A0A077ZHG5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHG5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 130 aa.

						>A0A077ZHG5_TRITR|A0A077ZHG5
MRIYVRGRLERVTKSLTPELFDWQPDVTRRYVHGRPERVAESLTSELFDWQPDVTRRYVHGRPERVAESLTSELFDWQPDVTRRYAHRRPERVAESLTSELFDWQPDVMHHLVTLVEAVLAAEILASLFK
					

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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	26.3	Very low	31.8	Very low	172 Å²	172	154.6 Å²	154.6	85%	0.847	68%	0.68	S	S	*	*				0	118.3	0	176.7	164.9	138.2	0	0	108.7	P25	M1-P25 HydrophobicContact CB-CB 4.47Å; M1-P25 HydrophobicContact CB-CG 4.35Å; M1-P25 WeakPolarHBondContact O-CB 3.24Å; M1-P25 WeakPolarHBondContact O-CG 3.38Å
2	R	29.5	Very low	31.9	Very low	191 Å²	191	145.5 Å²	145.5	72%	0.721	65%	0.647	S	S	*	*			trans	-89.9	112.1	-177.3	-71	179.5	179.8	158.7	1.8	110.3	Y4	R2-Y4 HydrophobicContact CB-CD2 4.34Å; R2-Y4 HydrophobicContact CB-CE2 3.7Å
3	I	29.8	Very low	32	Very low	104 Å²	104	144.5 Å²	144.5	53%	0.533	66%	0.659	S	S	.	*			trans	-85.7	114.3	175.1	-56.7	175.1	0	0	0	108.8	V5	I3-V5 HydrophobicContact CG2-CG2 4Å
4	Y	30.9	Very low	32.5	Very low	145 Å²	145	141.8 Å²	141.8	57%	0.569	65%	0.645	S	S	*	*			trans	-98.1	104.8	174	-66.5	-87.2	0	0	0	110	R2	R2-Y4 HydrophobicContact CB-CD2 4.34Å; R2-Y4 HydrophobicContact CB-CE2 3.7Å
5	V	35.2	Very low	32.8	Very low	74 Å²	74	138.1 Å²	138.1	45%	0.448	64%	0.643	S	S	.	*			trans	-91.8	104	172.1	-175.3	0	0	0	0	108.8	I3	I3-V5 HydrophobicContact CG2-CG2 4Å
6	R	33	Very low	33.3	Very low	254 Å²	254	135.6 Å²	135.6	96%	0.958	63%	0.634	S	S	*	*			trans	-93.2	101.9	169.1	-167.6	178.8	-174.8	-174.4	1.5	108.2
7	G	36.7	Very low	33.6	Very low	41 Å²	41	134.4 Å²	134.4	42%	0.423	64%	0.639	S	S	.	*			trans	-121.4	132.6	179.5	0	0	0	0	0	112.3
8	R	31.9	Very low	34.1	Very low	232 Å²	232	129.4 Å²	129.4	88%	0.875	62%	0.619	S	S	*	*			trans	-80.5	121.4	160.5	-176.2	178.2	177.4	170.3	-1.7	106.7	E10	R8-E10 PolarHBondContact O-N 3.13Å
9	L	36.1	Very low	34.3	Very low	78 Å²	78	131.4 Å²	131.4	41%	0.408	63%	0.628	S	S	.	*			trans	-102.7	75.6	-159.6	-131	151.4	0	0	0	111.4	R11 V12 Y31	L9-R11 PolarHBondContact O-N 3.33Å; L9-V12 HydrophobicContact CB-CG2 4.36Å; L9-V12 HydrophobicContact CD1-CB 4.39Å; L9-V12 HydrophobicContact CD1-CG2 4.46Å; L9-V12 HydrophobicContact CD2-CB 3.55Å; L9-V12 HydrophobicContact CD2-CG2 3.77Å; L9-V12 VanDerWaalsContact CD2-N 3.29Å; L9-V12 HydrophobicContact CG-CB 3.7Å; L9-V12 HydrophobicContact CG-CG2 3.49Å; L9-V12 VanDerWaalsContact CG-CG2 3.49Å; L9-Y31 HydrophobicContact CD1-CD1 3.95Å; L9-Y31 HydrophobicContact CD1-CE1 4.02Å
10	E	30	Very low	34.1	Very low	172 Å²	172	132.9 Å²	132.9	80%	0.804	64%	0.639	S	S	*	*	S	Bend	trans	-85.6	92	155.3	-75.3	-178.2	-168.9	0	0	106.2	R8	R8-E10 PolarHBondContact O-N 3.13Å
11	R	30.7	Very low	34.2	Very low	238 Å²	238	133.1 Å²	133.1	90%	0.898	64%	0.637	S	S	*	*	S	Bend	trans	51	83.4	-179.7	-105.3	179.2	161	-176.7	-5.6	114.2	L9 T13	L9-R11 PolarHBondContact O-N 3.33Å; R11-T13 PolarHBondContact O-N 3.34Å
12	V	33.3	Very low	34.7	Very low	45 Å²	45	133 Å²	133	27%	0.273	64%	0.64	S	S	.	*			trans	-95.8	89.9	170.8	178.5	0	0	0	0	109.1	L9 K14	L9-V12 HydrophobicContact CB-CG2 4.36Å; L9-V12 HydrophobicContact CD1-CB 4.39Å; L9-V12 HydrophobicContact CD1-CG2 4.46Å; L9-V12 HydrophobicContact CD2-CB 3.55Å; L9-V12 HydrophobicContact CD2-CG2 3.77Å; L9-V12 VanDerWaalsContact CD2-N 3.29Å; L9-V12 HydrophobicContact CG-CB 3.7Å; L9-V12 HydrophobicContact CG-CG2 3.49Å; L9-V12 VanDerWaalsContact CG-CG2 3.49Å; V12-K14 HydrophobicContact CG1-CB 3.96Å; V12-K14 HydrophobicContact CG1-CD 3.47Å; V12-K14 VanDerWaalsContact CG1-CD 3.47Å; V12-K14 HydrophobicContact CG1-CG 3.47Å; V12-K14 VanDerWaalsContact CG1-CG 3.47Å; V12-K14 PolarHBondContact O-N 3.44Å
13	T	32.4	Very low	35	Very low	132 Å²	132	130.9 Å²	130.9	81%	0.81	63%	0.632	S	S	*	*			trans	-81.3	101.4	154.1	43.9	0	0	0	0	107	R11	R11-T13 PolarHBondContact O-N 3.34Å
14	K	39.3	Very low	35.7	Very low	107 Å²	107	127 Å²	127	47%	0.465	61%	0.612	S	S	.	*			trans	-114.3	99	171.3	-87.9	176.1	-173.5	-172.7	0	108.6	V12 L16	V12-K14 HydrophobicContact CG1-CB 3.96Å; V12-K14 HydrophobicContact CG1-CD 3.47Å; V12-K14 VanDerWaalsContact CG1-CD 3.47Å; V12-K14 HydrophobicContact CG1-CG 3.47Å; V12-K14 VanDerWaalsContact CG1-CG 3.47Å; V12-K14 PolarHBondContact O-N 3.44Å; K14-L16 PolarHBondContact O-N 2.93Å
15	S	37.3	Very low	36.3	Very low	87 Å²	87	121.6 Å²	121.6	61%	0.608	59%	0.594	S	S	*	*			trans	-73.2	114.2	157.6	49.5	0	0	0	0	107.3
16	L	40.9	Very low	36.8	Very low	97 Å²	97	121.8 Å²	121.8	51%	0.508	59%	0.593	S	S	.	*			trans	-92	105.7	162.8	-70.2	169	0	0	0	105.2	K14 P18	K14-L16 PolarHBondContact O-N 2.93Å; L16-P18 WeakPolarHBondContact O-CD 3.5Å
17	T	37.3	Very low	37.5	Very low	115 Å²	115	111.3 Å²	111.3	71%	0.706	56%	0.557	S	S	*	*			trans	-85.6	103.4	159.9	41.5	0	0	0	0	106	E19	T17-E19 PolarHBondContact O-N 3.28Å
18	P	44	Very low	37.9	Very low	45 Å²	45	111.2 Å²	111.2	29%	0.292	55%	0.548	S	S	.	.			trans	-74.2	116.7	175.7	11	4	0	0	0	108	L16 F48	L16-P18 WeakPolarHBondContact O-CD 3.5Å; P18-F48 HydrophobicContact CB-CZ 4.12Å; P18-F48 HydrophobicContact CG-CE2 4.08Å; P18-F48 HydrophobicContact CG-CZ 4.07Å
19	E	36.7	Very low	38.7	Very low	168 Å²	168	101.6 Å²	101.6	79%	0.785	51%	0.512	S	S	*	.			trans	-56.7	139.8	162.4	-67	178.4	164.5	0	0	108.6	T17 F21	T17-E19 PolarHBondContact O-N 3.28Å; E19-F21 WeakPolarHBondContact O-CD2 3.39Å; E19-F21 PolarHBondContact O-N 3.4Å
20	L	31.8	Very low	39	Very low	161 Å²	161	103.9 Å²	103.9	84%	0.843	52%	0.515	S	S	*	.			trans	-41.8	115.7	-171.1	-76.6	102.3	0	0	0	114.2
21	F	35.9	Very low	40	Very low	137 Å²	137	98.1 Å²	98.1	60%	0.601	49%	0.486	S	S	*	.			trans	-129.2	129.1	162.8	-71.8	-79.6	0	0	0	108.8	E19 W23 F48	E19-F21 WeakPolarHBondContact O-CD2 3.39Å; E19-F21 PolarHBondContact O-N 3.4Å; F21-W23 PolarHBondContact O-N 3.05Å; F21-F48 WeakPolarHBondContact O-CD1 3.33Å; F21-F48 WeakPolarHBondContact O-CE1 3.27Å
22	D	35.5	Very low	40.5	Very low	170 Å²	170	90 Å²	90	91%	0.909	46%	0.463	S	S	*	.	S	Bend	trans	-57.8	-13.2	174.6	-61.5	-24.3	0	0	0	113.4
23	W	36.6	Very low	41.3	Very low	147 Å²	147	94.3 Å²	94.3	56%	0.557	48%	0.48	S	S	*	.	S	Bend	trans	-149.1	124.7	175.9	-176.5	82.4	0	0	0	110.1	F21 P25 W50	F21-W23 PolarHBondContact O-N 3.05Å; W23-P25 HydrophobicContact CH2-CB 3.78Å; W23-P25 HydrophobicContact CZ3-CB 3.71Å; W23-P25 HydrophobicContact CZ3-CG 4.48Å; W23-W50 AromaticContact CD1-CE3 3.88Å; W23-W50 AromaticContact NE1-CE3 3.76Å; W23-W50 AromaticContact NE1-CZ3 3.46Å
24	Q	44.9	Very low	41.7	Very low	23 Å²	23	90.1 Å²	90.1	11%	0.107	46%	0.463	C	S	.	.			trans	-99.2	142.4	169.2	-70.4	-169.6	12.2	0	0	111.2	F48 W50 P52	Q24-F48 HydrophobicContact CG-CE1 4.43Å; Q24-W50 WeakPolarHBondContact O-CZ3 3.22Å; Q24-P52 HydrophobicContact CB-CB 4.3Å; Q24-P52 HydrophobicContact CB-CG 3.66Å
