A0A077ZKR0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKR0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 aa.

						>A0A077ZKR0_TRITR|A0A077ZKR0
MVDNHSCERLWRVCKLEEGSQCLYAGYIVEIWDPQTSIPDWEVEEGVCDCSRRGLSSRYSYDTVVGNCVNRFGYVEEWDGKARTGELCVLDADLQRCQVLVAAIDIGGKAGLHVA
					

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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	29.2	Very low	37	Very low	232 Å²	232	112.5 Å²	112.5	100%	1.143	58%	0.581	S	S	*	*				0	99.6	0	-74.4	174.1	-84	0	0	104.8
2	V	27.5	Very low	38.4	Very low	140 Å²	140	108 Å²	108	85%	0.848	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-87.4	116.4	173.1	-179.8	0	0	0	0	104
3	D	31.3	Very low	39.5	Very low	153 Å²	153	99.7 Å²	99.7	82%	0.818	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-56.7	139.4	-175.4	-84.8	-53.1	0	0	0	111.4	H5	D3-H5 PolarHBondContact O-N 3.03Å
4	N	33.9	Very low	40.8	Very low	137 Å²	137	92.9 Å²	92.9	73%	0.733	47%	0.474	S	S	*	.	S	Bend	trans	-62.7	116.5	-177.4	-104.5	1.5	0	0	0	111.2
5	H	34.8	Very low	42	Very low	128 Å²	128	90 Å²	90	59%	0.593	46%	0.457	S	S	*	.			trans	76.2	48	138.2	-55.6	-68.2	0	0	0	120.4	D3 C7	D3-H5 PolarHBondContact O-N 3.03Å; H5-C7 VanDerWaalsContact C-N 3.32Å; H5-C7 PolarHBondContact O-N 3.28Å
6	S	38.1	Very low	42.8	Very low	73 Å²	73	85.6 Å²	85.6	51%	0.51	44%	0.435	S	S	.	.			trans	-75	94.3	143.6	52.8	0	0	0	0	107.9	E8	S6-E8 VanDerWaalsContact C-N 3.28Å; S6-E8 PolarHBondContact O-N 3.3Å
7	C	30.8	Very low	43.7	Very low	63 Å²	63	85.4 Å²	85.4	43%	0.426	43%	0.432	S	S	.	.			trans	-75.9	87.1	170	-87.8	0	0	0	0	108.4	H5 R9	H5-C7 VanDerWaalsContact C-N 3.32Å; H5-C7 PolarHBondContact O-N 3.28Å; C7-R9 PolarHBondContact O-N 3.33Å; C7-R9 VanDerWaalsContact O-N 3.1Å
8	E	44.1	Very low	44.6	Very low	96 Å²	96	90.2 Å²	90.2	45%	0.449	45%	0.452	S	S	.	.			trans	-66.7	107.8	171.1	-70.7	172.2	-164.9	0	0	108.7	S6 V29	S6-E8 VanDerWaalsContact C-N 3.28Å; S6-E8 PolarHBondContact O-N 3.3Å; E8-V29 HydrophobicContact CB-CG1 3.86Å; E8-V29 HydrophobicContact CG-CG1 3.65Å
9	R	42	Very low	45.1	Very low	126 Å²	126	89.7 Å²	89.7	48%	0.475	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.1	168	-69.7	-174.9	-179.7	149.5	-8	108	C7 W11 V29 E30	C7-R9 PolarHBondContact O-N 3.33Å; C7-R9 VanDerWaalsContact O-N 3.1Å; R9-W11 HydrophobicContact CB-CZ2 4.42Å; R9-V29 WeakPolarHBondContact O-CA 3.48Å; R9-E30 HydrophobicContact CB-CB 4.3Å; R9-E30 WeakPolarHBondContact CD-OE2 3.3Å; R9-E30 IonicContact CZ-OE2 2.88Å; R9-E30 IonicContact NH1-OE2 3.88Å; R9-E30 PolarHBondContact NH1-OE2 3.4Å; R9-E30 PolarHBondContact O-N 2.78Å
10	L	45.9	Very low	45.4	Very low	40 Å²	40	87.4 Å²	87.4	21%	0.209	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113.3	175.5	-79.3	151.7	0	0	0	108.9	Y27 I28 V29 L94	L10-Y27 HydrophobicContact CB-CD1 4.14Å; L10-Y27 VanDerWaalsContact CD2-CB 3.41Å; L10-Y27 HydrophobicContact CD2-CD1 3.95Å; L10-Y27 HydrophobicContact CD2-CG 3.74Å; L10-I28 WeakPolarHBondContact CA-O 3.47Å; L10-V29 HydrophobicContact CD2-CG2 3.81Å; L10-L94 HydrophobicContact CB-CB 3.85Å; L10-L94 HydrophobicContact CB-CD1 4.12Å; L10-L94 WeakPolarHBondContact O-CB 3.37Å
11	W	50	Low	45.5	Very low	49 Å²	49	87.9 Å²	87.9	19%	0.186	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.4	179.1	-57.2	89.2	0	0	0	110.6	R9 V13 Y27 I28 V89 A92	R9-W11 HydrophobicContact CB-CZ2 4.42Å; W11-V13 HydrophobicContact CB-CG1 4.39Å; W11-V13 PolarHBondContact O-N 2.86Å; W11-Y27 VanDerWaalsContact O-CA 3.22Å; W11-Y27 WeakPolarHBondContact O-CA 3.35Å; W11-I28 HydrophobicContact CB-CB 4.15Å; W11-I28 PolarHBondContact N-O 3.47Å; W11-I28 PolarHBondContact O-N 2.84Å; W11-V89 HydrophobicContact CB-CG1 4.3Å; W11-V89 HydrophobicContact CD2-CG1 4.28Å; W11-V89 HydrophobicContact CE3-CG1 3.42Å; W11-V89 VanDerWaalsContact CE3-CG1 3.42Å; W11-V89 HydrophobicContact CZ3-CG1 4.04Å; W11-A92 HydrophobicContact CE3-CB 4.06Å; W11-A92 HydrophobicContact CH2-CB 4Å; W11-A92 HydrophobicContact CZ3-CB 3.33Å
12	R	53	Low	46.2	Very low	59 Å²	59	78 Å²	78	22%	0.223	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119	171.1	-72	179.4	177.1	176	-2.9	109.4	Y27 L90 L94	R12-Y27 HydrophobicContact CG-CD1 4.3Å; R12-Y27 HydrophobicContact CG-CE1 3.93Å; R12-L90 PolarHBondContact O-N 3.3Å; R12-L90 VanDerWaalsContact O-N 3.1Å; R12-L94 HydrophobicContact CG-CD1 4.46Å
13	V	53.6	Low	47.1	Very low	0 Å²	0	77.2 Å²	77.2	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.6	-177	-71.3	0	0	0	0	113.2	W11 Y24 A25 G26 I28 L87 C88 V89	W11-V13 HydrophobicContact CB-CG1 4.39Å; W11-V13 PolarHBondContact O-N 2.86Å; V13-Y24 HydrophobicContact CG2-CE1 4.45Å; V13-A25 VanDerWaalsContact O-CA 3.26Å; V13-A25 WeakPolarHBondContact O-CA 3.48Å; V13-G26 PolarHBondContact N-O 3.42Å; V13-G26 VanDerWaalsContact N-O 3.16Å; V13-G26 PolarHBondContact O-N 2.82Å; V13-I28 HydrophobicContact CB-CG1 4.5Å; V13-I28 HydrophobicContact CG1-CD1 3.52Å; V13-I28 HydrophobicContact CG1-CG1 3.67Å; V13-I28 HydrophobicContact CG2-CG1 4.06Å; V13-L87 HydrophobicContact CB-CB 4.23Å; V13-L87 HydrophobicContact CB-CD1 4.42Å; V13-L87 HydrophobicContact CB-CD2 4.15Å; V13-L87 HydrophobicContact CB-CG 4.48Å; V13-L87 HydrophobicContact CG1-CB 4.42Å; V13-L87 HydrophobicContact CG2-CD1 4.26Å; V13-L87 HydrophobicContact CG2-CD2 4.19Å; V13-C88 CarbonylContact C-O 3.52Å; V13-C88 WeakPolarHBondContact CA-O 3.42Å; V13-V89 HydrophobicContact CG1-CG2 4.09Å
14	C	57.7	Low	48	Very low	4 Å²	4	71.9 Å²	71.9	3%	0.027	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.1	172.9	-88.7	0	0	0	0	112.2	L16 C22 Y24 V64 C88 L90	C14-L16 PolarHBondContact O-N 3.16Å; C14-C22 HydrophobicContact CB-CB 3.83Å; C14-C22 WeakPolarHBondContact CB-SG 3.42Å; C14-C22 WeakPolarHBondContact SG-CB 3.46Å; C14-C22 CovalentContact SG-SG 2.03Å; C14-C22 PolarHBondContact SG-SG 3.28Å; C14-Y24 VanDerWaalsContact CA-O 3.23Å; C14-Y24 WeakPolarHBondContact CA-O 3.3Å; C14-V64 HydrophobicContact CB-CG1 3.34Å; C14-C88 PolarHBondContact N-O 3.41Å; C14-C88 PolarHBondContact O-N 3.37Å; C14-L90 HydrophobicContact CB-CD1 4.24Å; C14-L90 HydrophobicContact CB-CG 4.44Å; C14-L90 WeakPolarHBondContact SG-CD1 3.23Å
