A0A3Q0KD07_SCHMA Loading...

UPAR/Ly6 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KD07, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 126 aa.

						>A0A3Q0KD07_SCHMA|A0A3Q0KD07
MIYNFNVMMLRLFPILLLVIFTSTGLGHRCYVCSKCQDPFRVKDTEIQNGCTFCSTIRTYVQDKLQVTSRSCVPVCVEADARRSGSGIVTSCCQDDLCNSGTQTQISMTLILSSLFSILPLLSRYF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	39.8	Very low	57.9	Low	212 Å²	212	144.7 Å²	144.7	100%	1.044	70%	0.697	S	S	*	*				0	106.5	0	-154.3	164.8	76.3	0	0	106.4	Y3	M1-Y3 PolarHBondContact O-N 2.73Å
2	I	53.8	Low	58.8	Low	152 Å²	152	141.4 Å²	141.4	78%	0.779	69%	0.685	S	S	*	*			trans	-73.9	111.1	-175.7	-63.6	165	0	0	0	106.3	N4	I2-N4 VanDerWaalsContact C-N 3.34Å; I2-N4 PolarHBondContact O-N 3.19Å
3	Y	60.7	Low	59.6	Low	160 Å²	160	140.5 Å²	140.5	63%	0.627	68%	0.676	S	S	*	*			trans	-61.2	99.6	172.9	-73.8	-86.4	0	0	0	107.6	M1 F5 F126	M1-Y3 PolarHBondContact O-N 2.73Å; Y3-F5 PolarHBondContact O-N 3.45Å; Y3-F126 PolarHBondContact OH-O 3.26Å
4	N	55.9	Low	60.2	Low	136 Å²	136	135.9 Å²	135.9	73%	0.727	66%	0.663	S	S	*	*			trans	-68	80.2	164.7	-75.7	-70.9	0	0	0	106.7	I2 N6	I2-N4 VanDerWaalsContact C-N 3.34Å; I2-N4 PolarHBondContact O-N 3.19Å; N4-N6 VanDerWaalsContact C-N 3.29Å; N4-N6 PolarHBondContact O-N 3.2Å
5	F	58.6	Low	60.9	Low	143 Å²	143	133.7 Å²	133.7	63%	0.627	65%	0.654	S	S	*	*			trans	-64.3	97.4	173.4	-161.9	-94.9	0	0	0	106.4	Y3 V7	Y3-F5 PolarHBondContact O-N 3.45Å; F5-V7 PolarHBondContact O-N 3.34Å
6	N	59.9	Low	61.6	Low	117 Å²	117	132.2 Å²	132.2	63%	0.626	65%	0.649	S	S	*	*			trans	-52.4	112.6	-173.7	-80.8	-66.2	0	0	0	109.5	N4 M8 M9	N4-N6 VanDerWaalsContact C-N 3.29Å; N4-N6 PolarHBondContact O-N 3.2Å; N6-M8 PolarHBondContact O-N 2.96Å; N6-M9 PolarHBondContact O-N 3.48Å
7	V	62.4	Low	62	Low	98 Å²	98	129.2 Å²	129.2	59%	0.594	64%	0.636	S	S	*	*	H	α-helix	trans	-52.7	-21.5	177.9	-161.3	0	0	0	0	111.5	F5 L10 R11	F5-V7 PolarHBondContact O-N 3.34Å; V7-L10 WeakPolarHBondContact O-CB 3.41Å; V7-L10 PolarHBondContact O-N 2.88Å; V7-R11 PolarHBondContact O-N 3.14Å
8	M	57.5	Low	62.3	Low	150 Å²	150	129.4 Å²	129.4	74%	0.739	64%	0.639	S	S	*	*	H	α-helix	trans	-62.3	-38.4	173.6	-163.9	163.2	85.9	0	0	113.6	N6 R11	N6-M8 PolarHBondContact O-N 2.96Å; M8-R11 PolarHBondContact O-N 3.33Å
9	M	60.6	Low	62.6	Low	129 Å²	129	127.5 Å²	127.5	64%	0.635	64%	0.635	S	S	*	*	H	α-helix	trans	-70.7	-33.8	174.7	-74.9	-120.4	-68.2	0	0	111.7	N6 R11 L12 F13	N6-M9 PolarHBondContact O-N 3.48Å; M9-R11 PolarHBondContact O-N 3.28Å; M9-L12 PolarHBondContact O-N 3.43Å; M9-L12 VanDerWaalsContact O-N 3.16Å; M9-F13 PolarHBondContact O-N 3.36Å