25	P	42.6	Very low	41.9	Very low	30 Å²	30	94.4 Å²	94.4	20%	0.195	48%	0.476	C	S	.	.			trans	-77.9	148.8	175.1	30.7	-33.9	0	0	0	112.8	M1 W23 V27 P52	M1-P25 HydrophobicContact CB-CB 4.47Å; M1-P25 HydrophobicContact CB-CG 4.35Å; M1-P25 WeakPolarHBondContact O-CB 3.24Å; M1-P25 WeakPolarHBondContact O-CG 3.38Å; W23-P25 HydrophobicContact CH2-CB 3.78Å; W23-P25 HydrophobicContact CZ3-CB 3.71Å; W23-P25 HydrophobicContact CZ3-CG 4.48Å; P25-V27 PolarHBondContact O-N 2.86Å; P25-P52 VanDerWaalsContact C-CB 3.44Å; P25-P52 VanDerWaalsContact O-CB 3.32Å; P25-P52 WeakPolarHBondContact O-CB 3.36Å
26	D	47	Very low	42.1	Very low	78 Å²	78	92.4 Å²	92.4	42%	0.417	46%	0.461	S	S	.	.			trans	-40.6	123.2	169.9	-57.2	-21.6	0	0	0	112.5	T28	D26-T28 PolarHBondContact O-N 3.4Å
27	V	46.7	Very low	42.3	Very low	35 Å²	35	94.4 Å²	94.4	21%	0.212	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	97.5	-178.4	-175.9	0	0	0	0	108.6	P25 R29 P52 D53 T55	P25-V27 PolarHBondContact O-N 2.86Å; V27-R29 HydrophobicContact CG1-CG 3.87Å; V27-P52 HydrophobicContact CG2-CG 4.18Å; V27-D53 PolarHBondContact N-O 3.42Å; V27-T55 PolarHBondContact O-N 3.44Å; V27-T55 VanDerWaalsContact O-N 3.1Å
28	T	44.8	Very low	42.7	Very low	38 Å²	38	97.2 Å²	97.2	23%	0.233	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	105	169.7	-58.4	0	0	0	0	110.9	D26 R30 T55	D26-T28 PolarHBondContact O-N 3.4Å; T28-R30 HydrophobicContact CG2-CG 4.44Å; T28-T55 CarbonylContact C-O 3.59Å; T28-T55 VanDerWaalsContact CA-O 3.31Å; T28-T55 WeakPolarHBondContact CA-O 3.41Å; T28-T55 HydrophobicContact CG2-CG2 4.47Å
29	R	49.6	Very low	42.9	Very low	30 Å²	30	95.9 Å²	95.9	11%	0.113	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.7	172.8	-56.9	-169.2	-177.6	170.4	-5.6	110.2	V27 Y31 E41 T55 R56 R57	V27-R29 HydrophobicContact CG1-CG 3.87Å; R29-Y31 HydrophobicContact CB-CD2 4.44Å; R29-Y31 HydrophobicContact CB-CE2 3.71Å; R29-Y31 WeakPolarHBondContact CD-OH 3.22Å; R29-E41 IonicContact CZ-OE2 3.67Å; R29-E41 IonicContact NH1-OE2 3.18Å; R29-E41 PolarHBondContact NH1-OE2 2.87Å; R29-T55 PolarHBondContact N-O 2.91Å; R29-R56 WeakPolarHBondContact O-CA 3.27Å; R29-R57 PolarHBondContact O-N 2.96Å
30	R	42.6	Very low	43.2	Very low	126 Å²	126	91.3 Å²	91.3	48%	0.475	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	109.4	171.8	-68.5	-171.2	179.4	-175.3	2.2	109.3	T28 R57	T28-R30 HydrophobicContact CG2-CG 4.44Å; R30-R57 HydrophobicContact CG-CB 4.19Å
31	Y	50.9	Low	44.1	Very low	52 Å²	52	84.4 Å²	84.4	20%	0.204	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	117.9	172.6	-61.6	-73.7	0	0	0	108.6	L9 R29 E41 R57 Y58 V59	L9-Y31 HydrophobicContact CD1-CD1 3.95Å; L9-Y31 HydrophobicContact CD1-CE1 4.02Å; R29-Y31 HydrophobicContact CB-CD2 4.44Å; R29-Y31 HydrophobicContact CB-CE2 3.71Å; R29-Y31 WeakPolarHBondContact CD-OH 3.22Å; Y31-E41 WeakPolarHBondContact CE2-OE1 3.47Å; Y31-E41 PolarHBondContact OH-OE1 3.24Å; Y31-E41 PolarHBondContact OH-OE2 3.46Å; Y31-R57 PolarHBondContact N-O 2.96Å; Y31-Y58 AromaticContact CD2-CD1 3.79Å; Y31-Y58 HydrophobicContact CD2-CD1 3.79Å; Y31-Y58 AromaticContact CD2-CE1 3.38Å; Y31-Y58 HydrophobicContact CD2-CE1 3.38Å; Y31-Y58 AromaticContact CD2-CZ 3.88Å; Y31-Y58 AromaticContact CE2-CE1 3.94Å; Y31-Y58 HydrophobicContact CE2-CE1 3.94Å; Y31-Y58 HydrophobicContact CG-CD1 4.1Å; Y31-Y58 AromaticContact CG-CE1 3.96Å; Y31-Y58 HydrophobicContact CG-CE1 3.96Å; Y31-V59 PolarHBondContact O-N 2.89Å
32	V	40.8	Very low	44.5	Very low	67 Å²	67	80.7 Å²	80.7	41%	0.406	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.5	176.9	-156.3	0	0	0	0	108.3	V59	V32-V59 CarbonylContact C-O 3.47Å; V32-V59 WeakPolarHBondContact CA-O 3.45Å; V32-V59 HydrophobicContact CG1-CB 4.08Å; V32-V59 HydrophobicContact CG1-CG1 4.15Å; V32-V59 HydrophobicContact CG2-CB 4.38Å
33	H	49.5	Very low	45.2	Very low	135 Å²	135	73.6 Å²	73.6	63%	0.625	36%	0.364	S	S	*	.			trans	99.3	144.9	161.8	-49.1	-69.3	0	0	0	122.1	V59 H60	H33-V59 PolarHBondContact N-O 3Å; H33-H60 CarbonylContact C-O 3.23Å; H33-H60 VanDerWaalsContact C-O 3.23Å; H33-H60 WeakPolarHBondContact CA-O 2.98Å; H33-H60 AromaticContact CE1-CD2 3.84Å; H33-H60 AromaticContact ND1-CD2 3.91Å
34	G	42.1	Very low	45.8	Very low	45 Å²	45	69.3 Å²	69.3	46%	0.464	35%	0.354	S	S	.	.	S	Bend	trans	93.2	143	166	0	0	0	0	0	113.3	P36 H60 G61	G34-P36 WeakPolarHBondContact O-CD 3.47Å; G34-P36 WeakPolarHBondContact O-CG 3.37Å; G34-H60 PolarHBondContact N-O 3.04Å; G34-G61 VanDerWaalsContact O-CA 3.22Å; G34-G61 WeakPolarHBondContact O-CA 2.94Å
35	R	42.2	Very low	45.9	Very low	197 Å²	197	68.5 Å²	68.5	74%	0.743	35%	0.351	S	S	*	.			trans	-71.7	99.4	172.2	-70.1	-178.3	-177.1	-177.1	2.9	109.4	R62	R35-R62 HydrophobicContact CG-CB 4.46Å
36	P	42.4	Very low	45.9	Very low	45 Å²	45	73.7 Å²	73.7	29%	0.292	37%	0.373	S	S	.	.			trans	-98.2	119.2	178.9	14.2	9.5	0	0	0	107.7	G34 R38 V39 P63	G34-P36 WeakPolarHBondContact O-CD 3.47Å; G34-P36 WeakPolarHBondContact O-CG 3.37Å; P36-R38 PolarHBondContact O-N 3.08Å; P36-V39 HydrophobicContact CB-CG2 4.47Å; P36-V39 HydrophobicContact CG-CG2 4.33Å; P36-P63 VanDerWaalsContact O-CA 3.24Å; P36-P63 WeakPolarHBondContact O-CA 2.9Å
37	E	43.6	Very low	45.5	Very low	139 Å²	139	75.6 Å²	75.6	65%	0.65	38%	0.382	S	S	*	.	S	Bend	trans	-56.8	-28.8	179.1	-73.5	174.9	-176.4	0	0	112.6	R65	E37-R65 PolarHBondContact O-N 3.44Å
38	R	46.5	Very low	45.4	Very low	174 Å²	174	74.9 Å²	74.9	66%	0.657	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	134.9	-179	-58.4	-175.9	-179.7	166.1	2.2	112.4	P36 R65	P36-R38 PolarHBondContact O-N 3.08Å; R38-R65 WeakPolarHBondContact CA-O 3.47Å; R38-R65 HydrophobicContact CG-CB 4.38Å
39	V	47.6	Very low	45.2	Very low	17 Å²	17	79.9 Å²	79.9	10%	0.103	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.7	165.2	179.5	0	0	0	0	107.3	P36 E41 P63 R65 V66 A67	P36-V39 HydrophobicContact CB-CG2 4.47Å; P36-V39 HydrophobicContact CG-CG2 4.33Å; V39-E41 HydrophobicContact CG1-CG 4.22Å; V39-P63 HydrophobicContact CG2-CB 4.16Å; V39-R65 PolarHBondContact N-O 2.84Å; V39-V66 HydrophobicContact CB-CG2 4.39Å; V39-V66 WeakPolarHBondContact O-CA 3.18Å; V39-A67 PolarHBondContact O-N 3.45Å
40	A	43.8	Very low	44.8	Very low	72 Å²	72	82.6 Å²	82.6	60%	0.595	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.6	173.4	0	0	0	0	0	108.8	A67	A40-A67 CarbonylContact C-O 3.59Å; A40-A67 VanDerWaalsContact CA-O 3.27Å; A40-A67 WeakPolarHBondContact CA-O 3.17Å
41	E	50.5	Low	45.2	Very low	16 Å²	16	77.1 Å²	77.1	8%	0.075	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	120.1	178.1	-71	-177.1	-132.5	0	0	109.7	R29 Y31 V39 R56 Y58 A67 E68 S69	R29-E41 IonicContact CZ-OE2 3.67Å; R29-E41 IonicContact NH1-OE2 3.18Å; R29-E41 PolarHBondContact NH1-OE2 2.87Å; Y31-E41 WeakPolarHBondContact CE2-OE1 3.47Å; Y31-E41 PolarHBondContact OH-OE1 3.24Å; Y31-E41 PolarHBondContact OH-OE2 3.46Å; V39-E41 HydrophobicContact CG1-CG 4.22Å; E41-R56 IonicContact OE2-CZ 3.38Å; E41-R56 IonicContact OE2-NE 2.99Å; E41-R56 IonicContact OE2-NH1 3.37Å; E41-R56 PolarHBondContact OE2-NH1 3.36Å; E41-Y58 PolarHBondContact OE1-OH 2.83Å; E41-A67 PolarHBondContact N-O 3.19Å; E41-E68 WeakPolarHBondContact O-CA 3.13Å; E41-S69 PolarHBondContact O-N 3.49Å
42	S	45.1	Very low	45.2	Very low	58 Å²	58	74.8 Å²	74.8	41%	0.406	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.8	169.6	57.4	0	0	0	0	109.5	S69	S42-S69 CarbonylContact C-O 3.59Å; S42-S69 WeakPolarHBondContact CA-O 3.28Å; S42-S69 WeakPolarHBondContact CA-OG 3.49Å; S42-S69 VanDerWaalsContact CB-OG 3.29Å; S42-S69 WeakPolarHBondContact CB-OG 3.4Å