15	K	57.5	Low	48.8	Very low	50 Å²	50	65.7 Å²	65.7	22%	0.217	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	120.8	165.3	-178.3	166.2	177.1	165.1	0	108.6	E17 Y24 Y74 E76 L87	K15-E17 WeakPolarHBondContact CE-OE1 3.28Å; K15-E17 HydrophobicContact CG-CG 4.49Å; K15-Y24 HydrophobicContact CB-CD1 4.37Å; K15-Y24 HydrophobicContact CB-CG 4.23Å; K15-Y74 WeakPolarHBondContact CD-OH 3.4Å; K15-Y74 WeakPolarHBondContact CE-OH 3.44Å; K15-Y74 VanDerWaalsContact CG-OH 3.32Å; K15-Y74 WeakPolarHBondContact CG-OH 2.91Å; K15-Y74 PolarHBondContact NZ-OH 3.44Å; K15-E76 IonicContact NZ-OE2 3.98Å; K15-E76 PolarHBondContact NZ-OE2 3.5Å; K15-L87 HydrophobicContact CB-CD2 4.49Å
16	L	56.1	Low	49.6	Very low	20 Å²	20	59.6 Å²	59.6	11%	0.105	32%	0.316	C	S	.	.			trans	-90.5	114.6	179.4	-69.5	-174.5	0	0	0	109.9	C14 Y61 V64 V65 E86 C88	C14-L16 PolarHBondContact O-N 3.16Å; L16-Y61 HydrophobicContact CB-CE2 3.85Å; L16-Y61 HydrophobicContact CD2-CD2 4.1Å; L16-Y61 HydrophobicContact CD2-CE2 3.98Å; L16-Y61 HydrophobicContact CG-CE2 4.36Å; L16-V64 HydrophobicContact CD2-CB 4.27Å; L16-V64 HydrophobicContact CD2-CG1 3.6Å; L16-V65 HydrophobicContact CD1-CG2 3.97Å; L16-V65 HydrophobicContact CD2-CG2 3.81Å; L16-E86 HydrophobicContact CD1-CB 4.49Å; L16-E86 PolarHBondContact N-O 3.21Å; L16-C88 HydrophobicContact CD1-CB 3.87Å; L16-C88 HydrophobicContact CD2-CB 4.06Å; L16-C88 HydrophobicContact CG-CB 3.9Å
17	E	57.9	Low	50.2	Low	81 Å²	81	59 Å²	59	38%	0.379	30%	0.303	S	S	.	.			trans	-122.1	119.7	166.6	-69.1	-174.7	173.6	0	0	107.8	K15 G19 S20 Y61	K15-E17 WeakPolarHBondContact CE-OE1 3.28Å; K15-E17 HydrophobicContact CG-CG 4.49Å; E17-G19 PolarHBondContact O-N 2.89Å; E17-S20 WeakPolarHBondContact O-CB 3.41Å; E17-S20 PolarHBondContact O-N 3.12Å; E17-Y61 VanDerWaalsContact O-CD2 3.23Å; E17-Y61 WeakPolarHBondContact O-CD2 3.47Å
18	E	58.6	Low	51.1	Low	172 Å²	172	56.5 Å²	56.5	80%	0.804	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	130.6	-177.5	-75.9	-172.1	162.3	0	0	111.4	S20 Y61	E18-S20 PolarHBondContact O-N 3.14Å; E18-Y61 HydrophobicContact CG-CE2 4.3Å
19	G	55.3	Low	51.4	Low	81 Å²	81	52.6 Å²	52.6	84%	0.835	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-3.9	-179.7	0	0	0	0	0	115.3	E17	E17-G19 PolarHBondContact O-N 2.89Å
20	S	50.4	Low	51.6	Low	44 Å²	44	48.1 Å²	48.1	31%	0.308	25%	0.252	S	S	.	.	S	Bend	trans	-96.2	160.4	176.7	-67.8	0	0	0	0	112.1	E17 E18 Y61	E17-S20 WeakPolarHBondContact O-CB 3.41Å; E17-S20 PolarHBondContact O-N 3.12Å; E18-S20 PolarHBondContact O-N 3.14Å; S20-Y61 VanDerWaalsContact O-CB 3.3Å; S20-Y61 WeakPolarHBondContact O-CB 2.99Å; S20-Y61 PolarHBondContact O-N 3.28Å
21	Q	48.3	Very low	51.7	Low	97 Å²	97	49 Å²	49	45%	0.453	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-71.2	151.7	165.3	-66.8	172.9	3.7	0	0	108	L23 Y59	Q21-L23 WeakPolarHBondContact O-CG 3.35Å; Q21-L23 PolarHBondContact O-N 2.91Å; Q21-Y59 WeakPolarHBondContact CA-O 3.13Å
22	C	44.1	Very low	51.3	Low	24 Å²	24	52.5 Å²	52.5	16%	0.162	27%	0.27	C	S	.	.			trans	-57.9	112.8	170.8	158.3	0	0	0	0	108.5	C14 Y24 Y59 V64	C14-C22 HydrophobicContact CB-CB 3.83Å; C14-C22 WeakPolarHBondContact CB-SG 3.42Å; C14-C22 WeakPolarHBondContact SG-CB 3.46Å; C14-C22 CovalentContact SG-SG 2.03Å; C14-C22 PolarHBondContact SG-SG 3.28Å; C22-Y24 PolarHBondContact SG-O 3.38Å; C22-Y59 PolarHBondContact N-O 3.16Å; C22-Y59 VanDerWaalsContact N-O 3.1Å; C22-V64 HydrophobicContact CB-CB 4.47Å; C22-V64 HydrophobicContact CB-CG1 4.34Å; C22-V64 HydrophobicContact CB-CG2 3.44Å; C22-V64 VanDerWaalsContact CB-CG2 3.44Å
23	L	46.2	Very low	51.2	Low	124 Å²	124	52.4 Å²	52.4	65%	0.649	27%	0.274	S	S	*	.			trans	-85.7	-17.6	-173.6	-67.6	177.9	0	0	0	112.3	Q21	Q21-L23 WeakPolarHBondContact O-CG 3.35Å; Q21-L23 PolarHBondContact O-N 2.91Å
24	Y	50.5	Low	51.1	Low	41 Å²	41	56.2 Å²	56.2	16%	0.161	30%	0.299	C	S	.	.			trans	-134.8	127.6	-161.6	-170.9	-99.7	0	0	0	109.5	V13 C14 K15 C22 G26 V43 E45	V13-Y24 HydrophobicContact CG2-CE1 4.45Å; C14-Y24 VanDerWaalsContact CA-O 3.23Å; C14-Y24 WeakPolarHBondContact CA-O 3.3Å; K15-Y24 HydrophobicContact CB-CD1 4.37Å; K15-Y24 HydrophobicContact CB-CG 4.23Å; C22-Y24 PolarHBondContact SG-O 3.38Å; Y24-G26 VanDerWaalsContact CE1-N 3.33Å; Y24-V43 HydrophobicContact CE1-CG1 4.09Å; Y24-V43 WeakPolarHBondContact OH-CG1 3.39Å; Y24-E45 HydrophobicContact CE2-CB 3.9Å; Y24-E45 HydrophobicContact CE2-CG 3.76Å; Y24-E45 WeakPolarHBondContact OH-CA 3.43Å; Y24-E45 VanDerWaalsContact OH-CG 3.29Å; Y24-E45 WeakPolarHBondContact OH-CG 3.48Å; Y24-E45 PolarHBondContact OH-N 3.13Å
25	A	50.6	Low	50.8	Low	7 Å²	7	64.5 Å²	64.5	6%	0.058	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	85.4	158.2	0	0	0	0	0	109.4	V13 G46 C48	V13-A25 VanDerWaalsContact O-CA 3.26Å; V13-A25 WeakPolarHBondContact O-CA 3.48Å; A25-G46 VanDerWaalsContact O-O 3.06Å; A25-C48 HydrophobicContact CB-CB 3.26Å; A25-C48 WeakPolarHBondContact CB-SG 2.98Å
26	G	51.2	Low	50.7	Low	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-179.7	165.9	0	0	0	0	0	111	V13 Y24 E44	V13-G26 PolarHBondContact N-O 3.42Å; V13-G26 VanDerWaalsContact N-O 3.16Å; V13-G26 PolarHBondContact O-N 2.82Å; Y24-G26 VanDerWaalsContact CE1-N 3.33Å; G26-E44 VanDerWaalsContact CA-O 3.25Å; G26-E44 WeakPolarHBondContact CA-O 3.33Å
27	Y	49.8	Very low	50.2	Low	62 Å²	62	68.7 Å²	68.7	24%	0.243	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.1	166.6	-54.3	-90.9	0	0	0	109.1	L10 W11 R12 E44 L94	L10-Y27 HydrophobicContact CB-CD1 4.14Å; L10-Y27 VanDerWaalsContact CD2-CB 3.41Å; L10-Y27 HydrophobicContact CD2-CD1 3.95Å; L10-Y27 HydrophobicContact CD2-CG 3.74Å; W11-Y27 VanDerWaalsContact O-CA 3.22Å; W11-Y27 WeakPolarHBondContact O-CA 3.35Å; R12-Y27 HydrophobicContact CG-CD1 4.3Å; R12-Y27 HydrophobicContact CG-CE1 3.93Å; Y27-E44 PolarHBondContact N-O 3.36Å; Y27-E44 PolarHBondContact O-N 3.38Å; Y27-L94 HydrophobicContact CD1-CD1 4.05Å; Y27-L94 HydrophobicContact CE1-CD1 3.65Å