10	L	60.7	Low	62.8	Low	106 Å²	106	127.3 Å²	127.3	56%	0.555	64%	0.635	S	S	*	*	H	α-helix	trans	-64.1	-29.8	177.8	-166.1	70.6	0	0	0	112.1	V7 L12 P14	V7-L10 WeakPolarHBondContact O-CB 3.41Å; V7-L10 PolarHBondContact O-N 2.88Å; L10-L12 VanDerWaalsContact C-N 3.33Å; L10-P14 WeakPolarHBondContact O-CD 3.14Å
11	R	67.3	Low	62.7	Low	189 Å²	189	129.5 Å²	129.5	71%	0.713	64%	0.641	S	S	*	*	H	α-helix	trans	-71.1	-25.1	176.3	-68.4	-173.3	-179	-167.8	0.6	113.8	V7 M8 M9 P14	V7-R11 PolarHBondContact O-N 3.14Å; M8-R11 PolarHBondContact O-N 3.33Å; M9-R11 PolarHBondContact O-N 3.28Å; R11-P14 WeakPolarHBondContact O-CD 3.13Å; R11-P14 WeakPolarHBondContact O-CG 3.41Å
12	L	67.8	Low	63.5	Low	105 Å²	105	124 Å²	124	55%	0.55	62%	0.62	S	S	.	*	H	α-helix	trans	-83.6	-25.7	-179.7	-62.6	178.2	0	0	0	112.6	M9 L10 I15 L16	M9-L12 PolarHBondContact O-N 3.43Å; M9-L12 VanDerWaalsContact O-N 3.16Å; L10-L12 VanDerWaalsContact C-N 3.33Å; L12-I15 HydrophobicContact CD2-CD1 4.45Å; L12-I15 PolarHBondContact O-N 3.02Å; L12-L16 PolarHBondContact O-N 3.5Å
13	F	69.4	Low	63.7	Low	129 Å²	129	121.6 Å²	121.6	57%	0.566	62%	0.616	S	S	*	*	H	α-helix	trans	-57.7	-46.7	179.8	-156.4	-100.2	0	0	0	114.5	M9 I15 L16 L17	M9-F13 PolarHBondContact O-N 3.36Å; F13-I15 VanDerWaalsContact C-N 3.32Å; F13-I15 PolarHBondContact O-N 3.23Å; F13-L16 PolarHBondContact O-N 3.15Å; F13-L17 HydrophobicContact CD1-CD1 3.6Å; F13-L17 HydrophobicContact CD1-CG 4.32Å; F13-L17 HydrophobicContact CE1-CD1 3.58Å; F13-L17 HydrophobicContact CE1-CG 4.21Å; F13-L17 WeakPolarHBondContact O-CG 3.46Å; F13-L17 PolarHBondContact O-N 3.29Å
14	P	67.9	Low	63.6	Low	76 Å²	76	118.6 Å²	118.6	49%	0.494	62%	0.615	S	S	.	*	H	α-helix	trans	-67	-32	176.1	24.8	-33.3	0	0	0	112.8	L10 R11 L17 L18	L10-P14 WeakPolarHBondContact O-CD 3.14Å; R11-P14 WeakPolarHBondContact O-CD 3.13Å; R11-P14 WeakPolarHBondContact O-CG 3.41Å; P14-L17 PolarHBondContact O-N 3.49Å; P14-L18 WeakPolarHBondContact O-CB 3.41Å; P14-L18 PolarHBondContact O-N 3Å
15	I	70.5	Confident	63.8	Low	104 Å²	104	116.3 Å²	116.3	53%	0.533	62%	0.623	S	S	.	*	H	α-helix	trans	-67.3	-45	176.2	-59.2	174	0	0	0	109.8	L12 F13 L17 L18 V19	L12-I15 HydrophobicContact CD2-CD1 4.45Å; L12-I15 PolarHBondContact O-N 3.02Å; F13-I15 VanDerWaalsContact C-N 3.32Å; F13-I15 PolarHBondContact O-N 3.23Å; I15-L17 PolarHBondContact O-N 3.17Å; I15-L18 PolarHBondContact O-N 2.01Å; I15-V19 WeakPolarHBondContact O-CG2 3.32Å; I15-V19 PolarHBondContact O-N 2.86Å; I15-V19 VanDerWaalsContact O-N 3.15Å