43	L	50.4	Low	45.7	Very low	21 Å²	21	74.3 Å²	74.3	11%	0.11	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	111.5	169.9	-95.1	143.2	0	0	0	107.1	R56 S69 L70 T71	L43-R56 VanDerWaalsContact CD1-NH2 3.25Å; L43-S69 PolarHBondContact N-O 2.96Å; L43-L70 HydrophobicContact CB-CD2 3.46Å; L43-L70 VanDerWaalsContact CB-CD2 3.46Å; L43-L70 HydrophobicContact CB-CG 4.44Å; L43-L70 HydrophobicContact CD1-CD2 4.06Å; L43-L70 HydrophobicContact CG-CD2 4.35Å; L43-T71 PolarHBondContact O-N 3.37Å; L43-T71 PolarHBondContact O-OG1 2.91Å
44	T	47.6	Very low	45.8	Very low	57 Å²	57	68.2 Å²	68.2	35%	0.35	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.2	172.4	47.1	0	0	0	0	106.9	T71	T44-T71 WeakPolarHBondContact CA-O 3.42Å; T44-T71 WeakPolarHBondContact CG2-OG1 3.29Å
45	S	47.7	Very low	46.2	Very low	7 Å²	7	67.6 Å²	67.6	5%	0.049	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.7	169.2	-61.3	0	0	0	0	108.1	Q51 T71	S45-Q51 PolarHBondContact OG-NE2 3.48Å; S45-T71 PolarHBondContact N-O 3.43Å
46	E	42.7	Very low	46.9	Very low	138 Å²	138	58.2 Å²	58.2	65%	0.645	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.2	169.5	-66.2	173.6	-172.2	0	0	106.7	F48	E46-F48 VanDerWaalsContact O-CE2 3.29Å; E46-F48 WeakPolarHBondContact O-CE2 3.37Å
47	L	38.4	Very low	47.3	Very low	119 Å²	119	59.9 Å²	59.9	62%	0.623	30%	0.303	S	S	*	.	S	Bend	trans	68.3	79.6	161.9	-55.5	163.5	0	0	0	117.9
48	F	44.3	Very low	47.8	Very low	19 Å²	19	54.3 Å²	54.3	8%	0.083	28%	0.276	C	S	.	.			trans	-141.4	148.2	160.5	-52.3	-86.8	0	0	0	111.9	P18 F21 Q24 E46 W50 F75	P18-F48 HydrophobicContact CB-CZ 4.12Å; P18-F48 HydrophobicContact CG-CE2 4.08Å; P18-F48 HydrophobicContact CG-CZ 4.07Å; F21-F48 WeakPolarHBondContact O-CD1 3.33Å; F21-F48 WeakPolarHBondContact O-CE1 3.27Å; Q24-F48 HydrophobicContact CG-CE1 4.43Å; E46-F48 VanDerWaalsContact O-CE2 3.29Å; E46-F48 WeakPolarHBondContact O-CE2 3.37Å; F48-W50 PolarHBondContact O-N 2.99Å; F48-F75 HydrophobicContact CB-CD1 4.39Å; F48-F75 HydrophobicContact CB-CE1 3.8Å; F48-F75 HydrophobicContact CD2-CE1 4.05Å; F48-F75 HydrophobicContact CD2-CZ 4.38Å; F48-F75 HydrophobicContact CG-CE1 4.43Å; F48-F75 WeakPolarHBondContact O-CD1 3.24Å; F48-F75 VanDerWaalsContact O-CE1 3.3Å; F48-F75 WeakPolarHBondContact O-CE1 3.4Å
49	D	40.4	Very low	47.9	Very low	144 Å²	144	47.9 Å²	47.9	77%	0.77	26%	0.256	S	S	*	.	S	Bend	trans	-69.3	-19.7	172.4	-67.5	-17.8	0	0	0	112.1
50	W	41	Very low	47.8	Very low	87 Å²	87	50.2 Å²	50.2	33%	0.33	27%	0.265	S	S	.	.			trans	-147.8	127.1	-178.9	-171.5	75.7	0	0	0	111.6	W23 Q24 F48 P52	W23-W50 AromaticContact CD1-CE3 3.88Å; W23-W50 AromaticContact NE1-CE3 3.76Å; W23-W50 AromaticContact NE1-CZ3 3.46Å; Q24-W50 WeakPolarHBondContact O-CZ3 3.22Å; F48-W50 PolarHBondContact O-N 2.99Å; W50-P52 HydrophobicContact CH2-CB 4.4Å; W50-P52 HydrophobicContact CZ3-CB 4.07Å
51	Q	50.8	Low	47.9	Very low	10 Å²	10	48.2 Å²	48.2	5%	0.047	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-94.3	139.5	171.1	-107.6	-175.5	-16.2	0	0	110.9	S45 S72 F75 P79	S45-Q51 PolarHBondContact OG-NE2 3.48Å; Q51-S72 PolarHBondContact NE2-OG 2.85Å; Q51-S72 PolarHBondContact OE1-OG 3.15Å; Q51-F75 HydrophobicContact CB-CD1 4.49Å; Q51-F75 HydrophobicContact CG-CD1 4.07Å; Q51-F75 HydrophobicContact CG-CE1 3.7Å; Q51-F75 HydrophobicContact CG-CZ 4.23Å; Q51-P79 HydrophobicContact CB-CB 4.04Å; Q51-P79 HydrophobicContact CB-CG 3.79Å; Q51-P79 HydrophobicContact CG-CG 4.45Å
52	P	50.8	Low	47.8	Very low	4 Å²	4	55.5 Å²	55.5	3%	0.026	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76.6	144.5	-179.9	29.9	-33.5	0	0	0	112.5	Q24 P25 V27 W50 V54 P79	Q24-P52 HydrophobicContact CB-CB 4.3Å; Q24-P52 HydrophobicContact CB-CG 3.66Å; P25-P52 VanDerWaalsContact C-CB 3.44Å; P25-P52 VanDerWaalsContact O-CB 3.32Å; P25-P52 WeakPolarHBondContact O-CB 3.36Å; V27-P52 HydrophobicContact CG2-CG 4.18Å; W50-P52 HydrophobicContact CH2-CB 4.4Å; W50-P52 HydrophobicContact CZ3-CB 4.07Å; P52-V54 PolarHBondContact O-N 3.45Å; P52-P79 WeakPolarHBondContact O-CB 3.05Å
53	D	52.1	Low	47.8	Very low	57 Å²	57	53.5 Å²	53.5	31%	0.305	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-56.4	132.2	176.2	-73	-20.7	0	0	0	111.5	V27 D80	V27-D53 PolarHBondContact N-O 3.42Å; D53-D80 PolarHBondContact OD1-N 3.05Å
54	V	51.8	Low	47.6	Very low	7 Å²	7	57.5 Å²	57.5	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	100.3	-178.4	-175.8	0	0	0	0	109	P52 R56 D80 T82	P52-V54 PolarHBondContact O-N 3.45Å; V54-R56 HydrophobicContact CG1-CG 3.99Å; V54-D80 PolarHBondContact N-O 3.38Å; V54-D80 VanDerWaalsContact N-O 3.09Å; V54-T82 PolarHBondContact O-N 2.99Å; V54-T82 VanDerWaalsContact O-N 3.08Å
55	T	51.4	Low	47.5	Very low	31 Å²	31	60 Å²	60	19%	0.19	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117.1	172.5	-64	0	0	0	0	111.1	V27 T28 R29 T82	V27-T55 PolarHBondContact O-N 3.44Å; V27-T55 VanDerWaalsContact O-N 3.1Å; T28-T55 CarbonylContact C-O 3.59Å; T28-T55 VanDerWaalsContact CA-O 3.31Å; T28-T55 WeakPolarHBondContact CA-O 3.41Å; T28-T55 HydrophobicContact CG2-CG2 4.47Å; R29-T55 PolarHBondContact N-O 2.91Å; T55-T82 CarbonylContact C-O 3.16Å; T55-T82 WeakPolarHBondContact CA-O 3.37Å; T55-T82 HydrophobicContact CG2-CG2 4.48Å
56	R	55.5	Low	47.6	Very low	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.1	177	-55	-175.4	-168	-176.2	5.4	110.9	R29 E41 L43 V54 Y58 E68 T82 R84	R29-R56 WeakPolarHBondContact O-CA 3.27Å; E41-R56 IonicContact OE2-CZ 3.38Å; E41-R56 IonicContact OE2-NE 2.99Å; E41-R56 IonicContact OE2-NH1 3.37Å; E41-R56 PolarHBondContact OE2-NH1 3.36Å; L43-R56 VanDerWaalsContact CD1-NH2 3.25Å; V54-R56 HydrophobicContact CG1-CG 3.99Å; R56-Y58 HydrophobicContact CB-CE2 3.88Å; R56-E68 IonicContact CZ-OE1 2.72Å; R56-E68 IonicContact CZ-OE2 2.74Å; R56-E68 VanDerWaalsContact NH1-CG 3.26Å; R56-E68 IonicContact NH1-OE1 3.43Å; R56-E68 PolarHBondContact NH1-OE1 2.87Å; R56-E68 IonicContact NH1-OE2 3.14Å; R56-E68 PolarHBondContact NH1-OE2 3.43Å; R56-T82 PolarHBondContact N-O 3.06Å; R56-R84 PolarHBondContact O-N 2.93Å
57	R	52.2	Low	47.6	Very low	80 Å²	80	55.2 Å²	55.2	30%	0.302	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.5	174.6	-76.8	-179.7	-176.8	-159.3	3.4	110.2	R29 R30 Y31 R84	R29-R57 PolarHBondContact O-N 2.96Å; R30-R57 HydrophobicContact CG-CB 4.19Å; Y31-R57 PolarHBondContact N-O 2.96Å; R57-R84 CarbonylContact C-O 3.42Å; R57-R84 WeakPolarHBondContact CA-O 3.36Å; R57-R84 HydrophobicContact CG-CB 3.78Å