28	I	51.3	Low	49.4	Very low	9 Å²	9	70.4 Å²	70.4	5%	0.046	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.4	160.5	-58.4	177.6	0	0	0	106.4	L10 W11 V13 W41 V43 F72 L87	L10-I28 WeakPolarHBondContact CA-O 3.47Å; W11-I28 HydrophobicContact CB-CB 4.15Å; W11-I28 PolarHBondContact N-O 3.47Å; W11-I28 PolarHBondContact O-N 2.84Å; V13-I28 HydrophobicContact CB-CG1 4.5Å; V13-I28 HydrophobicContact CG1-CD1 3.52Å; V13-I28 HydrophobicContact CG1-CG1 3.67Å; V13-I28 HydrophobicContact CG2-CG1 4.06Å; I28-W41 HydrophobicContact CG2-CB 3.94Å; I28-W41 HydrophobicContact CG2-CD2 4.31Å; I28-W41 HydrophobicContact CG2-CE3 3.62Å; I28-W41 HydrophobicContact CG2-CG 4.48Å; I28-W41 HydrophobicContact CG2-CZ3 4.48Å; I28-V43 HydrophobicContact CG1-CG2 4.11Å; I28-F72 HydrophobicContact CD1-CD2 3.98Å; I28-F72 HydrophobicContact CD1-CE2 4.31Å; I28-L87 HydrophobicContact CD1-CD1 4.34Å
29	V	49.3	Very low	48.6	Very low	14 Å²	14	64.1 Å²	64.1	9%	0.085	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	117	168.8	-179	0	0	0	0	108.5	E8 R9 L10 I31 W41 E42	E8-V29 HydrophobicContact CB-CG1 3.86Å; E8-V29 HydrophobicContact CG-CG1 3.65Å; R9-V29 WeakPolarHBondContact O-CA 3.48Å; L10-V29 HydrophobicContact CD2-CG2 3.81Å; V29-I31 HydrophobicContact CG1-CG1 3.99Å; V29-I31 PolarHBondContact O-N 3.1Å; V29-W41 WeakPolarHBondContact O-CA 3.43Å; V29-E42 PolarHBondContact N-O 3.18Å; V29-E42 PolarHBondContact O-N 2.88Å
30	E	46.6	Very low	48.2	Very low	32 Å²	32	65.1 Å²	65.1	15%	0.15	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	106.9	169.6	-169.8	169.3	-165.5	0	0	109.3	R9 P39 W41	R9-E30 HydrophobicContact CB-CB 4.3Å; R9-E30 WeakPolarHBondContact CD-OE2 3.3Å; R9-E30 IonicContact CZ-OE2 2.88Å; R9-E30 IonicContact NH1-OE2 3.88Å; R9-E30 PolarHBondContact NH1-OE2 3.4Å; R9-E30 PolarHBondContact O-N 2.78Å; E30-P39 HydrophobicContact CG-CB 3.95Å; E30-W41 HydrophobicContact CB-CE3 3.59Å; E30-W41 HydrophobicContact CB-CH2 4.08Å; E30-W41 HydrophobicContact CB-CZ3 3.31Å; E30-W41 HydrophobicContact CG-CD2 4.41Å; E30-W41 HydrophobicContact CG-CE3 3.73Å; E30-W41 HydrophobicContact CG-CH2 3.45Å; E30-W41 VanDerWaalsContact CG-CH2 3.45Å; E30-W41 HydrophobicContact CG-CZ2 4.13Å; E30-W41 HydrophobicContact CG-CZ3 3.23Å; E30-W41 WeakPolarHBondContact OE1-CH2 2.83Å
31	I	48.5	Very low	48.1	Very low	60 Å²	60	66.4 Å²	66.4	31%	0.308	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	102.1	172.3	-54.5	177.3	0	0	0	107.1	V29 D33 D40 E42	V29-I31 HydrophobicContact CG1-CG1 3.99Å; V29-I31 PolarHBondContact O-N 3.1Å; I31-D33 PolarHBondContact O-N 2.9Å; I31-D40 HydrophobicContact CB-CB 4.46Å; I31-D40 PolarHBondContact N-O 3.16Å; I31-D40 PolarHBondContact O-N 2.02Å; I31-E42 HydrophobicContact CD1-CG 4.48Å
32	W	41.8	Very low	48.1	Very low	121 Å²	121	67 Å²	67	46%	0.458	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	110.3	174.1	-172.4	72.7	0	0	0	109.9	P34	W32-P34 HydrophobicContact CE3-CB 4.1Å; W32-P34 HydrophobicContact CE3-CG 3.81Å; W32-P34 HydrophobicContact CH2-CB 3.58Å; W32-P34 HydrophobicContact CH2-CG 4.17Å; W32-P34 HydrophobicContact CZ2-CB 4.36Å; W32-P34 HydrophobicContact CZ3-CB 3.43Å; W32-P34 VanDerWaalsContact CZ3-CB 3.43Å; W32-P34 HydrophobicContact CZ3-CG 3.47Å; W32-P34 VanDerWaalsContact CZ3-CG 3.47Å; W32-P34 WeakPolarHBondContact O-CD 3.44Å
33	D	49.2	Very low	48.3	Very low	57 Å²	57	67.6 Å²	67.6	31%	0.305	35%	0.346	S	S	.	.			trans	-86.6	112.6	166.8	178.7	-1	0	0	0	109.5	I31 Q35 T36 S37	I31-D33 PolarHBondContact O-N 2.9Å; D33-Q35 PolarHBondContact O-N 2.88Å; D33-Q35 VanDerWaalsContact O-N 3.14Å; D33-Q35 WeakPolarHBondContact OD1-CB 3.21Å; D33-Q35 PolarHBondContact OD1-N 2.81Å; D33-T36 WeakPolarHBondContact CB-OG1 3.5Å; D33-T36 PolarHBondContact O-N 2.78Å; D33-T36 WeakPolarHBondContact OD2-CG2 3.22Å; D33-T36 PolarHBondContact OD2-OG1 2.94Å; D33-S37 PolarHBondContact O-N 3.25Å
34	P	51.8	Low	48.5	Very low	80 Å²	80	66.6 Å²	66.6	52%	0.519	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.7	179.3	-13.5	22	0	0	0	113.6	W32	W32-P34 HydrophobicContact CE3-CB 4.1Å; W32-P34 HydrophobicContact CE3-CG 3.81Å; W32-P34 HydrophobicContact CH2-CB 3.58Å; W32-P34 HydrophobicContact CH2-CG 4.17Å; W32-P34 HydrophobicContact CZ2-CB 4.36Å; W32-P34 HydrophobicContact CZ3-CB 3.43Å; W32-P34 VanDerWaalsContact CZ3-CB 3.43Å; W32-P34 HydrophobicContact CZ3-CG 3.47Å; W32-P34 VanDerWaalsContact CZ3-CG 3.47Å; W32-P34 WeakPolarHBondContact O-CD 3.44Å
35	Q	51.1	Low	48.3	Very low	178 Å²	178	69.5 Å²	69.5	83%	0.832	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-38.3	-172.2	-59.1	-170.8	6.7	0	0	112	D33	D33-Q35 PolarHBondContact O-N 2.88Å; D33-Q35 VanDerWaalsContact O-N 3.14Å; D33-Q35 WeakPolarHBondContact OD1-CB 3.21Å; D33-Q35 PolarHBondContact OD1-N 2.81Å
36	T	55.9	Low	48	Very low	74 Å²	74	70.1 Å²	70.1	45%	0.454	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-22.6	-179.3	60.4	0	0	0	0	111.8	D33 I38	D33-T36 WeakPolarHBondContact CB-OG1 3.5Å; D33-T36 PolarHBondContact O-N 2.78Å; D33-T36 WeakPolarHBondContact OD2-CG2 3.22Å; D33-T36 PolarHBondContact OD2-OG1 2.94Å; T36-I38 PolarHBondContact O-N 3.18Å; T36-I38 PolarHBondContact OG1-N 3.14Å; T36-I38 PolarHBondContact OG1-O 2.92Å
37	S	46.5	Very low	47.4	Very low	85 Å²	85	76.4 Å²	76.4	59%	0.594	40%	0.398	S	S	*	.			trans	54	16.7	-167.4	-58.9	0	0	0	0	113.1	D33	D33-S37 PolarHBondContact O-N 3.25Å
38	I	40.5	Very low	46.9	Very low	116 Å²	116	75.4 Å²	75.4	60%	0.595	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-103.7	117.7	175.4	-61.7	169.4	0	0	0	105.2	T36 D40	T36-I38 PolarHBondContact O-N 3.18Å; T36-I38 PolarHBondContact OG1-N 3.14Å; T36-I38 PolarHBondContact OG1-O 2.92Å; I38-D40 PolarHBondContact O-N 3.46Å
39	P	42.7	Very low	46.3	Very low	40 Å²	40	78.8 Å²	78.8	26%	0.26	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	124.8	171.8	27.6	-31.2	0	0	0	108.2	E30 W41	E30-P39 HydrophobicContact CG-CB 3.95Å; P39-W41 HydrophobicContact CB-CD2 4.39Å; P39-W41 HydrophobicContact CB-CH2 4.12Å; P39-W41 HydrophobicContact CB-CZ2 3.39Å; P39-W41 HydrophobicContact CG-CH2 4.33Å; P39-W41 HydrophobicContact CG-CZ2 3.33Å; P39-W41 VanDerWaalsContact O-CD1 3.26Å; P39-W41 PolarHBondContact O-NE1 2.93Å