16	L	72.6	Confident	64.3	Low	109 Å²	109	116.2 Å²	116.2	57%	0.571	63%	0.628	S	S	*	*	H	α-helix	trans	-61.5	-42.8	175.6	-173.4	67.5	0	0	0	111.5	L12 F13 L18 V19 I20	L12-L16 PolarHBondContact O-N 3.5Å; F13-L16 PolarHBondContact O-N 3.15Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.44Å; L16-V19 PolarHBondContact O-N 3.38Å; L16-I20 HydrophobicContact CG-CD1 4.46Å; L16-I20 WeakPolarHBondContact O-CG1 3.36Å; L16-I20 PolarHBondContact O-N 2.78Å
17	L	69.3	Low	65.4	Low	81 Å²	81	112.1 Å²	112.1	42%	0.424	61%	0.614	S	S	.	*	H	α-helix	trans	-60.9	-40	174.5	-81	166.1	0	0	0	112.6	F13 P14 I15 V19 I20 F21	F13-L17 HydrophobicContact CD1-CD1 3.6Å; F13-L17 HydrophobicContact CD1-CG 4.32Å; F13-L17 HydrophobicContact CE1-CD1 3.58Å; F13-L17 HydrophobicContact CE1-CG 4.21Å; F13-L17 WeakPolarHBondContact O-CG 3.46Å; F13-L17 PolarHBondContact O-N 3.29Å; P14-L17 PolarHBondContact O-N 3.49Å; I15-L17 PolarHBondContact O-N 3.17Å; L17-V19 PolarHBondContact O-N 2.86Å; L17-I20 PolarHBondContact O-N 2.66Å; L17-F21 PolarHBondContact O-N 2.78Å
18	L	66.9	Low	66.6	Low	133 Å²	133	109.8 Å²	109.8	70%	0.696	60%	0.596	S	S	*	*	H	α-helix	trans	-65.3	-38.2	179.1	-159.3	81.3	0	0	0	112.1	P14 I15 L16 I20 F21	P14-L18 WeakPolarHBondContact O-CB 3.41Å; P14-L18 PolarHBondContact O-N 3Å; I15-L18 PolarHBondContact O-N 2.01Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.44Å; L18-I20 VanDerWaalsContact C-N 3.31Å; L18-I20 PolarHBondContact O-N 3.3Å; L18-F21 PolarHBondContact O-N 2.8Å
19	V	67.2	Low	68.4	Low	94 Å²	94	107.5 Å²	107.5	57%	0.57	58%	0.579	S	S	*	*	H	α-helix	trans	-68.1	-30.9	178.1	176.2	0	0	0	0	111.8	I15 L16 L17 F21 T22	I15-V19 WeakPolarHBondContact O-CG2 3.32Å; I15-V19 PolarHBondContact O-N 2.86Å; I15-V19 VanDerWaalsContact O-N 3.15Å; L16-V19 PolarHBondContact O-N 3.38Å; L17-V19 PolarHBondContact O-N 2.86Å; V19-F21 VanDerWaalsContact C-N 3.28Å; V19-F21 PolarHBondContact O-N 2.92Å; V19-T22 PolarHBondContact O-OG1 3.27Å; V19-T22 VanDerWaalsContact O-OG1 3.14Å
20	I	67	Low	70.1	Confident	122 Å²	122	101.3 Å²	101.3	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-69.5	-28	177.5	-63.3	163.2	0	0	0	111.4	L16 L17 L18	L16-I20 HydrophobicContact CG-CD1 4.46Å; L16-I20 WeakPolarHBondContact O-CG1 3.36Å; L16-I20 PolarHBondContact O-N 2.78Å; L17-I20 PolarHBondContact O-N 2.66Å; L18-I20 VanDerWaalsContact C-N 3.31Å; L18-I20 PolarHBondContact O-N 3.3Å
21	F	60.1	Low	71.9	Confident	174 Å²	174	97.4 Å²	97.4	76%	0.763	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.1	-176.2	-95.5	-89	0	0	0	115	L17 L18 V19 S23	L17-F21 PolarHBondContact O-N 2.78Å; L18-F21 PolarHBondContact O-N 2.8Å; V19-F21 VanDerWaalsContact C-N 3.28Å; V19-F21 PolarHBondContact O-N 2.92Å; F21-S23 PolarHBondContact O-N 3.28Å