58	Y	53.7	Low	48.2	Very low	22 Å²	22	49.8 Å²	49.8	9%	0.086	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115.2	176.4	-62.8	-83.2	0	0	0	110.4	Y31 E41 R56 E68 R84 Y85 A86	Y31-Y58 AromaticContact CD2-CD1 3.79Å; Y31-Y58 HydrophobicContact CD2-CD1 3.79Å; Y31-Y58 AromaticContact CD2-CE1 3.38Å; Y31-Y58 HydrophobicContact CD2-CE1 3.38Å; Y31-Y58 AromaticContact CD2-CZ 3.88Å; Y31-Y58 AromaticContact CE2-CE1 3.94Å; Y31-Y58 HydrophobicContact CE2-CE1 3.94Å; Y31-Y58 HydrophobicContact CG-CD1 4.1Å; Y31-Y58 AromaticContact CG-CE1 3.96Å; Y31-Y58 HydrophobicContact CG-CE1 3.96Å; E41-Y58 PolarHBondContact OE1-OH 2.83Å; R56-Y58 HydrophobicContact CB-CE2 3.88Å; Y58-E68 PolarHBondContact OH-OE1 3.14Å; Y58-E68 VanDerWaalsContact OH-OE1 3.06Å; Y58-R84 PolarHBondContact N-O 3.06Å; Y58-Y85 AromaticContact CD2-CD1 3.78Å; Y58-Y85 HydrophobicContact CD2-CD1 3.78Å; Y58-Y85 AromaticContact CD2-CE1 3.54Å; Y58-Y85 HydrophobicContact CD2-CE1 3.54Å; Y58-Y85 HydrophobicContact CE2-CE1 4.01Å; Y58-Y85 HydrophobicContact CG-CD1 4.18Å; Y58-Y85 HydrophobicContact CG-CE1 4.2Å; Y58-A86 VanDerWaalsContact O-CB 3.26Å; Y58-A86 WeakPolarHBondContact O-CB 3.43Å; Y58-A86 PolarHBondContact O-N 2.8Å
59	V	47.8	Very low	48.2	Very low	39 Å²	39	50.6 Å²	50.6	24%	0.236	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	119.5	-174.3	-168.6	0	0	0	0	108	Y31 V32 H33 A86	Y31-V59 PolarHBondContact O-N 2.89Å; V32-V59 CarbonylContact C-O 3.47Å; V32-V59 WeakPolarHBondContact CA-O 3.45Å; V32-V59 HydrophobicContact CG1-CB 4.08Å; V32-V59 HydrophobicContact CG1-CG1 4.15Å; V32-V59 HydrophobicContact CG2-CB 4.38Å; H33-V59 PolarHBondContact N-O 3Å; V59-A86 HydrophobicContact CB-CB 4.38Å; V59-A86 HydrophobicContact CG1-CB 4.29Å; V59-A86 HydrophobicContact CG2-CB 4.18Å
60	H	45.5	Very low	48.7	Very low	66 Å²	66	44.1 Å²	44.1	31%	0.306	22%	0.215	S	C	.	.	S	Bend	trans	65.6	60.7	177.6	-53.3	-75.8	0	0	0	120.3	H33 G34 H87 V119	H33-H60 CarbonylContact C-O 3.23Å; H33-H60 VanDerWaalsContact C-O 3.23Å; H33-H60 WeakPolarHBondContact CA-O 2.98Å; H33-H60 AromaticContact CE1-CD2 3.84Å; H33-H60 AromaticContact ND1-CD2 3.91Å; G34-H60 PolarHBondContact N-O 3.04Å; H60-H87 AromaticContact CE1-CE1 3.84Å; H60-H87 AromaticContact CE1-NE2 3.64Å; H60-H87 AromaticContact CG-NE2 3.81Å; H60-H87 PolarHBondContact N-CD2 2.84Å; H60-H87 PolarHBondContact N-NE2 3.29Å; H60-H87 AromaticContact ND1-CE1 3.78Å; H60-H87 AromaticContact ND1-NE2 3.45Å; H60-H87 PolarHBondContact ND1-NE2 2.69Å; H60-V119 WeakPolarHBondContact CE1-CG2 3.33Å; H60-V119 WeakPolarHBondContact ND1-CG2 3.43Å
61	G	47	Very low	49.2	Very low	30 Å²	30	42.2 Å²	42.2	31%	0.309	21%	0.213	S	C	.	.			trans	-163.6	149.9	164.8	0	0	0	0	0	111.5	G34 P63	G34-G61 VanDerWaalsContact O-CA 3.22Å; G34-G61 WeakPolarHBondContact O-CA 2.94Å; G61-P63 WeakPolarHBondContact O-CD 3.32Å
62	R	46.6	Very low	49	Very low	170 Å²	170	42 Å²	42	64%	0.642	21%	0.213	S	C	*	.			trans	-93.5	88.8	168	-67.5	-177.2	-176.5	-177.3	0.1	108.6	R35 E64	R35-R62 HydrophobicContact CG-CB 4.46Å; R62-E64 PolarHBondContact O-N 2.9Å
63	P	47	Very low	48.8	Very low	16 Å²	16	47 Å²	47	10%	0.104	24%	0.235	C	C	.	.			trans	-73.8	117.8	165.5	29.1	-31	0	0	0	110	P36 V39 G61 V66 P90	P36-P63 VanDerWaalsContact O-CA 3.24Å; P36-P63 WeakPolarHBondContact O-CA 2.9Å; V39-P63 HydrophobicContact CG2-CB 4.16Å; G61-P63 WeakPolarHBondContact O-CD 3.32Å; P63-V66 HydrophobicContact CB-CG2 3.92Å; P63-V66 HydrophobicContact CG-CG2 3.97Å; P63-P90 HydrophobicContact CG-CB 4.47Å; P63-P90 HydrophobicContact CG-CG 4.26Å
64	E	46	Very low	48.3	Very low	105 Å²	105	49 Å²	49	49%	0.491	25%	0.246	S	C	.	.	S	Bend	trans	-65.5	-35.2	170.7	-72.8	-177.6	178.4	0	0	110.3	R62 R92	R62-E64 PolarHBondContact O-N 2.9Å; E64-R92 PolarHBondContact O-N 2.88Å
65	R	45.3	Very low	48.2	Very low	108 Å²	108	49 Å²	49	41%	0.408	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.9	179.4	-56	-173.7	179.4	178.1	-0.2	112.1	E37 R38 V39 R92	E37-R65 PolarHBondContact O-N 3.44Å; R38-R65 WeakPolarHBondContact CA-O 3.47Å; R38-R65 HydrophobicContact CG-CB 4.38Å; V39-R65 PolarHBondContact N-O 2.84Å; R65-R92 WeakPolarHBondContact CA-O 3.09Å; R65-R92 HydrophobicContact CG-CB 4.37Å
66	V	48.8	Very low	47.8	Very low	1 Å²	1	52.9 Å²	52.9	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.7	167.6	177.4	0	0	0	0	107.2	V39 P63 E68 P90 R92 V93 A94	V39-V66 HydrophobicContact CB-CG2 4.39Å; V39-V66 WeakPolarHBondContact O-CA 3.18Å; P63-V66 HydrophobicContact CB-CG2 3.92Å; P63-V66 HydrophobicContact CG-CG2 3.97Å; V66-E68 HydrophobicContact CG1-CG 3.77Å; V66-P90 HydrophobicContact CB-CB 4.48Å; V66-P90 HydrophobicContact CB-CG 4.29Å; V66-P90 HydrophobicContact CG2-CB 3.88Å; V66-P90 HydrophobicContact CG2-CG 3.53Å; V66-R92 PolarHBondContact N-O 2.77Å; V66-V93 WeakPolarHBondContact O-CA 3.26Å; V66-A94 PolarHBondContact O-N 3.47Å
67	A	42.9	Very low	47.1	Very low	45 Å²	45	58.7 Å²	58.7	37%	0.372	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119	172.8	0	0	0	0	0	108.4	V39 A40 E41 A94	V39-A67 PolarHBondContact O-N 3.45Å; A40-A67 CarbonylContact C-O 3.59Å; A40-A67 VanDerWaalsContact CA-O 3.27Å; A40-A67 WeakPolarHBondContact CA-O 3.17Å; E41-A67 PolarHBondContact N-O 3.19Å; A67-A94 CarbonylContact C-O 3.58Å; A67-A94 WeakPolarHBondContact CA-O 3.08Å
68	E	51	Low	47	Very low	5 Å²	5	55.9 Å²	55.9	2%	0.023	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	123.7	179.3	-59.2	-177.2	172.2	0	0	108.8	E41 R56 Y58 V66 R83 A94 E95 S96	E41-E68 WeakPolarHBondContact O-CA 3.13Å; R56-E68 IonicContact CZ-OE1 2.72Å; R56-E68 IonicContact CZ-OE2 2.74Å; R56-E68 VanDerWaalsContact NH1-CG 3.26Å; R56-E68 IonicContact NH1-OE1 3.43Å; R56-E68 PolarHBondContact NH1-OE1 2.87Å; R56-E68 IonicContact NH1-OE2 3.14Å; R56-E68 PolarHBondContact NH1-OE2 3.43Å; Y58-E68 PolarHBondContact OH-OE1 3.14Å; Y58-E68 VanDerWaalsContact OH-OE1 3.06Å; V66-E68 HydrophobicContact CG1-CG 3.77Å; E68-R83 IonicContact OE1-NE 3.05Å; E68-R83 IonicContact OE2-CZ 3.71Å; E68-R83 IonicContact OE2-NE 3.53Å; E68-R83 PolarHBondContact OE2-NE 3.19Å; E68-R83 IonicContact OE2-NH2 2.91Å; E68-R83 PolarHBondContact OE2-NH2 2.85Å; E68-A94 PolarHBondContact N-O 3.11Å; E68-E95 HydrophobicContact CB-CG 4.5Å; E68-E95 WeakPolarHBondContact O-CA 3.3Å; E68-S96 PolarHBondContact O-N 3.45Å
69	S	45.6	Very low	46.9	Very low	36 Å²	36	55.3 Å²	55.3	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.6	171.7	63.6	0	0	0	0	109.2	E41 S42 L43 S96	E41-S69 PolarHBondContact O-N 3.49Å; S42-S69 CarbonylContact C-O 3.59Å; S42-S69 WeakPolarHBondContact CA-O 3.28Å; S42-S69 WeakPolarHBondContact CA-OG 3.49Å; S42-S69 VanDerWaalsContact CB-OG 3.29Å; S42-S69 WeakPolarHBondContact CB-OG 3.4Å; L43-S69 PolarHBondContact N-O 2.96Å; S69-S96 WeakPolarHBondContact CA-O 3.15Å; S69-S96 WeakPolarHBondContact CA-OG 3.11Å; S69-S96 VanDerWaalsContact CB-OG 3.24Å; S69-S96 WeakPolarHBondContact CB-OG 3.09Å
70	L	50.7	Low	47	Very low	8 Å²	8	56 Å²	56	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.7	170.4	-80.9	158.4	0	0	0	106.4	L43 V81 S96 L97 T98	L43-L70 HydrophobicContact CB-CD2 3.46Å; L43-L70 VanDerWaalsContact CB-CD2 3.46Å; L43-L70 HydrophobicContact CB-CG 4.44Å; L43-L70 HydrophobicContact CD1-CD2 4.06Å; L43-L70 HydrophobicContact CG-CD2 4.35Å; L70-V81 HydrophobicContact CD1-CG2 3.92Å; L70-S96 PolarHBondContact N-O 2.79Å; L70-L97 HydrophobicContact CB-CD2 3.56Å; L70-L97 HydrophobicContact CB-CG 4.26Å; L70-L97 HydrophobicContact CD1-CD2 3.82Å; L70-L97 HydrophobicContact CG-CD2 4.32Å; L70-L97 WeakPolarHBondContact O-CA 3.42Å; L70-T98 PolarHBondContact O-N 2.8Å