40	D	46.7	Very low	45.6	Very low	103 Å²	103	78.9 Å²	78.9	55%	0.551	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	148	166.6	-152.1	-7.3	0	0	0	108.4	I31 I38	I31-D40 HydrophobicContact CB-CB 4.46Å; I31-D40 PolarHBondContact N-O 3.16Å; I31-D40 PolarHBondContact O-N 2.02Å; I38-D40 PolarHBondContact O-N 3.46Å
41	W	47.7	Very low	45	Very low	71 Å²	71	81.4 Å²	81.4	27%	0.269	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	118.8	-173	-41.9	81.7	0	0	0	110.5	I28 V29 E30 P39	I28-W41 HydrophobicContact CG2-CB 3.94Å; I28-W41 HydrophobicContact CG2-CD2 4.31Å; I28-W41 HydrophobicContact CG2-CE3 3.62Å; I28-W41 HydrophobicContact CG2-CG 4.48Å; I28-W41 HydrophobicContact CG2-CZ3 4.48Å; V29-W41 WeakPolarHBondContact O-CA 3.43Å; E30-W41 HydrophobicContact CB-CE3 3.59Å; E30-W41 HydrophobicContact CB-CH2 4.08Å; E30-W41 HydrophobicContact CB-CZ3 3.31Å; E30-W41 HydrophobicContact CG-CD2 4.41Å; E30-W41 HydrophobicContact CG-CE3 3.73Å; E30-W41 HydrophobicContact CG-CH2 3.45Å; E30-W41 VanDerWaalsContact CG-CH2 3.45Å; E30-W41 HydrophobicContact CG-CZ2 4.13Å; E30-W41 HydrophobicContact CG-CZ3 3.23Å; E30-W41 WeakPolarHBondContact OE1-CH2 2.83Å; P39-W41 HydrophobicContact CB-CD2 4.39Å; P39-W41 HydrophobicContact CB-CH2 4.12Å; P39-W41 HydrophobicContact CB-CZ2 3.39Å; P39-W41 HydrophobicContact CG-CH2 4.33Å; P39-W41 HydrophobicContact CG-CZ2 3.33Å; P39-W41 VanDerWaalsContact O-CD1 3.26Å; P39-W41 PolarHBondContact O-NE1 2.93Å
42	E	48.8	Very low	44.4	Very low	109 Å²	109	89 Å²	89	51%	0.509	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.6	171.9	-65.4	-171.9	169	0	0	109.4	V29 I31	V29-E42 PolarHBondContact N-O 3.18Å; V29-E42 PolarHBondContact O-N 2.88Å; I31-E42 HydrophobicContact CD1-CG 4.48Å
43	V	47.9	Very low	44.2	Very low	37 Å²	37	91.6 Å²	91.6	22%	0.224	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	107.6	172	-179.9	0	0	0	0	107.5	Y24 I28 L87 L112	Y24-V43 HydrophobicContact CE1-CG1 4.09Å; Y24-V43 WeakPolarHBondContact OH-CG1 3.39Å; I28-V43 HydrophobicContact CG1-CG2 4.11Å; V43-L87 HydrophobicContact CG2-CD1 4.25Å; V43-L112 HydrophobicContact CB-CD1 4.42Å; V43-L112 HydrophobicContact CG2-CD1 3.91Å; V43-L112 HydrophobicContact CG2-CD2 3.81Å; V43-L112 HydrophobicContact CG2-CG 4.3Å
44	E	50	Low	43.4	Very low	102 Å²	102	92.3 Å²	92.3	48%	0.477	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.3	172.3	-67.2	-171.4	164	0	0	109.9	G26 Y27 G46	G26-E44 VanDerWaalsContact CA-O 3.25Å; G26-E44 WeakPolarHBondContact CA-O 3.33Å; Y27-E44 PolarHBondContact N-O 3.36Å; Y27-E44 PolarHBondContact O-N 3.38Å; E44-G46 PolarHBondContact O-N 3.49Å
45	E	45.7	Very low	42.4	Very low	102 Å²	102	91.4 Å²	91.4	48%	0.477	49%	0.487	S	S	.	.			trans	-68.5	112.5	172.2	-49.4	-166.1	134.3	0	0	109.9	Y24 I106	Y24-E45 HydrophobicContact CE2-CB 3.9Å; Y24-E45 HydrophobicContact CE2-CG 3.76Å; Y24-E45 WeakPolarHBondContact OH-CA 3.43Å; Y24-E45 VanDerWaalsContact OH-CG 3.29Å; Y24-E45 WeakPolarHBondContact OH-CG 3.48Å; Y24-E45 PolarHBondContact OH-N 3.13Å; E45-I106 HydrophobicContact CB-CD1 3.42Å; E45-I106 VanDerWaalsContact CB-CD1 3.42Å; E45-I106 HydrophobicContact CG-CD1 3.45Å; E45-I106 VanDerWaalsContact CG-CD1 3.45Å
46	G	44.4	Very low	41.7	Very low	20 Å²	20	86.7 Å²	86.7	21%	0.206	47%	0.473	C	S	.	.			trans	-113.6	144.7	171.4	0	0	0	0	0	110.8	A25 E44 C48	A25-G46 VanDerWaalsContact O-O 3.06Å; E44-G46 PolarHBondContact O-N 3.49Å; G46-C48 PolarHBondContact O-N 3.22Å
47	V	39.7	Very low	40.9	Very low	133 Å²	133	87.4 Å²	87.4	81%	0.806	48%	0.481	S	S	*	.			trans	-72.7	118.9	163.3	-179	0	0	0	0	107.1	D49	V47-D49 PolarHBondContact O-N 2.88Å
48	C	38.3	Very low	40.6	Very low	41 Å²	41	91.6 Å²	91.6	28%	0.277	48%	0.484	S	S	.	.			trans	-64.7	96.4	173.5	-160.4	0	0	0	0	110.1	A25 G46 C50	A25-C48 HydrophobicContact CB-CB 3.26Å; A25-C48 WeakPolarHBondContact CB-SG 2.98Å; G46-C48 PolarHBondContact O-N 3.22Å; C48-C50 PolarHBondContact O-N 2.89Å; C48-C50 PolarHBondContact SG-SG 2.03Å
49	D	38.3	Very low	40.6	Very low	80 Å²	80	89.2 Å²	89.2	43%	0.428	47%	0.468	S	S	.	.			trans	-75.8	76	168	-174.1	10.2	0	0	0	109.7	V47 S51 R52	V47-D49 PolarHBondContact O-N 2.88Å; D49-S51 PolarHBondContact O-N 3.15Å; D49-S51 VanDerWaalsContact OD1-CB 3.25Å; D49-S51 WeakPolarHBondContact OD1-CB 3.31Å; D49-S51 PolarHBondContact OD1-N 2.81Å; D49-S51 PolarHBondContact OD1-OG 3.06Å; D49-R52 IonicContact OD2-NE 3.21Å
50	C	35.8	Very low	40.9	Very low	16 Å²	16	89.8 Å²	89.8	11%	0.108	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-62.8	-18.6	176.5	-56.1	0	0	0	0	112.3	C48 R52 R53 L55	C48-C50 PolarHBondContact O-N 2.89Å; C48-C50 PolarHBondContact SG-SG 2.03Å; C50-R52 VanDerWaalsContact C-N 3.26Å; C50-R52 PolarHBondContact O-N 2.75Å; C50-R53 PolarHBondContact O-N 3.45Å; C50-L55 CarbonylContact C-O 3.55Å; C50-L55 HydrophobicContact CB-CB 4.01Å; C50-L55 WeakPolarHBondContact CB-O 3.01Å; C50-L55 PolarHBondContact O-N 3.1Å
51	S	33.9	Very low	40.9	Very low	85 Å²	85	87 Å²	87	59%	0.594	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-62.1	-32.5	-172.3	78.1	0	0	0	0	112.7	D49 R53 G54	D49-S51 PolarHBondContact O-N 3.15Å; D49-S51 VanDerWaalsContact OD1-CB 3.25Å; D49-S51 WeakPolarHBondContact OD1-CB 3.31Å; D49-S51 PolarHBondContact OD1-N 2.81Å; D49-S51 PolarHBondContact OD1-OG 3.06Å; S51-R53 PolarHBondContact O-N 2.83Å; S51-R53 VanDerWaalsContact O-N 3.1Å; S51-G54 PolarHBondContact O-N 2.87Å
52	R	36.3	Very low	40.8	Very low	218 Å²	218	89.4 Å²	89.4	82%	0.823	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-67	-10.5	-177.1	-76.3	-169.8	174.8	-163.4	-2.1	115.5	D49 C50	D49-R52 IonicContact OD2-NE 3.21Å; C50-R52 VanDerWaalsContact C-N 3.26Å; C50-R52 PolarHBondContact O-N 2.75Å
53	R	36.8	Very low	41.1	Very low	176 Å²	176	86.8 Å²	86.8	66%	0.664	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-126	20.2	172	-75.4	-153.1	174.4	-178.7	1.2	114.1	C50 S51 L55	C50-R53 PolarHBondContact O-N 3.45Å; S51-R53 PolarHBondContact O-N 2.83Å; S51-R53 VanDerWaalsContact O-N 3.1Å; R53-L55 HydrophobicContact CB-CD1 4.17Å; R53-L55 HydrophobicContact CB-CG 4Å; R53-L55 PolarHBondContact O-N 3.47Å
54	G	32	Very low	41.2	Very low	73 Å²	73	85.1 Å²	85.1	75%	0.753	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	17.9	-178	0	0	0	0	0	113.1	S51	S51-G54 PolarHBondContact O-N 2.87Å