22	T	56.7	Low	73.3	Confident	98 Å²	98	90 Å²	90	60%	0.601	50%	0.503	S	S	*	.			trans	-78.2	75.7	172.5	60.4	0	0	0	0	109.7	V19 T24	V19-T22 PolarHBondContact O-OG1 3.27Å; V19-T22 VanDerWaalsContact O-OG1 3.14Å; T22-T24 VanDerWaalsContact C-N 3.33Å; T22-T24 PolarHBondContact O-N 3.02Å
23	S	59.6	Low	74.6	Confident	101 Å²	101	85.8 Å²	85.8	71%	0.706	48%	0.482	S	S	*	.			trans	-60	100.7	159.6	174.4	0	0	0	0	106.9	F21 G25	F21-S23 PolarHBondContact O-N 3.28Å; S23-G25 PolarHBondContact O-N 3.47Å
24	T	57.4	Low	75.7	Confident	97 Å²	97	84.9 Å²	84.9	60%	0.595	49%	0.492	S	S	*	.			trans	-64.5	125.6	178.8	45	0	0	0	0	107.7	T22 L26	T22-T24 VanDerWaalsContact C-N 3.33Å; T22-T24 PolarHBondContact O-N 3.02Å; T24-L26 PolarHBondContact O-N 3.24Å
25	G	60	Low	76.9	Confident	87 Å²	87	89.2 Å²	89.2	90%	0.897	50%	0.503	S	S	*	.	S	Bend	trans	-66.4	33.8	-176.5	0	0	0	0	0	115.7	S23	S23-G25 PolarHBondContact O-N 3.47Å
26	L	70.1	Confident	77.9	Confident	142 Å²	142	84.9 Å²	84.9	74%	0.743	48%	0.481	S	S	*	.	S	Bend	trans	-84.1	113.3	166.3	-64	162.4	0	0	0	105.5	T24	T24-L26 PolarHBondContact O-N 3.24Å
27	G	81.7	Confident	78.7	Confident	31 Å²	31	83.7 Å²	83.7	32%	0.32	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-50.5	151.3	-176.9	0	0	0	0	0	112.9	G50 C51	G27-G50 WeakPolarHBondContact O-CA 3.13Å; G27-G50 PolarHBondContact O-N 3.45Å; G27-C51 CarbonylContact C-O 3.43Å; G27-C51 WeakPolarHBondContact CA-O 2.93Å
28	H	89.5	Confident	79.5	Confident	49 Å²	49	83.6 Å²	83.6	23%	0.227	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	159.7	-173.3	-51.8	-72	0	0	0	112.1	G50 C51 Q94	H28-G50 PolarHBondContact O-N 3.5Å; H28-C51 PolarHBondContact N-O 3.31Å; H28-C51 VanDerWaalsContact O-CB 3.23Å; H28-C51 WeakPolarHBondContact O-CB 3.45Å; H28-C51 PolarHBondContact O-N 3.04Å; H28-Q94 PolarHBondContact CE1-O 2.96Å; H28-Q94 PolarHBondContact NE2-O 3.46Å
29	R	94.3	Very high	80.4	Confident	101 Å²	101	82 Å²	82	38%	0.381	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138	168.9	-50.6	-176.2	-69.6	176.5	-1.3	109.5	I47 Q48 N49 C54 D96 L97	R29-I47 HydrophobicContact CB-CG2 3.81Å; R29-I47 HydrophobicContact CG-CG2 4.48Å; R29-Q48 CarbonylContact C-O 3.5Å; R29-Q48 VanDerWaalsContact CA-O 3.22Å; R29-Q48 WeakPolarHBondContact CA-O 3.46Å; R29-N49 WeakPolarHBondContact CD-OD1 3.44Å; R29-N49 HydrophobicContact CG-CB 4.5Å; R29-N49 WeakPolarHBondContact CG-OD1 3.49Å; R29-C54 PolarHBondContact O-SG 3.06Å; R29-D96 WeakPolarHBondContact CB-OD1 