71	T	49.7	Very low	47.2	Very low	47 Å²	47	53 Å²	53	29%	0.288	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.2	176.1	43	0	0	0	0	106.8	L43 T44 S45 T98	L43-T71 PolarHBondContact O-N 3.37Å; L43-T71 PolarHBondContact O-OG1 2.91Å; T44-T71 WeakPolarHBondContact CA-O 3.42Å; T44-T71 WeakPolarHBondContact CG2-OG1 3.29Å; S45-T71 PolarHBondContact N-O 3.43Å; T71-T98 WeakPolarHBondContact CG2-OG1 3.4Å
72	S	47.9	Very low	47.4	Very low	5 Å²	5	52.9 Å²	52.9	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114	-178.9	-71	0	0	0	0	108.2	Q51 F75 T98	Q51-S72 PolarHBondContact NE2-OG 2.85Å; Q51-S72 PolarHBondContact OE1-OG 3.15Å; S72-F75 VanDerWaalsContact CB-CE2 3.41Å; S72-T98 PolarHBondContact N-O 2.89Å; S72-T98 VanDerWaalsContact N-O 3.11Å
73	E	46	Very low	47.8	Very low	108 Å²	108	44.9 Å²	44.9	51%	0.505	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.7	172.1	-66.9	-178.5	-174.8	0	0	108.9	F75	E73-F75 VanDerWaalsContact O-CE2 3.25Å; E73-F75 WeakPolarHBondContact O-CE2 3.24Å
74	L	42.2	Very low	48	Very low	99 Å²	99	48.5 Å²	48.5	52%	0.518	24%	0.239	S	C	.	.	S	Bend	trans	68.6	91.8	172	-57.1	163.1	0	0	0	117.1	L101	L74-L101 HydrophobicContact CD2-CD1 3.82Å
75	F	49.8	Very low	48.3	Very low	9 Å²	9	43.9 Å²	43.9	4%	0.039	22%	0.217	C	C	.	.			trans	-147.1	143.8	174.7	-59.9	-98.3	0	0	0	111.7	F48 Q51 S72 E73 W77 F102	F48-F75 HydrophobicContact CB-CD1 4.39Å; F48-F75 HydrophobicContact CB-CE1 3.8Å; F48-F75 HydrophobicContact CD2-CE1 4.05Å; F48-F75 HydrophobicContact CD2-CZ 4.38Å; F48-F75 HydrophobicContact CG-CE1 4.43Å; F48-F75 WeakPolarHBondContact O-CD1 3.24Å; F48-F75 VanDerWaalsContact O-CE1 3.3Å; F48-F75 WeakPolarHBondContact O-CE1 3.4Å; Q51-F75 HydrophobicContact CB-CD1 4.49Å; Q51-F75 HydrophobicContact CG-CD1 4.07Å; Q51-F75 HydrophobicContact CG-CE1 3.7Å; Q51-F75 HydrophobicContact CG-CZ 4.23Å; S72-F75 VanDerWaalsContact CB-CE2 3.41Å; E73-F75 VanDerWaalsContact O-CE2 3.25Å; E73-F75 WeakPolarHBondContact O-CE2 3.24Å; F75-W77 VanDerWaalsContact C-N 3.34Å; F75-F102 HydrophobicContact CB-CE1 3.59Å; F75-F102 HydrophobicContact CB-CZ 3.96Å; F75-F102 HydrophobicContact CD2-CZ 4.12Å; F75-F102 HydrophobicContact CG-CE1 4.46Å; F75-F102 HydrophobicContact CG-CZ 4.46Å; F75-F102 WeakPolarHBondContact O-CD1 3.1Å; F75-F102 WeakPolarHBondContact O-CE1 3.47Å
76	D	42.1	Very low	48.5	Very low	111 Å²	111	39.1 Å²	39.1	59%	0.594	20%	0.201	S	C	*	.	S	Bend	trans	-75.7	-23.8	171.6	-76.5	-12.9	0	0	0	112.4
77	W	41.7	Very low	48.6	Very low	123 Å²	123	41.3 Å²	41.3	47%	0.466	21%	0.211	S	C	.	.			trans	-139.8	132.6	-177.4	-87.4	79	0	0	0	112.3	F75 W104	F75-W77 VanDerWaalsContact C-N 3.34Å; W77-W104 HydrophobicContact CD2-CD2 4.24Å; W77-W104 HydrophobicContact CD2-CE3 4.01Å; W77-W104 AromaticContact CE3-CD2 3.64Å; W77-W104 HydrophobicContact CE3-CD2 3.64Å; W77-W104 AromaticContact CE3-CE3 3.26Å; W77-W104 HydrophobicContact CE3-CE3 3.26Å; W77-W104 HydrophobicContact CE3-CG 4.37Å; W77-W104 AromaticContact CE3-CH2 3.92Å; W77-W104 HydrophobicContact CE3-CH2 3.92Å; W77-W104 HydrophobicContact CE3-CZ2 4.26Å; W77-W104 AromaticContact CE3-CZ3 3.4Å; W77-W104 HydrophobicContact CE3-CZ3 3.4Å; W77-W104 VanDerWaalsContact CE3-CZ3 3.4Å; W77-W104 AromaticContact CH2-CD1 3.98Å; W77-W104 AromaticContact CH2-CD2 3.66Å; W77-W104 HydrophobicContact CH2-CD2 3.66Å; W77-W104 AromaticContact CH2-CE2 3.51Å; W77-W104 HydrophobicContact CH2-CE3 4.18Å; W77-W104 AromaticContact CH2-CG 3.97Å; W77-W104 HydrophobicContact CH2-CG 3.97Å; W77-W104 HydrophobicContact CH2-CH2 4.38Å; W77-W104 AromaticContact CH2-CZ2 3.92Å; W77-W104 HydrophobicContact CH2-CZ2 3.92Å; W77-W104 HydrophobicContact CH2-CZ3 4.49Å; W77-W104 AromaticContact CH2-NE1 3.71Å; W77-W104 HydrophobicContact CZ2-CD2 4.25Å; W77-W104 HydrophobicContact CZ2-CG 4.17Å; W77-W104 AromaticContact CZ3-CD2 3.33Å; W77-W104 HydrophobicContact CZ3-CD2 3.33Å; W77-W104 AromaticContact CZ3-CE2 3.32Å; W77-W104 AromaticContact CZ3-CE3 3.39Å; W77-W104 HydrophobicContact CZ3-CE3 3.39Å; W77-W104 HydrophobicContact CZ3-CG 4.1Å; W77-W104 AromaticContact CZ3-CH2 3.42Å; W77-W104 HydrophobicContact CZ3-CH2 3.42Å; W77-W104 VanDerWaalsContact CZ3-CH2 3.42Å; W77-W104 AromaticContact CZ3-CZ2 3.39Å; W77-W104 HydrophobicContact CZ3-CZ2 3.39Å; W77-W104 AromaticContact CZ3-CZ3 3.41Å; W77-W104 HydrophobicContact CZ3-CZ3 3.41Å; W77-W104 VanDerWaalsContact CZ3-CZ3 3.41Å
78	Q	50	Low	48.9	Very low	21 Å²	21	49 Å²	49	10%	0.098	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-88.4	150.7	168.7	-67.3	-162.4	-0.6	0	0	111.5	S99 F102 W104 P106	Q78-S99 VanDerWaalsContact NE2-CB 3.32Å; Q78-S99 PolarHBondContact NE2-OG 3.21Å; Q78-F102 HydrophobicContact CB-CE1 4.24Å; Q78-F102 HydrophobicContact CG-CD1 3.38Å; Q78-F102 HydrophobicContact CG-CE1 3.02Å; Q78-F102 HydrophobicContact CG-CE2 4.3Å; Q78-F102 HydrophobicContact CG-CG 4.12Å; Q78-F102 HydrophobicContact CG-CZ 3.56Å; Q78-W104 WeakPolarHBondContact O-CZ3 3.33Å; Q78-P106 HydrophobicContact CB-CB 3.69Å; Q78-P106 HydrophobicContact CB-CG 3.39Å; Q78-P106 HydrophobicContact CG-CG 4.11Å
79	P	51.3	Low	49	Very low	9 Å²	9	56.6 Å²	56.6	6%	0.058	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-77.4	145.6	177.7	30.7	-32.7	0	0	0	111.5	Q51 P52 V81 P106	Q51-P79 HydrophobicContact CB-CB 4.04Å; Q51-P79 HydrophobicContact CB-CG 3.79Å; Q51-P79 HydrophobicContact CG-CG 4.45Å; P52-P79 WeakPolarHBondContact O-CB 3.05Å; P79-V81 PolarHBondContact O-N 2.95Å; P79-P106 WeakPolarHBondContact O-CB 3.33Å
80	D	49.5	Very low	49.2	Very low	55 Å²	55	55.2 Å²	55.2	29%	0.294	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-69.5	125.9	170.1	-76.9	-24.3	0	0	0	109.4	D53 V54 D107	D53-D80 PolarHBondContact OD1-N 3.05Å; V54-D80 PolarHBondContact N-O 3.38Å; V54-D80 VanDerWaalsContact N-O 3.09Å; D80-D107 PolarHBondContact OD1-N 3.33Å
81	V	50.9	Low	49.1	Very low	3 Å²	3	63.1 Å²	63.1	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	100.8	178.6	-175.5	0	0	0	0	109	L70 P79 R83 M109	L70-V81 HydrophobicContact CD1-CG2 3.92Å; P79-V81 PolarHBondContact O-N 2.95Å; V81-R83 HydrophobicContact CG1-CG 4.27Å; V81-M109 PolarHBondContact O-N 3.29Å
82	T	50.7	Low	48.8	Very low	26 Å²	26	68.7 Å²	68.7	16%	0.16	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.7	176.6	-64.9	0	0	0	0	111.3	V54 T55 R56 M109	V54-T82 PolarHBondContact O-N 2.99Å; V54-T82 VanDerWaalsContact O-N 3.08Å; T55-T82 CarbonylContact C-O 3.16Å; T55-T82 WeakPolarHBondContact CA-O 3.37Å; T55-T82 HydrophobicContact CG2-CG2 4.48Å; R56-T82 PolarHBondContact N-O 3.06Å; T82-M109 WeakPolarHBondContact CA-O 3.45Å
83	R	54.4	Low	49	Very low	2 Å²	2	70.4 Å²	70.4	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.7	177.3	-59.4	-173.3	-173.5	93.8	-6.3	111.6	E68 V81 Y85 E95 V108 M109 H110 H111	E68-R83 IonicContact OE1-NE 3.05Å; E68-R83 IonicContact OE2-CZ 3.71Å; E68-R83 IonicContact OE2-NE 3.53Å; E68-R83 PolarHBondContact OE2-NE 3.19Å; E68-R83 IonicContact OE2-NH2 2.91Å; E68-R83 PolarHBondContact OE2-NH2 2.85Å; V81-R83 HydrophobicContact CG1-CG 4.27Å; R83-Y85 HydrophobicContact CB-CE2 3.98Å; R83-E95 IonicContact CZ-OE1 3.93Å; R83-E95 IonicContact CZ-OE2 3.68Å; R83-E95 IonicContact NE-OE1 2.86Å; R83-E95 IonicContact NH1-OE1 3.88Å; R83-E95 PolarHBondContact NH1-OE1 2.98Å; R83-E95 IonicContact NH1-OE2 3.95Å; R83-E95 PolarHBondContact NH1-OE2 2.74Å; R83-E95 IonicContact NH2-OE1 3.88Å; R83-E95 PolarHBondContact NH2-OE1 2.87Å; R83-E95 IonicContact NH2-OE2 2.79Å; R83-E95 PolarHBondContact NH2-OE2 2.72Å; R83-V108 VanDerWaalsContact NH1-CG1 3.31Å; R83-M109 PolarHBondContact N-O 2.9Å; R83-H110 PolarHBondContact NH1-CE1 2.89Å; R83-H111 PolarHBondContact O-N 2.81Å