55	L	32	Very low	41.4	Very low	61 Å²	61	81.9 Å²	81.9	32%	0.319	44%	0.442	S	S	.	.			trans	-87	119.5	175	-53.4	-179.7	0	0	0	105.5	C50 R53 Y59	C50-L55 CarbonylContact C-O 3.55Å; C50-L55 HydrophobicContact CB-CB 4.01Å; C50-L55 WeakPolarHBondContact CB-O 3.01Å; C50-L55 PolarHBondContact O-N 3.1Å; R53-L55 HydrophobicContact CB-CD1 4.17Å; R53-L55 HydrophobicContact CB-CG 4Å; R53-L55 PolarHBondContact O-N 3.47Å; L55-Y59 HydrophobicContact CB-CE2 4.11Å; L55-Y59 VanDerWaalsContact CB-OH 3.31Å; L55-Y59 WeakPolarHBondContact CB-OH 3.32Å; L55-Y59 WeakPolarHBondContact CD2-OH 3.44Å; L55-Y59 WeakPolarHBondContact CG-OH 3.34Å
56	S	35.5	Very low	42	Very low	79 Å²	79	80.2 Å²	80.2	55%	0.552	45%	0.452	S	S	*	.			trans	-67.3	143.9	175.2	52.7	0	0	0	0	109.4	R58	S56-R58 PolarHBondContact O-N 3.43Å
57	S	39.4	Very low	42.6	Very low	89 Å²	89	83.8 Å²	83.8	62%	0.622	47%	0.466	S	S	*	.	S	Bend	trans	-63.2	19.9	178.8	50.9	0	0	0	0	115.3
58	R	39.6	Very low	43.3	Very low	172 Å²	172	78.9 Å²	78.9	65%	0.649	44%	0.437	S	S	*	.			trans	-143.2	76.4	-171.6	-59.6	-174.2	-175.4	-174.4	-1.2	109.4	S56	S56-R58 PolarHBondContact O-N 3.43Å
59	Y	42	Very low	44.4	Very low	66 Å²	66	81.1 Å²	81.1	26%	0.259	45%	0.45	S	S	.	.			trans	-81.1	131.1	160.4	-70.5	-76	0	0	0	108.4	Q21 C22 L55 T63 V64	Q21-Y59 WeakPolarHBondContact CA-O 3.13Å; C22-Y59 PolarHBondContact N-O 3.16Å; C22-Y59 VanDerWaalsContact N-O 3.1Å; L55-Y59 HydrophobicContact CB-CE2 4.11Å; L55-Y59 VanDerWaalsContact CB-OH 3.31Å; L55-Y59 WeakPolarHBondContact CB-OH 3.32Å; L55-Y59 WeakPolarHBondContact CD2-OH 3.44Å; L55-Y59 WeakPolarHBondContact CG-OH 3.34Å; Y59-T63 HydrophobicContact CD1-CG2 3.54Å; Y59-T63 HydrophobicContact CE1-CG2 4.09Å; Y59-V64 VanDerWaalsContact CB-CG2 3.5Å; Y59-V64 HydrophobicContact CG-CG2 4.49Å
60	S	47.7	Very low	45.1	Very low	53 Å²	53	81.5 Å²	81.5	37%	0.371	45%	0.452	S	S	.	.	B	Isolated β-bridge	trans	-63.2	148.9	166.6	64.1	0	0	0	0	108.9	D62 T63 V64	S60-D62 PolarHBondContact O-N 3.44Å; S60-D62 VanDerWaalsContact O-N 3.13Å; S60-T63 WeakPolarHBondContact O-CB 3.39Å; S60-T63 PolarHBondContact O-N 3.22Å; S60-T63 PolarHBondContact OG-N 3.34Å; S60-T63 PolarHBondContact OG-OG1 3.22Å; S60-V64 WeakPolarHBondContact O-CG2 3.23Å; S60-V64 PolarHBondContact O-N 3.22Å; S60-V64 VanDerWaalsContact O-N 3.14Å
61	Y	47	Very low	46.1	Very low	44 Å²	44	86.3 Å²	86.3	17%	0.173	47%	0.468	C	S	.	.	H	α-helix	trans	-40.7	-49.1	171.7	178.4	-93.1	0	0	0	112.2	L16 E17 E18 S20 T63 V64 V65	L16-Y61 HydrophobicContact CB-CE2 3.85Å; L16-Y61 HydrophobicContact CD2-CD2 4.1Å; L16-Y61 HydrophobicContact CD2-CE2 3.98Å; L16-Y61 HydrophobicContact CG-CE2 4.36Å; E17-Y61 VanDerWaalsContact O-CD2 3.23Å; E17-Y61 WeakPolarHBondContact O-CD2 3.47Å; E18-Y61 HydrophobicContact CG-CE2 4.3Å; S20-Y61 VanDerWaalsContact O-CB 3.3Å; S20-Y61 WeakPolarHBondContact O-CB 2.99Å; S20-Y61 PolarHBondContact O-N 3.28Å; Y61-T63 VanDerWaalsContact C-N 3.29Å; Y61-T63 PolarHBondContact O-N 3.18Å; Y61-V64 WeakPolarHBondContact O-CB 3.13Å; Y61-V64 PolarHBondContact O-N 3.19Å; Y61-V64 VanDerWaalsContact O-N 3.12Å; Y61-V65 HydrophobicContact CD1-CG2 3.98Å; Y61-V65 HydrophobicContact CD2-CG2 4.45Å; Y61-V65 HydrophobicContact CE1-CG2 3.62Å; Y61-V65 HydrophobicContact CE2-CG2 4.16Å; Y61-V65 HydrophobicContact CG-CG2 4.36Å; Y61-V65 WeakPolarHBondContact O-CB 3.09Å; Y61-V65 WeakPolarHBondContact O-CG2 3.31Å; Y61-V65 PolarHBondContact O-N 2.89Å
62	D	45.6	Very low	47	Very low	122 Å²	122	84.9 Å²	84.9	65%	0.652	45%	0.451	S	S	*	.	H	α-helix	trans	-60.7	-36.9	-178.7	-56.2	-37.6	0	0	0	113.2	S60 G66	S60-D62 PolarHBondContact O-N 3.44Å; S60-D62 VanDerWaalsContact O-N 3.13Å; D62-G66 PolarHBondContact O-N 3.29Å
63	T	54.6	Low	47.6	Very low	54 Å²	54	76.4 Å²	76.4	33%	0.331	43%	0.432	S	S	.	.	H	α-helix	trans	-70.7	-38.2	178.6	-51	0	0	0	0	111	Y59 S60 Y61 G66 N67	Y59-T63 HydrophobicContact CD1-CG2 3.54Å; Y59-T63 HydrophobicContact CE1-CG2 4.09Å; S60-T63 WeakPolarHBondContact O-CB 3.39Å; S60-T63 PolarHBondContact O-N 3.22Å; S60-T63 PolarHBondContact OG-N 3.34Å; S60-T63 PolarHBondContact OG-OG1 3.22Å; Y61-T63 VanDerWaalsContact C-N 3.29Å; Y61-T63 PolarHBondContact O-N 3.18Å; T63-G66 PolarHBondContact O-N 3.35Å; T63-N67 PolarHBondContact O-N 3.24Å; T63-N67 VanDerWaalsContact O-N 3.16Å; T63-N67 PolarHBondContact O-ND2 3.31Å
64	V	51	Low	48.4	Very low	1 Å²	1	68.8 Å²	68.8	1%	0.006	40%	0.403	C	S	.	.	H	α-helix	trans	-66.1	-49.2	178.4	176	0	0	0	0	109.2	C14 L16 C22 Y59 S60 Y61 G66 N67 C68 C88 L90	C14-V64 HydrophobicContact CB-CG1 3.34Å; L16-V64 HydrophobicContact CD2-CB 4.27Å; L16-V64 HydrophobicContact CD2-CG1 3.6Å; C22-V64 HydrophobicContact CB-CB 4.47Å; C22-V64 HydrophobicContact CB-CG1 4.34Å; C22-V64 HydrophobicContact CB-CG2 3.44Å; C22-V64 VanDerWaalsContact CB-CG2 3.44Å; Y59-V64 VanDerWaalsContact CB-CG2 3.5Å; Y59-V64 HydrophobicContact CG-CG2 4.49Å; S60-V64 WeakPolarHBondContact O-CG2 3.23Å; S60-V64 PolarHBondContact O-N 3.22Å; S60-V64 VanDerWaalsContact O-N 3.14Å; Y61-V64 WeakPolarHBondContact O-CB 3.13Å; Y61-V64 PolarHBondContact O-N 3.19Å; Y61-V64 VanDerWaalsContact O-N 3.12Å; V64-G66 VanDerWaalsContact C-N 3.32Å; V64-G66 PolarHBondContact O-N 2.9Å; V64-N67 PolarHBondContact O-N 3.02Å; V64-C68 PolarHBondContact O-N 3.07Å; V64-C68 VanDerWaalsContact O-N 3.14Å; V64-C88 HydrophobicContact CG1-CB 4.17Å; V64-C88 PolarHBondContact O-SG 2.96Å; V64-L90 HydrophobicContact CB-CD2 4.26Å; V64-L90 HydrophobicContact CG1-CD1 4.4Å; V64-L90 HydrophobicContact CG1-CD2 3.72Å; V64-L90 HydrophobicContact CG1-CG 4.32Å; V64-L90 WeakPolarHBondContact O-CD2 3.45Å
65	V	53.8	Low	49.3	Very low	35 Å²	35	67.4 Å²	67.4	21%	0.212	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-40.6	177.3	170.4	0	0	0	0	111.6	L16 Y61 N67 C68	L16-V65 HydrophobicContact CD1-CG2 3.97Å; L16-V65 HydrophobicContact CD2-CG2 3.81Å; Y61-V65 HydrophobicContact CD1-CG2 3.98Å; Y61-V65 HydrophobicContact CD2-CG2 4.45Å; Y61-V65 HydrophobicContact CE1-CG2 3.62Å; Y61-V65 HydrophobicContact CE2-CG2 4.16Å; Y61-V65 HydrophobicContact CG-CG2 4.36Å; Y61-V65 WeakPolarHBondContact O-CB 3.09Å; Y61-V65 WeakPolarHBondContact O-CG2 3.31Å; Y61-V65 PolarHBondContact O-N 2.89Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.17Å; V65-C68 VanDerWaalsContact O-CB 3.28Å; V65-C68 WeakPolarHBondContact O-CB 3.43Å; V65-C68 PolarHBondContact O-N 2.96Å
