	Confident	69.7	Low	130 Å²	130	113.6 Å²	113.6	61%	0.607	61%	0.614	S	S	*	*	H	α-helix	trans	-72.6	-32.3	175.5	-71.2	172.4	31.7	0	0	113	G201 M202 L203 S208 Q209	G201-Q205 VanDerWaalsContact O-CG 3.25Å; G201-Q205 WeakPolarHBondContact O-CG 3.37Å; G201-Q205 PolarHBondContact O-N 2.92Å; G201-Q205 PolarHBondContact O-NE2 3.49Å; M202-Q205 PolarHBondContact O-N 3.49Å; L203-Q205 PolarHBondContact O-N 3.45Å; Q205-S208 PolarHBondContact O-N 3.15Å; Q205-Q209 PolarHBondContact O-N 3.22Å
206	S	61.9	Low	67.3	Low	32 Å²	32	115.1 Å²	115.1	22%	0.224	62%	0.623	C	S	.	*	H	α-helix	trans	-73.4	-34	177.5	62	0	0	0	0	113.1	M202 L203 S208 Q209 Y211	M202-S206 PolarHBondContact O-N 3.11Å; M202-S206 VanDerWaalsContact O-N 3.11Å; L203-S206 WeakPolarHBondContact CA-OG 3.48Å; L203-S206 PolarHBondContact O-N 3.48Å; L203-S206 PolarHBondContact O-OG 3.39Å; S206-S208 PolarHBondContact O-N 3.05Å; S206-Q209 CarbonylContact O-C 3.58Å; S206-Q209 PolarHBondContact O-N 2.96Å; S206-Y211 WeakPolarHBondContact CB-OH 3.37Å
207	V	59.2	Low	65.4	Low	125 Å²	125	123.3 Å²	123.3	76%	0.758	65%	0.65	S	S	*	*	H	α-helix	trans	-68.7	-27.7	173.6	-177.3	0	0	0	0	111.5	L203	L203-V207 WeakPolarHBondContact O-CG2 3.43Å; L203-V207 PolarHBondContact O-N 2.91Å; L203-V207 VanDerWaalsContact O-N 3.14Å
208	S	55.7	Low	63.4	Low	101 Å²	101	122.3 Å²	122.3	71%	0.706	65%	0.654	S	S	*	*	H	α-helix	trans	-77.7	-20	176.5	-52.7	0	0	0	0	113.5	A204 Q205 S206	A204-S208 PolarHBondContact O-N 3.3Å; A204-S208 PolarHBondContact O-OG 2.93Å; Q205-S208 PolarHBondContact O-N 3.15Å; S206-S208 PolarHBondContact O-N 3.05Å
209	Q	54.4	Low	61	Low	144 Å²	144	121.3 Å²	121.3	67%	0.673	66%	0.657	S	S	*	*	S	Bend	trans	-103.5	93.9	173.7	-67.7	-172	23.8	0	0	108.7	Q205 S206 Y211	Q205-Q209 PolarHBondContact O-N 3.22Å; S206-Q209 CarbonylContact O-C 3.58Å; S206-Q209 PolarHBondContact O-N 2.96Å; Q209-Y211 VanDerWaalsContact O-CD2 3.3Å; Q209-Y211 WeakPolarHBondContact O-CD2 3.4Å; Q209-Y211 PolarHBondContact O-N 3.39Å
210	Q	51.6	Low	58.9	Low	186 Å²	186	125.6 Å²	125.6	87%	0.869	68%	0.675	S	S	*	*			trans	-50.7	103.9	164.3	-155.6	173.7	-25.7	0	0	107.7	H212	Q210-H212 PolarHBondContact O-N 3.35Å
211	Y	49.8	Very low	56.6	Low	165 Å²	165	126.6 Å²	126.6	65%	0.647	69%	0.69	S	S	*	*			trans	-59.8	109.5	-170	-80.6	-96.4	0	0	0	110	S206 Q209 M213	S206-Y211 WeakPolarHBondContact CB-OH 3.37Å; Q209-Y211 VanDerWaalsContact O-CD2 3.3Å; Q209-Y211 WeakPolarHBondContact O-CD2 3.4Å; Q209-Y211 PolarHBondContact O-N 3.39Å; Y211-M213 HydrophobicContact CD1-SD 4.46Å; Y211-M213 PolarHBondContact O-N 2.96Å
212	H	50.7	Low	54.3	Low	192 Å²	192	134.1 Å²	134.1	89%	0.889	71%	0.714	S	S	*	*			trans	-66.7	92.6	150.3	-85.9	85.6	0	0	0	106.9	Q210 A214	Q210-H212 PolarHBondContact O-N 3.35Å; H212-A214 PolarHBondContact O-N 3.43Å
213	M	41	Very low	52.2	Low	133 Å²	133	135.5 Å²	135.5	66%	0.655	72%	0.724	S	S	*	*			trans	-69.1	110.2	167.9	-68.9	-68.1	-78.2	0	0	107.9	Y211 G215 V216	Y211-M213 HydrophobicContact CD1-SD 4.46Å; Y211-M213 PolarHBondContact O-N 2.96Å; M213-G215 PolarHBondContact O-N 3.09Å; M213-V216 PolarHBondContact O-N 2.86Å