84	R	51.5	Low	48.9	Very low	93 Å²	93	68.2 Å²	68.2	35%	0.351	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	113.2	177.5	-82.9	179.4	-169.7	-150.9	4.6	111	R56 R57 Y58 H111	R56-R84 PolarHBondContact O-N 2.93Å; R57-R84 CarbonylContact C-O 3.42Å; R57-R84 WeakPolarHBondContact CA-O 3.36Å; R57-R84 HydrophobicContact CG-CB 3.78Å; Y58-R84 PolarHBondContact N-O 3.06Å; R84-H111 VanDerWaalsContact CA-O 3.28Å; R84-H111 WeakPolarHBondContact CA-O 3.31Å; R84-H111 HydrophobicContact CG-CB 3.7Å
85	Y	52.9	Low	49.2	Very low	8 Å²	8	66.6 Å²	66.6	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.7	175.7	-55.9	-86.1	0	0	0	110.3	Y58 R83 P90 H111 L112 V113	Y58-Y85 AromaticContact CD2-CD1 3.78Å; Y58-Y85 HydrophobicContact CD2-CD1 3.78Å; Y58-Y85 AromaticContact CD2-CE1 3.54Å; Y58-Y85 HydrophobicContact CD2-CE1 3.54Å; Y58-Y85 HydrophobicContact CE2-CE1 4.01Å; Y58-Y85 HydrophobicContact CG-CD1 4.18Å; Y58-Y85 HydrophobicContact CG-CE1 4.2Å; R83-Y85 HydrophobicContact CB-CE2 3.98Å; Y85-P90 HydrophobicContact CD1-CG 4.27Å; Y85-P90 HydrophobicContact CE1-CG 3.64Å; Y85-H111 PolarHBondContact N-O 2.91Å; Y85-L112 HydrophobicContact CD2-CD2 3.83Å; Y85-L112 HydrophobicContact CG-CD2 4.27Å; Y85-V113 CarbonylContact O-C 3.57Å; Y85-V113 PolarHBondContact O-N 2.86Å
86	A	48.8	Very low	49	Very low	7 Å²	7	68.9 Å²	68.9	6%	0.058	32%	0.319	C	S	.	.	S	Bend	trans	-91.2	-17.5	-178.3	0	0	0	0	0	114.7	Y58 V59 V113 L115	Y58-A86 VanDerWaalsContact O-CB 3.26Å; Y58-A86 WeakPolarHBondContact O-CB 3.43Å; Y58-A86 PolarHBondContact O-N 2.8Å; V59-A86 HydrophobicContact CB-CB 4.38Å; V59-A86 HydrophobicContact CG1-CB 4.29Å; V59-A86 HydrophobicContact CG2-CB 4.18Å; A86-V113 CarbonylContact C-O 3.53Å; A86-V113 WeakPolarHBondContact CA-O 3.29Å; A86-L115 HydrophobicContact CB-CB 4.4Å; A86-L115 HydrophobicContact CB-CD1 3.69Å; A86-L115 HydrophobicContact CB-CG 4.46Å; A86-L115 WeakPolarHBondContact O-CA 3.32Å; A86-L115 VanDerWaalsContact O-CB 3.3Å; A86-L115 WeakPolarHBondContact O-CB 3.34Å; A86-L115 PolarHBondContact O-N 3.33Å
87	H	51.7	Low	49.3	Very low	47 Å²	47	67 Å²	67	22%	0.218	31%	0.308	C	S	.	.	S	Bend	trans	-135.8	-16.5	-165.8	-63.5	-68	0	0	0	117.4	H60 V119	H60-H87 AromaticContact CE1-CE1 3.84Å; H60-H87 AromaticContact CE1-NE2 3.64Å; H60-H87 AromaticContact CG-NE2 3.81Å; H60-H87 PolarHBondContact N-CD2 2.84Å; H60-H87 PolarHBondContact N-NE2 3.29Å; H60-H87 AromaticContact ND1-CE1 3.78Å; H60-H87 AromaticContact ND1-NE2 3.45Å; H60-H87 PolarHBondContact ND1-NE2 2.69Å; H87-V119 WeakPolarHBondContact CE1-CG2 3.39Å; H87-V119 VanDerWaalsContact ND1-CG2 3.32Å; H87-V119 WeakPolarHBondContact ND1-CG2 3.34Å
88	R	49.5	Very low	49.6	Very low	208 Å²	208	64.7 Å²	64.7	79%	0.785	31%	0.308	S	S	*	.			trans	169.7	155.7	164.9	-99.6	172.1	-163.8	-160.9	4.6	108.3
89	R	51.6	Low	49.5	Very low	163 Å²	163	65.6 Å²	65.6	62%	0.615	32%	0.317	S	S	*	.			trans	-65.2	140.6	170.3	-167.6	179.4	179.9	-175.9	1.1	108.9	L112	R89-L112 HydrophobicContact CB-CD2 3.92Å; R89-L112 HydrophobicContact CG-CD2 4.44Å
90	P	50.6	Low	49.3	Very low	8 Å²	8	72.2 Å²	72.2	5%	0.052	35%	0.347	C	S	.	.			trans	-57.2	148.2	169.9	-17.4	28.2	0	0	0	110.9	P63 V66 Y85 R92 V93	P63-P90 HydrophobicContact CG-CB 4.47Å; P63-P90 HydrophobicContact CG-CG 4.26Å; V66-P90 HydrophobicContact CB-CB 4.48Å; V66-P90 HydrophobicContact CB-CG 4.29Å; V66-P90 HydrophobicContact CG2-CB 3.88Å; V66-P90 HydrophobicContact CG2-CG 3.53Å; Y85-P90 HydrophobicContact CD1-CG 4.27Å; Y85-P90 HydrophobicContact CE1-CG 3.64Å; P90-R92 VanDerWaalsContact C-N 3.28Å; P90-R92 PolarHBondContact O-N 2.79Å; P90-V93 HydrophobicContact CB-CG2 3.9Å; P90-V93 HydrophobicContact CG-CG2 3.81Å
91	E	47.8	Very low	48.8	Very low	174 Å²	174	74.9 Å²	74.9	81%	0.813	36%	0.361	S	S	*	.	S	Bend	trans	-65.2	-33.7	176.5	-77.8	-176.6	-173.8	0	0	112.1
92	R	44.7	Very low	48.7	Very low	163 Å²	163	77.4 Å²	77.4	62%	0.615	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.2	173.5	-65	-174.4	179.4	-171.1	-1.3	110.7	E64 R65 V66 P90	E64-R92 PolarHBondContact O-N 2.88Å; R65-R92 WeakPolarHBondContact CA-O 3.09Å; R65-R92 HydrophobicContact CG-CB 4.37Å; V66-R92 PolarHBondContact N-O 2.77Å; P90-R92 VanDerWaalsContact C-N 3.28Å; P90-R92 PolarHBondContact O-N 2.79Å
93	V	50.6	Low	48.2	Very low	42 Å²	42	84 Å²	84	26%	0.255	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	114.6	169.6	-179.1	0	0	0	0	106.2	V66 P90 E95	V66-V93 WeakPolarHBondContact O-CA 3.26Å; P90-V93 HydrophobicContact CB-CG2 3.9Å; P90-V93 HydrophobicContact CG-CG2 3.81Å; V93-E95 HydrophobicContact CG1-CG 3.77Å; V93-E95 WeakPolarHBondContact CG1-OE1 3.47Å
94	A	43.8	Very low	47.4	Very low	61 Å²	61	87.8 Å²	87.8	50%	0.504	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116	171	0	0	0	0	0	107.1	V66 A67 E68	V66-A94 PolarHBondContact O-N 3.47Å; A67-A94 CarbonylContact C-O 3.58Å; A67-A94 WeakPolarHBondContact CA-O 3.08Å; E68-A94 PolarHBondContact N-O 3.11Å
95	E	49.5	Very low	47.1	Very low	66 Å²	66	91.5 Å²	91.5	31%	0.308	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.1	177.5	-71.7	172	-147.2	0	0	107.7	E68 R83 V93 H110	E68-E95 HydrophobicContact CB-CG 4.5Å; E68-E95 WeakPolarHBondContact O-CA 3.3Å; R83-E95 IonicContact CZ-OE1 3.93Å; R83-E95 IonicContact CZ-OE2 3.68Å; R83-E95 IonicContact NE-OE1 2.86Å; R83-E95 IonicContact NH1-OE1 3.88Å; R83-E95 PolarHBondContact NH1-OE1 2.98Å; R83-E95 IonicContact NH1-OE2 3.95Å; R83-E95 PolarHBondContact NH1-OE2 2.74Å; R83-E95 IonicContact NH2-OE1 3.88Å; R83-E95 PolarHBondContact NH2-OE1 2.87Å; R83-E95 IonicContact NH2-OE2 2.79Å; R83-E95 PolarHBondContact NH2-OE2 2.72Å; V93-E95 HydrophobicContact CG1-CG 3.77Å; V93-E95 WeakPolarHBondContact CG1-OE1 3.47Å; E95-H110 IonicContact OE1-CE1 2.84Å; E95-H110 PolarHBondContact OE1-CE1 2.86Å; E95-H110 IonicContact OE1-NE2 3.09Å
96	S	44.7	Very low	46.7	Very low	57 Å²	57	92.1 Å²	92.1	40%	0.399	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	109.8	168.5	61.5	0	0	0	0	107.8	E68 S69 L70	E68-S96 PolarHBondContact O-N 3.45Å; S69-S96 WeakPolarHBondContact CA-O 3.15Å; S69-S96 WeakPolarHBondContact CA-OG 3.11Å; S69-S96 VanDerWaalsContact CB-OG 3.24Å; S69-S96 WeakPolarHBondContact CB-OG 3.09Å; L70-S96 PolarHBondContact N-O 2.79Å
97	L	49.1	Very low	46.4	Very low	70 Å²	70	97.1 Å²	97.1	37%	0.366	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.3	165	-80.2	149.3	0	0	0	106.2	L70 V108	L70-L97 HydrophobicContact CB-CD2 3.56Å; L70-L97 HydrophobicContact CB-CG 4.26Å; L70-L97 HydrophobicContact CD1-CD2 3.82Å; L70-L97 HydrophobicContact CG-CD2 4.32Å; L70-L97 WeakPolarHBondContact O-CA 3.42Å; L97-V108 HydrophobicContact CD1-CG2 4.46Å