66	G	58	Low	50.4	Low	66 Å²	66	67.1 Å²	67.1	68%	0.68	38%	0.377	S	S	*	.	H	α-helix	trans	-66.9	-26.1	178.5	0	0	0	0	0	114.4	D62 T63 V64	D62-G66 PolarHBondContact O-N 3.29Å; T63-G66 PolarHBondContact O-N 3.35Å; V64-G66 VanDerWaalsContact C-N 3.32Å; V64-G66 PolarHBondContact O-N 2.9Å
67	N	57.5	Low	51	Low	95 Å²	95	69.6 Å²	69.6	51%	0.508	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	7.3	177.7	-67.7	-59.8	0	0	0	113.2	T63 V64 V65 V69 L90	T63-N67 PolarHBondContact O-N 3.24Å; T63-N67 VanDerWaalsContact O-N 3.16Å; T63-N67 PolarHBondContact O-ND2 3.31Å; V64-N67 PolarHBondContact O-N 3.02Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.17Å; N67-V69 PolarHBondContact O-N 3.03Å; N67-V69 VanDerWaalsContact O-N 3.15Å; N67-L90 HydrophobicContact CB-CD2 4.26Å
68	C	55.3	Low	51.3	Low	30 Å²	30	74.1 Å²	74.1	20%	0.203	38%	0.383	C	S	.	.			trans	-67.1	112.8	-176.1	-147.6	0	0	0	0	111.4	V64 V65 N70 C88 V89	V64-C68 PolarHBondContact O-N 3.07Å; V64-C68 VanDerWaalsContact O-N 3.14Å; V65-C68 VanDerWaalsContact O-CB 3.28Å; V65-C68 WeakPolarHBondContact O-CB 3.43Å; V65-C68 PolarHBondContact O-N 2.96Å; C68-N70 PolarHBondContact SG-O 3.21Å; C68-C88 WeakPolarHBondContact CA-SG 3.35Å; C68-C88 HydrophobicContact CB-CB 4.32Å; C68-C88 WeakPolarHBondContact CB-SG 3.26Å; C68-C88 WeakPolarHBondContact SG-CA 3.46Å; C68-C88 WeakPolarHBondContact SG-CB 3.4Å; C68-C88 CovalentContact SG-SG 2.02Å; C68-C88 PolarHBondContact SG-SG 3.29Å; C68-V89 CarbonylContact C-O 3.17Å; C68-V89 WeakPolarHBondContact CA-O 3.35Å
69	V	60.1	Low	51.9	Low	89 Å²	89	72.2 Å²	72.2	54%	0.539	39%	0.386	S	S	.	.	S	Bend	trans	-80.6	-29.4	175.5	-61.7	0	0	0	0	111.9	N67 V89	N67-V69 PolarHBondContact O-N 3.03Å; N67-V69 VanDerWaalsContact O-N 3.15Å; V69-V89 HydrophobicContact CG2-CB 3.73Å; V69-V89 HydrophobicContact CG2-CG1 3.4Å; V69-V89 WeakPolarHBondContact CG2-O 3.19Å; V69-V89 PolarHBondContact N-O 2.93Å
70	N	52.5	Low	52.8	Low	87 Å²	87	72.8 Å²	72.8	47%	0.465	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	156.6	174.8	-151.9	-7.4	0	0	0	111.4	C68 F72 V89	C68-N70 PolarHBondContact SG-O 3.21Å; N70-F72 HydrophobicContact CB-CE2 4.34Å; N70-F72 HydrophobicContact CB-CZ 4.44Å; N70-V89 HydrophobicContact CB-CB 4.23Å; N70-V89 HydrophobicContact CB-CG2 4.1Å; N70-V89 PolarHBondContact O-N 3.34Å
71	R	58.2	Low	52.9	Low	118 Å²	118	76.9 Å²	76.9	45%	0.445	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.8	177	-64.8	-175.4	-170.8	-168	5.5	110.6	L87	R71-L87 CarbonylContact C-O 3.53Å; R71-L87 VanDerWaalsContact CA-O 3.3Å; R71-L87 WeakPolarHBondContact CA-O 3.29Å
72	F	53.3	Low	53.3	Low	54 Å²	54	77.8 Å²	77.8	24%	0.237	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.9	175.9	-62.2	-70.9	0	0	0	109.7	I28 N70 E86 L87 V89	I28-F72 HydrophobicContact CD1-CD2 3.98Å; I28-F72 HydrophobicContact CD1-CE2 4.31Å; N70-F72 HydrophobicContact CB-CE2 4.34Å; N70-F72 HydrophobicContact CB-CZ 4.44Å; F72-E86 CarbonylContact O-C 3.59Å; F72-E86 WeakPolarHBondContact O-CA 3.4Å; F72-L87 HydrophobicContact CB-CB 4.44Å; F72-L87 PolarHBondContact N-O 3.28Å; F72-L87 PolarHBondContact O-N 2.83Å; F72-V89 HydrophobicContact CD2-CG2 3.69Å; F72-V89 HydrophobicContact CE2-CG2 3.36Å
73	G	48.6	Very low	53.5	Low	41 Å²	41	80.6 Å²	80.6	42%	0.423	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	140.9	164.9	0	0	0	0	0	109.2	G85	G73-G85 WeakPolarHBondContact CA-O 3.24Å
74	Y	54	Low	53.6	Low	16 Å²	16	83.9 Å²	83.9	6%	0.063	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158	173.1	73	-85.9	0	0	0	111.4	K15 E76 T84 G85 L87 L112	K15-Y74 WeakPolarHBondContact CD-OH 3.4Å; K15-Y74 WeakPolarHBondContact CE-OH 3.44Å; K15-Y74 VanDerWaalsContact CG-OH 3.32Å; K15-Y74 WeakPolarHBondContact CG-OH 2.91Å; K15-Y74 PolarHBondContact NZ-OH 3.44Å; Y74-E76 HydrophobicContact CD2-CB 4.09Å; Y74-E76 HydrophobicContact CE2-CB 3.81Å; Y74-T84 CarbonylContact O-C 3.57Å; Y74-T84 VanDerWaalsContact O-CA 3.22Å; Y74-T84 WeakPolarHBondContact O-CA 3.1Å; Y74-G85 WeakPolarHBondContact CD1-O 3.46Å; Y74-G85 VanDerWaalsContact CE1-CA 3.45Å; Y74-G85 PolarHBondContact N-O 2.95Å; Y74-G85 PolarHBondContact O-N 3.3Å; Y74-L87 HydrophobicContact CD1-CB 4.4Å; Y74-L87 HydrophobicContact CD1-CD1 4.15Å; Y74-L87 HydrophobicContact CD1-CD2 4.23Å; Y74-L87 HydrophobicContact CD1-CG 3.54Å; Y74-L87 HydrophobicContact CE1-CD2 3.94Å; Y74-L87 HydrophobicContact CE1-CG 3.76Å; Y74-L87 HydrophobicContact CG-CD1 4.47Å; Y74-L87 HydrophobicContact CG-CG 4.32Å; Y74-L112 HydrophobicContact CD2-CD1 3.69Å; Y74-L112 HydrophobicContact CG-CD1 3.88Å; Y74-L112 HydrophobicContact CG-CG 4.49Å
75	V	50.1	Low	54.1	Low	43 Å²	43	84.7 Å²	84.7	26%	0.261	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.1	171.8	-168.9	0	0	0	0	108	A82 R83 T84	V75-A82 HydrophobicContact CG1-CB 3.87Å; V75-R83 WeakPolarHBondContact CA-O 3.22Å; V75-T84 HydrophobicContact CG2-CG2 4.09Å
76	E	54.2	Low	54.2	Low	55 Å²	55	87.3 Å²	87.3	26%	0.257	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.6	176.4	-179	-178.9	-179.9	0	0	108.1	K15 Y74 A82 R83	K15-E76 IonicContact NZ-OE2 3.98Å; K15-E76 PolarHBondContact NZ-OE2 3.5Å; Y74-E76 HydrophobicContact CD2-CB 4.09Å; Y74-E76 HydrophobicContact CE2-CB 3.81Å; E76-A82 CarbonylContact O-C 3.59Å; E76-A82 WeakPolarHBondContact O-CA 3.25Å; E76-R83 PolarHBondContact N-O 2.52Å; E76-R83 PolarHBondContact O-N 3.1Å
77	E	48.1	Very low	54.2	Low	131 Å²	131	84.3 Å²	84.3	61%	0.612	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	111.8	172	-71	-168.1	169.9	0	0	109.8	K81 A82	E77-K81 WeakPolarHBondContact CA-O 3.49Å; E77-A82 HydrophobicContact CG-CB 4.04Å
78	W	46.2	Very low	54.2	Low	185 Å²	185	79.8 Å²	79.8	70%	0.701	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.2	174.4	-172.2	76.4	0	0	0	110.1	G80 K81	W78-G80 VanDerWaalsContact C-N 3.26Å; W78-G80 PolarHBondContact O-N 3.29Å; W78-K81 PolarHBondContact N-O 2.86Å; W78-K81 WeakPolarHBondContact O-CB 3.25Å; W78-K81 PolarHBondContact O-N 3.18Å