214	A	50.5	Low	50.1	Low	112 Å²	112	139.4 Å²	139.4	93%	0.926	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	111.4	174.6	0	0	0	0	0	109.6	H212	H212-A214 PolarHBondContact O-N 3.43Å
215	G	54.8	Low	48.3	Very low	82 Å²	82	145.7 Å²	145.7	85%	0.845	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	119.9	-6.9	172	0	0	0	0	0	116.3	M213	M213-G215 PolarHBondContact O-N 3.09Å
216	V	40.2	Very low	46.7	Very low	105 Å²	105	148.2 Å²	148.2	64%	0.636	77%	0.767	S	S	*	*			trans	-101	105.4	172.3	-175.9	0	0	0	0	108.9	M213 T218	M213-V216 PolarHBondContact O-N 2.86Å; V216-T218 HydrophobicContact CG1-CG2 4.09Å; V216-T218 PolarHBondContact O-N 3.27Å
217	R	47.9	Very low	45.5	Very low	224 Å²	224	155.2 Å²	155.2	85%	0.845	80%	0.796	S	S	*	*			trans	-69.2	106.4	163.1	-75.4	-176.6	157.6	107.6	-1.9	107.3	E219	R217-E219 PolarHBondContact O-N 2.92Å
218	T	47.1	Very low	44.4	Very low	123 Å²	123	152.4 Å²	152.4	76%	0.755	79%	0.792	S	S	*	*			trans	-86.8	92.9	163.9	54.2	0	0	0	0	107.5	V216	V216-T218 HydrophobicContact CG1-CG2 4.09Å; V216-T218 PolarHBondContact O-N 3.27Å
219	E	40.7	Very low	43.3	Very low	166 Å²	166	156.1 Å²	156.1	78%	0.776	80%	0.801	S	S	*	*			trans	-80.7	115.5	163.3	-80	173.6	100.7	0	0	107.9	R217 T221	R217-E219 PolarHBondContact O-N 2.92Å; E219-T221 PolarHBondContact O-N 3.17Å
220	E	45.3	Very low	42.7	Very low	184 Å²	184	157 Å²	157	86%	0.86	81%	0.805	S	S	*	*			trans	-63	114.9	169.3	-68.9	176.4	98.6	0	0	109.1
221	T	38.7	Very low	42.2	Very low	142 Å²	142	154.7 Å²	154.7	87%	0.871	80%	0.803	S	S	*	*			trans	-112.9	92.9	159.8	29.7	0	0	0	0	107.2	E219	E219-T221 PolarHBondContact O-N 3.17Å
222	K	36.1	Very low	41.6	Very low	186 Å²	186	154.1 Å²	154.1	81%	0.809	81%	0.811	S	S	*	*			trans	-90.6	135.6	177.2	-172.3	175.1	178.3	178.4	0	109.2
223	D	42.5	Very low	41.4	Very low	135 Å²	135	149.6 Å²	149.6	72%	0.722	81%	0.807	S	S	*	*			trans	-43.4	138.8	-176.2	-60.8	-97.3	0	0	0	117
224	E	35.3	Very low	41.1	Very low	199 Å²	199	147.7 Å²	147.7	93%	0.93	81%	0.812	S	S	*	*			trans	-123.7	104.5	148.6	-75.7	-170.3	146.9	0	0	109.1
225	F	40.3	Very low	40.8	Very low	194 Å²	194	147.2 Å²	147.2	85%	0.851	81%	0.808	S	S	*	*			trans	-85.8	134.9	156.8	-105.7	-98.6	0	0	0	107.9
226	E	36.8	Very low	40.5	Very low	183 Å²	183	152.5 Å²	152.5	86%	0.855	81%	0.814	S	S	*	*			trans	156.2	144.1	157	-93.9	175.7	-175.4	0	0	106.7
227	E	36	Very low	40.6	Very low	178 Å²	178	156.7 Å²	156.7	83%	0.832	83%	0.826	S	S	*	*			cis	179.7	152.3	-0.9	-170.8	179.1	-159.3	0	0	105.4
228	G	36.3	Very low	40.3	Very low	67 Å²	67	150.5 Å²	150.5	69%	0.691	82%	0.823	S	S	*	*			trans	95.6	113.2	158.3	0	0	0	0	0	117.5
229	M	34.1	Very low	40.2	Very low	178 Å²	178	147.3 Å²	147.3	88%	0.877	82%	0.815	S	S	*	*				72.9	110.5	90.2	-167.2	165.2	-175	0	0	111
230	E	40.5	Very low	40.6	Very low	162 Å²	162	147.3 Å²	147.3	76%	0.757	82%	0.815	S	S	*	*				-175.2	147.2	72.1	-171.8	170.5	148	0	0	109.3