98	T	47.1	Very low	46	Very low	75 Å²	75	97.6 Å²	97.6	46%	0.46	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.9	173.1	42.6	0	0	0	0	108.3	L70 T71 S72	L70-T98 PolarHBondContact O-N 2.8Å; T71-T98 WeakPolarHBondContact CG2-OG1 3.4Å; S72-T98 PolarHBondContact N-O 2.89Å; S72-T98 VanDerWaalsContact N-O 3.11Å
99	S	48.6	Very low	45.5	Very low	40 Å²	40	92.7 Å²	92.7	28%	0.28	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	105.6	-153.3	-82.8	0	0	0	0	107.2	Q78 F102	Q78-S99 VanDerWaalsContact NE2-CB 3.32Å; Q78-S99 PolarHBondContact NE2-OG 3.21Å; S99-F102 WeakPolarHBondContact OG-CE2 3.28Å
100	E	47.2	Very low	44.9	Very low	148 Å²	148	88.7 Å²	88.7	69%	0.692	45%	0.453	S	S	*	.	S	Bend	trans	-88.9	-10.4	-167	-65.9	-157.9	150.9	0	0	114.9
101	L	39.7	Very low	44.5	Very low	112 Å²	112	91.9 Å²	91.9	59%	0.586	47%	0.468	S	S	*	.			trans	-162.3	119.9	175.4	-90.3	113.7	0	0	0	111.1	L74	L74-L101 HydrophobicContact CD2-CD1 3.82Å
102	F	47.8	Very low	43.8	Very low	55 Å²	55	88.5 Å²	88.5	24%	0.241	46%	0.455	C	S	.	.			trans	-150.1	136.9	177.1	-71.6	-83.2	0	0	0	113.2	F75 Q78 S99	F75-F102 HydrophobicContact CB-CE1 3.59Å; F75-F102 HydrophobicContact CB-CZ 3.96Å; F75-F102 HydrophobicContact CD2-CZ 4.12Å; F75-F102 HydrophobicContact CG-CE1 4.46Å; F75-F102 HydrophobicContact CG-CZ 4.46Å; F75-F102 WeakPolarHBondContact O-CD1 3.1Å; F75-F102 WeakPolarHBondContact O-CE1 3.47Å; Q78-F102 HydrophobicContact CB-CE1 4.24Å; Q78-F102 HydrophobicContact CG-CD1 3.38Å; Q78-F102 HydrophobicContact CG-CE1 3.02Å; Q78-F102 HydrophobicContact CG-CE2 4.3Å; Q78-F102 HydrophobicContact CG-CG 4.12Å; Q78-F102 HydrophobicContact CG-CZ 3.56Å; S99-F102 WeakPolarHBondContact OG-CE2 3.28Å
103	D	40	Very low	43.5	Very low	165 Å²	165	84 Å²	84	88%	0.882	45%	0.445	S	S	*	.	S	Bend	trans	-88.2	-16.7	167.6	-89.9	-11	0	0	0	112.8
104	W	38.9	Very low	42.7	Very low	81 Å²	81	87.4 Å²	87.4	31%	0.307	47%	0.466	S	S	.	.	S	Bend	trans	-138.9	138.7	-176.6	-174.3	86.1	0	0	0	112.6	W77 Q78 P106	W77-W104 HydrophobicContact CD2-CD2 4.24Å; W77-W104 HydrophobicContact CD2-CE3 4.01Å; W77-W104 AromaticContact CE3-CD2 3.64Å; W77-W104 HydrophobicContact CE3-CD2 3.64Å; W77-W104 AromaticContact CE3-CE3 3.26Å; W77-W104 HydrophobicContact CE3-CE3 3.26Å; W77-W104 HydrophobicContact CE3-CG 4.37Å; W77-W104 AromaticContact CE3-CH2 3.92Å; W77-W104 HydrophobicContact CE3-CH2 3.92Å; W77-W104 HydrophobicContact CE3-CZ2 4.26Å; W77-W104 AromaticContact CE3-CZ3 3.4Å; W77-W104 HydrophobicContact CE3-CZ3 3.4Å; W77-W104 VanDerWaalsContact CE3-CZ3 3.4Å; W77-W104 AromaticContact CH2-CD1 3.98Å; W77-W104 AromaticContact CH2-CD2 3.66Å; W77-W104 HydrophobicContact CH2-CD2 3.66Å; W77-W104 AromaticContact CH2-CE2 3.51Å; W77-W104 HydrophobicContact CH2-CE3 4.18Å; W77-W104 AromaticContact CH2-CG 3.97Å; W77-W104 HydrophobicContact CH2-CG 3.97Å; W77-W104 HydrophobicContact CH2-CH2 4.38Å; W77-W104 AromaticContact CH2-CZ2 3.92Å; W77-W104 HydrophobicContact CH2-CZ2 3.92Å; W77-W104 HydrophobicContact CH2-CZ3 4.49Å; W77-W104 AromaticContact CH2-NE1 3.71Å; W77-W104 HydrophobicContact CZ2-CD2 4.25Å; W77-W104 HydrophobicContact CZ2-CG 4.17Å; W77-W104 AromaticContact CZ3-CD2 3.33Å; W77-W104 HydrophobicContact CZ3-CD2 3.33Å; W77-W104 AromaticContact CZ3-CE2 3.32Å; W77-W104 AromaticContact CZ3-CE3 3.39Å; W77-W104 HydrophobicContact CZ3-CE3 3.39Å; W77-W104 HydrophobicContact CZ3-CG 4.1Å; W77-W104 AromaticContact CZ3-CH2 3.42Å; W77-W104 HydrophobicContact CZ3-CH2 3.42Å; W77-W104 VanDerWaalsContact CZ3-CH2 3.42Å; W77-W104 AromaticContact CZ3-CZ2 3.39Å; W77-W104 HydrophobicContact CZ3-CZ2 3.39Å; W77-W104 AromaticContact CZ3-CZ3 3.41Å; W77-W104 HydrophobicContact CZ3-CZ3 3.41Å; W77-W104 VanDerWaalsContact CZ3-CZ3 3.41Å; Q78-W104 WeakPolarHBondContact O-CZ3 3.33Å; W104-P106 HydrophobicContact CH2-CB 4.22Å; W104-P106 HydrophobicContact CZ3-CB 3.77Å
105	Q	45.2	Very low	42.4	Very low	171 Å²	171	87.8 Å²	87.8	80%	0.799	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-100.8	133.9	178.2	-72.6	-174.4	-18.4	0	0	110.9
106	P	44.8	Very low	41.7	Very low	21 Å²	21	89 Å²	89	14%	0.136	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-79.5	150	-179.8	35.8	-36.5	0	0	0	112.9	Q78 P79 W104	Q78-P106 HydrophobicContact CB-CB 3.69Å; Q78-P106 HydrophobicContact CB-CG 3.39Å; Q78-P106 HydrophobicContact CG-CG 4.11Å; P79-P106 WeakPolarHBondContact O-CB 3.33Å; W104-P106 HydrophobicContact CH2-CB 4.22Å; W104-P106 HydrophobicContact CZ3-CB 3.77Å
107	D	41.9	Very low	41.2	Very low	113 Å²	113	94.3 Å²	94.3	60%	0.604	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-82.2	117.6	174.2	-80.5	-37.1	0	0	0	110.1	D80 M109	D80-D107 PolarHBondContact OD1-N 3.33Å; D107-M109 PolarHBondContact O-N 3.03Å
108	V	42.9	Very low	40.7	Very low	56 Å²	56	93.5 Å²	93.5	34%	0.339	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	101.7	173.4	-177.1	0	0	0	0	109.4	R83 L97	R83-V108 VanDerWaalsContact NH1-CG1 3.31Å; L97-V108 HydrophobicContact CD1-CG2 4.46Å
109	M	38.7	Very low	40.5	Very low	106 Å²	106	91.3 Å²	91.3	52%	0.522	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.3	177.6	-67.8	-146.4	108.2	0	0	112.9	V81 T82 R83 D107	V81-M109 PolarHBondContact O-N 3.29Å; T82-M109 WeakPolarHBondContact CA-O 3.45Å; R83-M109 PolarHBondContact N-O 2.9Å; D107-M109 PolarHBondContact O-N 3.03Å
110	H	40.2	Very low	40.1	Very low	78 Å²	78	94.1 Å²	94.1	36%	0.361	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.5	170	-65.6	-95.3	0	0	0	110.9	R83 E95	R83-H110 PolarHBondContact NH1-CE1 2.89Å; E95-H110 IonicContact OE1-CE1 2.84Å; E95-H110 PolarHBondContact OE1-CE1 2.86Å; E95-H110 IonicContact OE1-NE2 3.09Å
111	H	41.2	Very low	39.8	Very low	75 Å²	75	89.3 Å²	89.3	35%	0.347	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.7	169.9	-69.2	-56.8	0	0	0	110.4	R83 R84 Y85	R83-H111 PolarHBondContact O-N 2.81Å; R84-H111 VanDerWaalsContact CA-O 3.28Å; R84-H111 WeakPolarHBondContact CA-O 3.31Å; R84-H111 HydrophobicContact CG-CB 3.7Å; Y85-H111 PolarHBondContact N-O 2.91Å
112	L	32.9	Very low	40.2	Very low	104 Å²	104	86.7 Å²	86.7	55%	0.545	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.4	169.2	-69.8	167.7	0	0	0	108.7	Y85 R89	Y85-L112 HydrophobicContact CD2-CD2 3.83Å; Y85-L112 HydrophobicContact CG-CD2 4.27Å; R89-L112 HydrophobicContact CB-CD2 3.92Å; R89-L112 HydrophobicContact CG-CD2 4.44Å
113	V	39.2	Very low	40.1	Very low	69 Å²	69	90.1 Å²	90.1	42%	0.418	49%	0.487	S	S	.	.			trans	-114.5	102.5	172.9	-179.3	0	0	0	0	107.2	Y85 A86 L115	Y85-V113 CarbonylContact O-C 3.57Å; Y85-V113 PolarHBondContact O-N 2.86Å; A86-V113 CarbonylContact C-O 3.53Å; A86-V113 WeakPolarHBondContact CA-O 3.29Å; V113-L115 HydrophobicContact CG1-CG 4.48Å; V113-L115 PolarHBondContact O-N 3.28Å
114	T	33.2	Very low	40.4	Very low	112 Å²	112	86.6 Å²	86.6	69%	0.687	47%	0.468	S	S	*	.			trans	-73.1	97.2	176	41.3	0	0	0	0	110.5	V116	T114-V116 PolarHBondContact O-N 2.78Å; T114-V116 VanDerWaalsContact O-N 3.15Å