3.49Å; R29-D96 WeakPolarHBondContact CG-OD1 3.4Å; R29-D96 IonicContact CZ-OD1 2.66Å; R29-D96 IonicContact CZ-OD2 3.67Å; R29-D96 PolarHBondContact N-OD1 2.96Å; R29-D96 IonicContact NE-OD1 3.37Å; R29-D96 PolarHBondContact NE-OD1 3.33Å; R29-D96 IonicContact NE-OD2 2.78Å; R29-D96 PolarHBondContact NE-OD2 3.37Å; R29-D96 IonicContact NH2-OD1 3.3Å; R29-D96 IonicContact NH2-OD2 3.71Å; R29-D96 PolarHBondContact NH2-OD2 3.49Å; R29-L97 HydrophobicContact CB-CD2 3.69Å; R29-L97 HydrophobicContact CB-CG 4.14Å; R29-L97 WeakPolarHBondContact O-CA 3.45Å; R29-L97 PolarHBondContact O-N 2.97Å
30	C	96.8	Very high	81.3	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.7	177.1	-58.3	0	0	0	0	110.4	I47 Q48 C51 C54 C72	C30-I47 WeakPolarHBondContact O-CA 3.38Å; C30-Q48 PolarHBondContact N-O 2.02Å; C30-Q48 PolarHBondContact O-N 3.14Å; C30-C51 HydrophobicContact CB-CB 4.35Å; C30-C51 WeakPolarHBondContact SG-CB 3.33Å; C30-C54 WeakPolarHBondContact CA-SG 3.37Å; C30-C54 HydrophobicContact CB-CB 3.7Å; C30-C54 WeakPolarHBondContact CB-SG 2.95Å; C30-C54 WeakPolarHBondContact SG-CA 3.01Å; C30-C54 WeakPolarHBondContact SG-CB 3.03Å; C30-C54 PolarHBondContact SG-N 2.99Å; C30-C54 CovalentContact SG-SG 2.02Å; C30-C54 PolarHBondContact SG-SG 2.96Å; C30-C72 HydrophobicContact CB-CB 4.46Å
31	Y	97.2	Very high	82.2	Confident	24 Å²	24	81 Å²	81	9%	0.094	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.7	164.1	-63.1	-71.2	0	0	0	109.7	F40 V42 T45 E46 I47 R70 L97 N99	Y31-F40 HydrophobicContact CD1-CE1 4.24Å; Y31-F40 AromaticContact CD1-CZ 3.73Å; Y31-F40 HydrophobicContact CD1-CZ 3.73Å; Y31-F40 AromaticContact CD2-CE1 3.84Å; Y31-F40 HydrophobicContact CD2-CE1 3.84Å; Y31-F40 AromaticContact CD2-CZ 3.72Å; Y31-F40 HydrophobicContact CD2-CZ 3.72Å; Y31-F40 HydrophobicContact CE1-CE1 4.29Å; Y31-F40 HydrophobicContact CE1-CZ 4.22Å; Y31-F40 AromaticContact CE2-CE1 3.92Å; Y31-F40 HydrophobicContact CE2-CE1 3.92Å; Y31-F40 HydrophobicContact CE2-CZ 4.22Å; Y31-F40 HydrophobicContact CG-CE1 4.01Å; Y31-F40 HydrophobicContact CG-CE2 4.46Å; Y31-F40 AromaticContact CG-CZ 3.45Å; Y31-F40 HydrophobicContact CG-CZ 3.45Å; Y31-F40 VanDerWaalsContact CG-CZ 3.45Å; Y31-V42 HydrophobicContact CE1-CB 4.41Å; Y31-V42 HydrophobicContact CE1-CG1 3.81Å; Y31-V42 HydrophobicContact CE1-CG2 3.98Å; Y31-T45 WeakPolarHBondContact CD1-OG1 3.18Å; Y31-E46 CarbonylContact C-O 3.55Å; Y31-E46 WeakPolarHBondContact CA-O 2.93Å; Y31-I47 HydrophobicContact CD1-CG1 3.91Å; Y31-I47 HydrophobicContact CE1-CD1 4.04Å; Y31-I47 HydrophobicContact CE1-CG1 3.89Å; Y31-R70 VanDerWaalsContact