231	V	41.7	Very low	40.4	Very low	139 Å²	139	148.3 Å²	148.3	84%	0.842	82%	0.816	S	S	*	*			trans	-80.2	118.3	172.5	-79.8	0	0	0	0	109.7
232	D	38.1	Very low	40.8	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	81%	0.813	S	S	*	*			trans	-105.3	116.7	169.2	-136.7	-38.6	0	0	0	110.3
233	A	44.7	Very low	41.4	Very low	96 Å²	96	148 Å²	148	79%	0.793	81%	0.813	S	S	*	*			trans	-107.5	96.3	179.8	0	0	0	0	0	108.9
234	A	36	Very low	42	Very low	93 Å²	93	146.3 Å²	146.3	77%	0.769	82%	0.818	S	S	*	*			trans	-166.8	110.4	159.4	0	0	0	0	0	111.8
235	A	43.3	Very low	42.8	Very low	102 Å²	102	144 Å²	144	84%	0.843	81%	0.812	S	S	*	*				161.6	112.4	119.4	0	0	0	0	0	109.5
236	M	48.9	Very low	43.4	Very low	194 Å²	194	141.3 Å²	141.3	96%	0.956	81%	0.811	S	S	*	*			trans	-61.5	131.8	164.5	-68.6	175	156.2	0	0	109.7
237	E	42	Very low	44.1	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	81%	0.813	S	S	*	*			trans	-139.8	107.3	148.8	-157.2	162.4	143.5	0	0	109	G239	E237-G239 PolarHBondContact O-N 3.04Å
238	A	42.6	Very low	45	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	83%	0.829	S	S	*	*			trans	-72.8	115.1	173.6	0	0	0	0	0	108.2	Q240	A238-Q240 PolarHBondContact O-N 3.18Å; A238-Q240 VanDerWaalsContact O-N 3.13Å
239	G	44	Very low	45.4	Very low	56 Å²	56	149.2 Å²	149.2	58%	0.577	84%	0.836	S	S	*	*			trans	-60.3	113.6	172.1	0	0	0	0	0	110.7	E237 F241	E237-G239 PolarHBondContact O-N 3.04Å; G239-F241 WeakPolarHBondContact O-CD2 3.46Å; G239-F241 PolarHBondContact O-N 2.82Å
240	Q	49	Very low	46	Very low	166 Å²	166	147.7 Å²	147.7	78%	0.776	83%	0.834	S	S	*	*			trans	-56.1	118.9	165	-78.5	172.7	-36.6	0	0	110	A238	A238-Q240 PolarHBondContact O-N 3.18Å; A238-Q240 VanDerWaalsContact O-N 3.13Å
241	F	40.7	Very low	46.3	Very low	204 Å²	204	146.9 Å²	146.9	90%	0.895	84%	0.838	S	S	*	*			trans	-117.7	97	153.8	-48.1	-81.8	0	0	0	105.3	G239	G239-F241 WeakPolarHBondContact O-CD2 3.46Å; G239-F241 PolarHBondContact O-N 2.82Å
242	E	47.6	Very low	46.6	Very low	171 Å²	171	147.4 Å²	147.4	80%	0.799	84%	0.838	S	S	*	*			trans	-84.3	137.2	177	-148	154.7	95.9	0	0	108.5
243	D	49.2	Very low	47.1	Very low	151 Å²	151	147 Å²	147	81%	0.807	84%	0.839	S	S	*	*			trans	-42.2	141.9	179.9	-84.5	-61.2	0	0	0	114.9
244	A	55.3	Low	47.3	Very low	100 Å²	100	150.4 Å²	150.4	83%	0.826	84%	0.842	S	S	*	*			trans	-137	117.2	152.1	0	0	0	0	0	108.8
245	D	52.1	Low	48.1	Very low	151 Å²	151	154.5 Å²	154.5	81%	0.807	85%	0.847	S	S	*	*			trans	-60.2	150.6	-165.8	-70.8	-73.6	0	0	0	116.3
246	V	52.5	Low	48.5	Very low	136 Å²	136	158.5 Å²	158.5	82%	0.824	85%	0.847	S	S	*	*			trans	-74.2	123.4	157	165.8	0	0	0	0	108.5
247	E	51.9	Low	48.4	Very low	193 Å²	193	155.6 Å²	155.6	90%	0.902	84%	0.838	S	S	*	*			trans	-114.7	137.6	160.5	-152.6	175.2	128.4	0	0	110
248	H	54.2	Low	49	Very low	252 Å²	252	152.2 Å²	152.2	100%	1.167	83%	0.833	S	S	*	*			trans	-67.4	0	-175.5	-91.8	103	0	0	0	114.2

Retrieved 248 of 248 residues in 412.7 ms (Link to these results)

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