115	L	37.1	Very low	41	Very low	69 Å²	69	87.3 Å²	87.3	36%	0.361	48%	0.477	S	S	.	.			trans	-83.9	48.8	167.9	-82	163.7	0	0	0	110.7	A86 V113 E117 A118	A86-L115 HydrophobicContact CB-CB 4.4Å; A86-L115 HydrophobicContact CB-CD1 3.69Å; A86-L115 HydrophobicContact CB-CG 4.46Å; A86-L115 WeakPolarHBondContact O-CA 3.32Å; A86-L115 VanDerWaalsContact O-CB 3.3Å; A86-L115 WeakPolarHBondContact O-CB 3.34Å; A86-L115 PolarHBondContact O-N 3.33Å; V113-L115 HydrophobicContact CG1-CG 4.48Å; V113-L115 PolarHBondContact O-N 3.28Å; L115-E117 PolarHBondContact O-N 3.04Å; L115-A118 HydrophobicContact CD2-CB 3.8Å
116	V	35.1	Very low	41.4	Very low	91 Å²	91	82 Å²	82	55%	0.552	46%	0.462	S	S	*	.	H	α-helix	trans	-62.8	-28.7	176.9	173.6	0	0	0	0	110.7	T114	T114-V116 PolarHBondContact O-N 2.78Å; T114-V116 VanDerWaalsContact O-N 3.15Å
117	E	35.2	Very low	41.8	Very low	170 Å²	170	85.2 Å²	85.2	79%	0.794	49%	0.485	S	S	*	.	H	α-helix	trans	-86.8	-32.3	-173.6	-62.8	-177.8	156.5	0	0	113.6	L115 A121	L115-E117 PolarHBondContact O-N 3.04Å; E117-A121 WeakPolarHBondContact O-CB 3.44Å; E117-A121 PolarHBondContact O-N 3.03Å
118	A	39	Very low	42.5	Very low	52 Å²	52	85.8 Å²	85.8	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-78	-31.3	-173.7	0	0	0	0	0	114	L115 A122	L115-A118 HydrophobicContact CD2-CB 3.8Å; A118-A122 WeakPolarHBondContact O-CB 2.87Å; A118-A122 PolarHBondContact O-N 3.08Å; A118-A122 VanDerWaalsContact O-N 3.14Å
119	V	42.7	Very low	43.4	Very low	30 Å²	30	91.5 Å²	91.5	18%	0.182	51%	0.508	C	S	.	.	H	α-helix	trans	-81.1	-43.2	178.9	-162.4	0	0	0	0	111.1	H60 H87 A121 A122 E123	H60-V119 WeakPolarHBondContact CE1-CG2 3.33Å; H60-V119 WeakPolarHBondContact ND1-CG2 3.43Å; H87-V119 WeakPolarHBondContact CE1-CG2 3.39Å; H87-V119 VanDerWaalsContact ND1-CG2 3.32Å; H87-V119 WeakPolarHBondContact ND1-CG2 3.34Å; V119-A121 VanDerWaalsContact C-N 3.26Å; V119-A121 PolarHBondContact O-N 3.35Å; V119-A122 PolarHBondContact O-N 3.09Å; V119-E123 HydrophobicContact CG1-CG 4.47Å; V119-E123 WeakPolarHBondContact O-CB 3.13Å; V119-E123 WeakPolarHBondContact O-CG 3.32Å; V119-E123 PolarHBondContact O-N 3.06Å
120	L	40	Very low	43.9	Very low	99 Å²	99	98.3 Å²	98.3	52%	0.518	54%	0.535	S	S	.	.	H	α-helix	trans	-59.9	-42.6	174.3	-124.5	89.9	0	0	0	109.8	A122 E123 I124	L120-A122 PolarHBondContact O-N 3.02Å; L120-E123 PolarHBondContact O-N 3.1Å; L120-I124 HydrophobicContact CD2-CD1 4.23Å; L120-I124 HydrophobicContact CG-CD1 4.43Å; L120-I124 VanDerWaalsContact O-CB 3.27Å; L120-I124 WeakPolarHBondContact O-CB 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.21Å; L120-I124 WeakPolarHBondContact O-CG1 3.38Å; L120-I124 PolarHBondContact O-N 3.37Å
121	A	40.3	Very low	44.1	Very low	46 Å²	46	99.3 Å²	99.3	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-62.2	-42	175.6	0	0	0	0	0	112.5	E117 V119 L125	E117-A121 WeakPolarHBondContact O-CB 3.44Å; E117-A121 PolarHBondContact O-N 3.03Å; V119-A121 VanDerWaalsContact C-N 3.26Å; V119-A121 PolarHBondContact O-N 3.35Å; A121-L125 VanDerWaalsContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CB 3.48Å; A121-L125 WeakPolarHBondContact O-CD1 3.25Å; A121-L125 VanDerWaalsContact O-CG 3.29Å; A121-L125 WeakPolarHBondContact O-CG 3.4Å; A121-L125 PolarHBondContact O-N 2.95Å
122	A	47.6	Very low	44.3	Very low	57 Å²	57	100.6 Å²	100.6	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-68.8	-37.7	177.7	0	0	0	0	0	113	A118 V119 L120 A126	A118-A122 WeakPolarHBondContact O-CB 2.87Å; A118-A122 PolarHBondContact O-N 3.08Å; A118-A122 VanDerWaalsContact O-N 3.14Å; V119-A122 PolarHBondContact O-N 3.09Å; L120-A122 PolarHBondContact O-N 3.02Å; A122-A126 VanDerWaalsContact O-CB 3.22Å; A122-A126 WeakPolarHBondContact O-CB 3.33Å; A122-A126 PolarHBondContact O-N 3.36Å
123	E	45.4	Very low	44.9	Very low	128 Å²	128	100.4 Å²	100.4	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-70.1	-41.1	176.1	-75.1	178.7	170.6	0	0	111.8	V119 L120 A126 S127	V119-E123 HydrophobicContact CG1-CG 4.47Å; V119-E123 WeakPolarHBondContact O-CB 3.13Å; V119-E123 WeakPolarHBondContact O-CG 3.32Å; V119-E123 PolarHBondContact O-N 3.06Å; L120-E123 PolarHBondContact O-N 3.1Å; E123-A126 PolarHBondContact O-N 3.04Å; E123-S127 WeakPolarHBondContact O-CB 3.3Å; E123-S127 PolarHBondContact O-N 3.24Å
124	I	47.6	Very low	45.3	Very low	91 Å²	91	102.2 Å²	102.2	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-45.3	174.7	-68.6	165.7	0	0	0	110.5	L120 S127 L128	L120-I124 HydrophobicContact CD2-CD1 4.23Å; L120-I124 HydrophobicContact CG-CD1 4.43Å; L120-I124 VanDerWaalsContact O-CB 3.27Å; L120-I124 WeakPolarHBondContact O-CB 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.21Å; L120-I124 WeakPolarHBondContact O-CG1 3.38Å; L120-I124 PolarHBondContact O-N 3.37Å; I124-S127 WeakPolarHBondContact O-CB 3.19Å; I124-S127 PolarHBondContact O-N 3.31Å; I124-L128 HydrophobicContact CG2-CD1 3.86Å; I124-L128 WeakPolarHBondContact O-CG 3.12Å; I124-L128 PolarHBondContact O-N 3.39Å; I124-L128 VanDerWaalsContact O-N 3.08Å
125	L	50.6	Low	46	Very low	96 Å²	96	101.6 Å²	101.6	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-43.1	175.6	-80	163.1	0	0	0	111.8	A121 S127 L128 F129	A121-L125 VanDerWaalsContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CB 3.48Å; A121-L125 WeakPolarHBondContact O-CD1 3.25Å; A121-L125 VanDerWaalsContact O-CG 3.29Å; A121-L125 WeakPolarHBondContact O-CG 3.4Å; A121-L125 PolarHBondContact O-N 2.95Å; L125-S127 PolarHBondContact O-N 3.34Å; L125-L128 PolarHBondContact O-N 2.95Å; L125-L128 VanDerWaalsContact O-N 3.13Å; L125-F129 HydrophobicContact CD2-CE2 4.19Å; L125-F129 WeakPolarHBondContact O-CD2 3.06Å; L125-F129 PolarHBondContact O-N 3.22Å
126	A	53.1	Low	46.6	Very low	59 Å²	59	103.8 Å²	103.8	49%	0.488	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-26.7	176.8	0	0	0	0	0	113.2	A122 E123	A122-A126 VanDerWaalsContact O-CB 3.22Å; A122-A126 WeakPolarHBondContact O-CB 3.33Å; A122-A126 PolarHBondContact O-N 3.36Å; E123-A126 PolarHBondContact O-N 3.04Å
127	S	54.1	Low	47.4	Very low	89 Å²	89	104.7 Å²	104.7	62%	0.622	57%	0.568	S	S	*	*	H	α-helix	trans	-78.1	-22.4	173.4	177.6	0	0	0	0	113.5	E123 I124 L125	E123-S127 WeakPolarHBondContact O-CB 3.3Å; E123-S127 PolarHBondContact O-N 3.24Å; I124-S127 WeakPolarHBondContact O-CB 3.19Å; I124-S127 PolarHBondContact O-N 3.31Å; L125-S127 PolarHBondContact O-N 3.34Å
128	L	57.1	Low	48.4	Very low	124 Å²	124	99.7 Å²	99.7	65%	0.649	55%	0.551	S	S	*	*	H	α-helix	trans	-88.3	-15.8	-179.3	-75.6	164.3	0	0	0	113.2	I124 L125	I124-L128 HydrophobicContact CG2-CD1 3.86Å; I124-L128 WeakPolarHBondContact O-CG 3.12Å; I124-L128 PolarHBondContact O-N 3.39Å; I124-L128 VanDerWaalsContact O-N 3.08Å; L125-L128 PolarHBondContact O-N 2.95Å; L125-L128 VanDerWaalsContact O-N 3.13Å
129	F	60.6	Low	49.1	Very low	177 Å²	177	103.7 Å²	103.7	78%	0.776	56%	0.561	S	S	*	*			trans	-111.2	16.6	-178.1	-76.7	-79.7	0	0	0	114.1	L125	L125-F129 HydrophobicContact CD2-CE2 4.19Å; L125-F129 WeakPolarHBondContact O-CD2 3.06Å; L125-F129 PolarHBondContact O-N 3.22Å
130	K	50.6	Low	49.7	Very low	248 Å²	248	110.4 Å²	110.4	100%	1.078	60%	0.596	S	S	*	*			trans	-112.8	0	168	-79.5	-174.1	177.7	-178.7	0	110

Retrieved 130 of 130 residues in 130.8 ms (Link to these results)

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