79	D	53.3	Low	54.5	Low	131 Å²	131	78.4 Å²	78.4	70%	0.701	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	44.4	-179.2	-165.5	31.1	0	0	0	113.2	K81	D79-K81 PolarHBondContact O-N 3.49Å
80	G	59.5	Low	54.3	Low	78 Å²	78	76 Å²	76	80%	0.804	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	8.1	-178.5	0	0	0	0	0	115	W78	W78-G80 VanDerWaalsContact C-N 3.26Å; W78-G80 PolarHBondContact O-N 3.29Å
81	K	50.8	Low	54.6	Low	140 Å²	140	75 Å²	75	61%	0.609	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.2	175.4	-64.1	178.3	-175.6	170.4	0	109.7	E77 W78 D79	E77-K81 WeakPolarHBondContact CA-O 3.49Å; W78-K81 PolarHBondContact N-O 2.86Å; W78-K81 WeakPolarHBondContact O-CB 3.25Å; W78-K81 PolarHBondContact O-N 3.18Å; D79-K81 PolarHBondContact O-N 3.49Å
82	A	54.4	Low	54.2	Low	63 Å²	63	71.6 Å²	71.6	52%	0.521	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128.2	168.6	0	0	0	0	0	110	V75 E76 E77	V75-A82 HydrophobicContact CG1-CB 3.87Å; E76-A82 CarbonylContact O-C 3.59Å; E76-A82 WeakPolarHBondContact O-CA 3.25Å; E77-A82 HydrophobicContact CG-CB 4.04Å
83	R	49.3	Very low	53.7	Low	180 Å²	180	74.6 Å²	74.6	68%	0.679	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.7	167.9	-72.1	-171.5	174.1	-171.1	-0.5	108.7	V75 E76	V75-R83 WeakPolarHBondContact CA-O 3.22Å; E76-R83 PolarHBondContact N-O 2.52Å; E76-R83 PolarHBondContact O-N 3.1Å
84	T	57.8	Low	53.4	Low	123 Å²	123	74.4 Å²	74.4	76%	0.755	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	143.4	170	58.9	0	0	0	0	109.6	Y74 V75	Y74-T84 CarbonylContact O-C 3.57Å; Y74-T84 VanDerWaalsContact O-CA 3.22Å; Y74-T84 WeakPolarHBondContact O-CA 3.1Å; V75-T84 HydrophobicContact CG2-CG2 4.09Å
85	G	60.4	Low	52.6	Low	19 Å²	19	82.2 Å²	82.2	20%	0.196	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	176.5	174.2	0	0	0	0	0	111.1	G73 Y74	G73-G85 WeakPolarHBondContact CA-O 3.24Å; Y74-G85 WeakPolarHBondContact CD1-O 3.46Å; Y74-G85 VanDerWaalsContact CE1-CA 3.45Å; Y74-G85 PolarHBondContact N-O 2.95Å; Y74-G85 PolarHBondContact O-N 3.3Å
86	E	56.5	Low	51.7	Low	89 Å²	89	86.9 Å²	86.9	42%	0.416	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.3	173.7	-66.6	-175.1	105.5	0	0	110	L16 F72	L16-E86 HydrophobicContact CD1-CB 4.49Å; L16-E86 PolarHBondContact N-O 3.21Å; F72-E86 CarbonylContact O-C 3.59Å; F72-E86 WeakPolarHBondContact O-CA 3.4Å
87	L	59	Low	50.4	Low	4 Å²	4	88.8 Å²	88.8	2%	0.021	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.5	167.4	-70.1	174.1	0	0	0	108.8	V13 K15 I28 V43 R71 F72 Y74	V13-L87 HydrophobicContact CB-CB 4.23Å; V13-L87 HydrophobicContact CB-CD1 4.42Å; V13-L87 HydrophobicContact CB-CD2 4.15Å; V13-L87 HydrophobicContact CB-CG 4.48Å; V13-L87 HydrophobicContact CG1-CB 4.42Å; V13-L87 HydrophobicContact CG2-CD1 4.26Å; V13-L87 HydrophobicContact CG2-CD2 4.19Å; K15-L87 HydrophobicContact CB-CD2 4.49Å; I28-L87 HydrophobicContact CD1-CD1 4.34Å; V43-L87 HydrophobicContact CG2-CD1 4.25Å; R71-L87 CarbonylContact C-O 3.53Å; R71-L87 VanDerWaalsContact CA-O 3.3Å; R71-L87 WeakPolarHBondContact CA-O 3.29Å; F72-L87 HydrophobicContact CB-CB 4.44Å; F72-L87 PolarHBondContact N-O 3.28Å; F72-L87 PolarHBondContact O-N 2.83Å; Y74-L87 HydrophobicContact CD1-CB 4.4Å; Y74-L87 HydrophobicContact CD1-CD1 4.15Å; Y74-L87 HydrophobicContact CD1-CD2 4.23Å; Y74-L87 HydrophobicContact CD1-CG 3.54Å; Y74-L87 HydrophobicContact CE1-CD2 3.94Å; Y74-L87 HydrophobicContact CE1-CG 3.76Å; Y74-L87 HydrophobicContact CG-CD1 4.47Å; Y74-L87 HydrophobicContact CG-CG 4.32Å
88	C	56.6	Low	49.3	Very low	0 Å²	0	91.1 Å²	91.1	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.2	171.8	174.9	0	0	0	0	110.2	V13 C14 L16 V64 C68 L90	V13-C88 CarbonylContact C-O 3.52Å; V13-C88 WeakPolarHBondContact CA-O 3.42Å; C14-C88 PolarHBondContact N-O 3.41Å; C14-C88 PolarHBondContact O-N 3.37Å; L16-C88 HydrophobicContact CD1-CB 3.87Å; L16-C88 HydrophobicContact CD2-CB 4.06Å; L16-C88 HydrophobicContact CG-CB 3.9Å; V64-C88 HydrophobicContact CG1-CB 4.17Å; V64-C88 PolarHBondContact O-SG 2.96Å; C68-C88 WeakPolarHBondContact CA-SG 3.35Å; C68-C88 HydrophobicContact CB-CB 4.32Å; C68-C88 WeakPolarHBondContact CB-SG 3.26Å; C68-C88 WeakPolarHBondContact SG-CA 3.46Å; C68-C88 WeakPolarHBondContact SG-CB 3.4Å; C68-C88 CovalentContact SG-SG 2.02Å; C68-C88 PolarHBondContact SG-SG 3.29Å; C88-L90 PolarHBondContact O-N 3.06Å
89	V	61.2	Low	48.2	Very low	0 Å²	0	86.4 Å²	86.4	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.3	170.5	-176.2	0	0	0	0	108.5	W11 V13 C68 V69 N70 F72	W11-V89 HydrophobicContact CB-CG1 4.3Å; W11-V89 HydrophobicContact CD2-CG1 4.28Å; W11-V89 HydrophobicContact CE3-CG1 3.42Å; W11-V89 VanDerWaalsContact CE3-CG1 3.42Å; W11-V89 HydrophobicContact CZ3-CG1 4.04Å; V13-V89 HydrophobicContact CG1-CG2 4.09Å; C68-V89 CarbonylContact C-O 3.17Å; C68-V89 WeakPolarHBondContact CA-O 3.35Å; V69-V89 HydrophobicContact CG2-CB 3.73Å; V69-V89 HydrophobicContact CG2-CG1 3.4Å; V69-V89 WeakPolarHBondContact CG2-O 3.19Å; V69-V89 PolarHBondContact N-O 2.93Å; N70-V89 HydrophobicContact CB-CB 4.23Å; N70-V89 HydrophobicContact CB-CG2 4.1Å; N70-V89 PolarHBondContact O-N 3.34Å; F72-V89 HydrophobicContact CD2-CG2 3.69Å; F72-V89 HydrophobicContact CE2-CG2 3.36Å
90	L	56.8	Low	46.8	Very low	40 Å²	40	87.5 Å²	87.5	21%	0.209	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-31.9	-177.3	-74	-176	0	0	0	114	R12 C14 V64 N67 C88	R12-L90 PolarHBondContact O-N 3.3Å; R12-L90 VanDerWaalsContact O-N 3.1Å; C14-L90 HydrophobicContact CB-CD1 4.24Å; C14-L90 HydrophobicContact CB-CG 4.44Å; C14-L90 WeakPolarHBondContact SG-CD1 3.23Å; V64-L90 HydrophobicContact CB-CD2 4.26Å; V64-L90 HydrophobicContact CG1-CD1 4.4Å; V64-L90 HydrophobicContact CG1-CD2 3.72Å; V64-L90 HydrophobicContact CG1-CG 4.32Å; V64-L90 WeakPolarHBondContact O-CD2 3.45Å; N67-L90 HydrophobicContact CB-CD2 4.26Å; C88-L90 PolarHBondContact O-N 3.06Å
91	D	58.8	Low	45.1	Very low	64 Å²	64	90.4 Å²	90.4	34%	0.342	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	133.1	-173.8	-161.5	-6.1	0	0	0	109.7	D93	D91-D93 VanDerWaalsContact C-N 3.27Å; D91-D93 PolarHBondContact O-N 3.07Å; D91-D93 WeakPolarHBondContact OD1-CB 3.37Å; D91-D93 PolarHBondContact OD1-N 3.05Å
92	A	48.4	Very low	43.8	Very low	48 Å²	48	88.1 Å²	88.1	40%	0.397	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-0.7	-178.8	0	0	0	0	0	113.1	W11 L94	W11-A92 HydrophobicContact CE3-CB 4.06Å; W11-A92 HydrophobicContact CH2-CB 4Å; W11-A92 HydrophobicContact CZ3-CB 3.33Å; A92-L94 VanDerWaalsContact C-N 3.31Å; A92-L94 PolarHBondContact O-N 3.44Å
93	D	43.9	Very low	42.3	Very low	116 Å²	116	89.2 Å²	89.2	62%	0.62	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	19.4	-155.3	-104.4	3.5	0	0	0	117.3	D91	D91-D93 VanDerWaalsContact C-N 3.27Å; D91-D93 PolarHBondContact O-N 3.07Å; D91-D93 WeakPolarHBondContact OD1-CB 3.37Å; D91-D93 PolarHBondContact OD1-N 3.05Å
94	L	42.9	Very low	41.1	Very low	38 Å²	38	85.6 Å²	85.6	20%	0.199	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	66.7	171.6	-55.8	174.5	0	0	0	111.1	L10 R12 Y27 A92 R96	L10-L94 HydrophobicContact CB-CB 3.85Å; L10-L94 HydrophobicContact CB-CD1 4.12Å; L10-L94 WeakPolarHBondContact O-CB 3.37Å; R12-L94 HydrophobicContact CG-CD1 4.46Å; Y27-L94 HydrophobicContact CD1-CD1 4.05Å; Y27-L94 HydrophobicContact CE1-CD1 3.65Å; A92-L94 VanDerWaalsContact C-N 3.31Å; A92-L94 PolarHBondContact O-N 3.44Å; L94-R96 PolarHBondContact O-N 3.41Å
95	Q	36.1	Very low	39.4	Very low	180 Å²	180	87.1 Å²	87.1	84%	0.841	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	82.6	153.3	-67.1	-173.9	8.6	0	0	108.4
96	R	32	Very low	37.9	Very low	140 Å²	140	90.2 Å²	90.2	53%	0.528	50%	0.5	S	S	.	.			trans	-114.7	75.4	173.4	-82.9	-172	163.2	-166.7	-4.9	110.3	L94 Q98	L94-R96 PolarHBondContact O-N 3.41Å; R96-Q98 PolarHBondContact O-N 3.45Å; R96-Q98 VanDerWaalsContact O-N 3.09Å
97	C	26.5	Very low	36.3	Very low	95 Å²	95	89.6 Å²	89.6	64%	0.642	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	111.5	148.9	-63.9	0	0	0	0	106.7
98	Q	25.5	Very low	34.7	Very low	181 Å²	181	92.2 Å²	92.2	85%	0.846	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	69.9	173.1	-49	177.4	-11.6	0	0	117.6	R96	R96-Q98 PolarHBondContact O-N 3.45Å; R96-Q98 VanDerWaalsContact O-N 3.09Å
99	V	23.6	Very low	33.4	Very low	85 Å²	85	102.3 Å²	102.3	52%	0.515	59%	0.589	S	S	.	*			trans	-149.6	101.8	141.9	-176	0	0	0	0	110.8
100	L	22.3	Very low	32	Very low	155 Å²	155	105.7 Å²	105.7	81%	0.812	62%	0.617	S	S	*	*			trans	37.7	105.8	146.5	-99.1	84	0	0	0	119.3	A102	L100-A102 PolarHBondContact O-N 3.14Å; L100-A102 VanDerWaalsContact O-N 3.13Å
101	V	25.2	Very low	30.7	Very low	138 Å²	138	106 Å²	106	84%	0.836	63%	0.63	S	S	*	*				-8.4	98	122.9	-168.2	0	0	0	0	113.1
102	A	22.8	Very low	29.5	Very low	93 Å²	93	105.1 Å²	105.1	77%	0.769	63%	0.625	S	S	*	*			trans	-107.3	76.8	155.8	0	0	0	0	0	107	L100 I104	L100-A102 PolarHBondContact O-N 3.14Å; L100-A102 VanDerWaalsContact O-N 3.13Å; A102-I104 PolarHBondContact O-N 3.31Å
103	A	22.3	Very low	28.5	Very low	85 Å²	85	109.8 Å²	109.8	70%	0.702	64%	0.638	S	S	*	*			trans	-8.3	108.3	166.6	0	0	0	0	0	115.8
104	I	24.5	Very low	27.8	Very low	105 Å²	105	107.9 Å²	107.9	54%	0.538	63%	0.63	S	S	.	*			trans	-135.5	92.8	152.3	-54.6	-177.8	0	0	0	107.5	A102 I106	A102-I104 PolarHBondContact O-N 3.31Å; I104-I106 HydrophobicContact CG2-CG1 4.36Å; I104-I106 WeakPolarHBondContact O-CG1 3.4Å; I104-I106 PolarHBondContact O-N 3.1Å
105	D	21.9	Very low	27.2	Very low	154 Å²	154	113.7 Å²	113.7	82%	0.824	68%	0.684	S	S	*	*			trans	-61.4	110.6	166.4	175.7	13.6	0	0	0	108.9	G107	D105-G107 PolarHBondContact OD1-N 3.03Å
106	I	29	Very low	26.7	Very low	85 Å²	85	110.4 Å²	110.4	44%	0.436	68%	0.676	S	S	.	*			trans	-107.2	85.8	171.1	-18.3	177.4	0	0	0	106.9	E45 I104 G108	E45-I106 HydrophobicContact CB-CD1 3.42Å; E45-I106 VanDerWaalsContact CB-CD1 3.42Å; E45-I106 HydrophobicContact CG-CD1 3.45Å; E45-I106 VanDerWaalsContact CG-CD1 3.45Å; I104-I106 HydrophobicContact CG2-CG1 4.36Å; I104-I106 WeakPolarHBondContact O-CG1 3.4Å; I104-I106 PolarHBondContact O-N 3.1Å; I106-G108 PolarHBondContact O-N 3.09Å
107	G	23.9	Very low	26.5	Very low	75 Å²	75	108.8 Å²	108.8	77%	0.773	68%	0.684	S	S	*	*			trans	-54.6	105.9	168.1	0	0	0	0	0	110	D105	D105-G107 PolarHBondContact OD1-N 3.03Å
108	G	25.3	Very low	26.5	Very low	60 Å²	60	109.6 Å²	109.6	62%	0.619	69%	0.687	S	S	*	*	S	Bend	trans	146.1	67.5	166.3	0	0	0	0	0	116.7	I106 A110	I106-G108 PolarHBondContact O-N 3.09Å; G108-A110 PolarHBondContact O-N 3.13Å
109	K	28.4	Very low	26.5	Very low	212 Å²	212	105.4 Å²	105.4	92%	0.922	68%	0.677	S	S	*	*			trans	36.3	47.4	143.2	-62.7	-173.7	174.6	-176.7	0	118.8	G111	K109-G111 PolarHBondContact O-N 2.86Å
110	A	32.1	Very low	26.7	Very low	71 Å²	71	106.7 Å²	106.7	59%	0.587	69%	0.687	S	S	*	*			trans	-89	88.2	162.5	0	0	0	0	0	108.6	G108 L112	G108-A110 PolarHBondContact O-N 3.13Å; A110-L112 PolarHBondContact O-N 3.17Å
111	G	29.9	Very low	27	Very low	47 Å²	47	103.5 Å²	103.5	49%	0.485	68%	0.679	S	S	.	*			trans	-74.8	107.1	171.6	0	0	0	0	0	109.4	K109 H113	K109-G111 PolarHBondContact O-N 2.86Å; G111-H113 PolarHBondContact O-N 3.27Å
112	L	32.3	Very low	27.1	Very low	44 Å²	44	101 Å²	101	23%	0.23	67%	0.668	C	S	.	*			trans	-84	110.5	178.2	-156.3	113.8	0	0	0	109	V43 Y74 A110 V114	V43-L112 HydrophobicContact CB-CD1 4.42Å; V43-L112 HydrophobicContact CG2-CD1 3.91Å; V43-L112 HydrophobicContact CG2-CD2 3.81Å; V43-L112 HydrophobicContact CG2-CG 4.3Å; Y74-L112 HydrophobicContact CD2-CD1 3.69Å; Y74-L112 HydrophobicContact CG-CD1 3.88Å; Y74-L112 HydrophobicContact CG-CG 4.49Å; A110-L112 PolarHBondContact O-N 3.17Å; L112-V114 HydrophobicContact CD2-CG2 4.46Å
113	H	27.8	Very low	27.5	Very low	147 Å²	147	101.6 Å²	101.6	68%	0.681	66%	0.66	S	S	*	*			trans	-97.8	121.3	171.8	-71.3	-77.6	0	0	0	109.7	G111	G111-H113 PolarHBondContact O-N 3.27Å
114	V	29.9	Very low	27.9	Very low	75 Å²	75	103 Å²	103	46%	0.455	66%	0.657	S	S	.	*			trans	-81.3	123.4	167.2	-175.5	0	0	0	0	107.5	L112	L112-V114 HydrophobicContact CD2-CG2 4.46Å
115	A	29.7	Very low	28.2	Very low	161 Å²	161	102.8 Å²	102.8	100%	1.331	67%	0.667	S	S	*	*			trans	-81.1	0	172.7	0	0	0	0	0	111.8

Retrieved 115 of 115 residues in 177.1 ms (Link to these results)

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