O-CB 3.28Å; Y31-R70 WeakPolarHBondContact O-CB 3.36Å; Y31-L97 HydrophobicContact CD1-CD2 4.48Å; Y31-L97 HydrophobicContact CD2-CB 4.39Å; Y31-L97 HydrophobicContact CD2-CD2 4.37Å; Y31-L97 HydrophobicContact CE1-CD2 4.16Å; Y31-L97 HydrophobicContact CE2-CB 3.63Å; Y31-L97 HydrophobicContact CE2-CD2 4.01Å; Y31-L97 HydrophobicContact CE2-CG 4.29Å; Y31-L97 WeakPolarHBondContact CE2-O 3.29Å; Y31-N99 WeakPolarHBondContact CD2-OD1 3.41Å; Y31-N99 PolarHBondContact N-OD1 2.99Å; Y31-N99 PolarHBondContact O-ND2 3.5Å
32	V	96.8	Very high	83.4	Confident	34 Å²	34	76.2 Å²	76.2	21%	0.206	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.2	179	-176.8	0	0	0	0	108.8	E46 Q48 R70 C72	V32-E46 PolarHBondContact N-O 2.02Å; V32-E46 PolarHBondContact O-N 2.85Å; V32-Q48 HydrophobicContact CG2-CB 3.66Å; V32-R70 WeakPolarHBondContact CA-O 3.46Å; V32-C72 HydrophobicContact CG2-CB 4.19Å
33	C	95.8	Very high	84.8	Confident	15 Å²	15	80.8 Å²	80.8	10%	0.101	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	145.4	176.8	43.2	0	0	0	0	110.5	C36 T45 S69 R70	C33-C36 HydrophobicContact CB-CB 4.09Å; C33-C36 WeakPolarHBondContact CB-SG 3.25Å; C33-C36 PolarHBondContact O-SG 2.92Å; C33-C36 WeakPolarHBondContact SG-CB 3.22Å; C33-C36 CovalentContact SG-SG 2.01Å; C33-C36 PolarHBondContact SG-SG 3.16Å; C33-T45 HydrophobicContact CB-CG2 3.78Å; C33-T45 WeakPolarHBondContact SG-CG2 3.45Å; C33-S69 WeakPolarHBondContact O-CA 3.23Å; C33-R70 PolarHBondContact N-O 2.82Å; C33-R70 PolarHBondContact O-N 3.03Å
34	S	92.8	Very high	85.8	Confident	111 Å²	111	80.3 Å²	80.3	78%	0.776	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.1	167.6	-65.7	0	0	0	0	108.7	C36	S34-C36 PolarHBondContact O-N 2.89Å
35	K	93.4	Very high	87.3	Confident	166 Å²	166	76.8 Å²	76.8	72%	0.722	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.1	49.4	-178.3	-52.2	179.5	179.4	178.5	0	113.3	V67 T68 S69	K35-V67 HydrophobicContact CB-CG1 4.33Å; K35-V67 HydrophobicContact CG-CG1 3.87Å; K35-T68 CarbonylContact C-O 3.53Å; K35-T68 VanDerWaalsContact CA-O 3.22Å; K35-T68 WeakPolarHBondContact CA-O 3.28Å; K35-T68 PolarHBondContact N-O 3.31Å; K35-S69 PolarHBondContact N-OG 3.45Å
36	C	91.6	Very high	89	Confident	13 Å²	13	79.9 Å²	79.9	9%	0.088	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	146.5	175.1	-35.6	0	0	0	0	111	C33 S34 T68 R70	C33-C36 HydrophobicContact CB-CB 4.09Å; C33-C36 WeakPolarHBondContact CB-SG 3.25Å; C33-C36 PolarHBondContact O-SG 2.92Å; C33-C36 WeakPolarHBondContact SG-CB 3.22Å; C33-C36 CovalentContact SG-SG 2.01Å; C33-C36 PolarHBondContact SG-SG 3.16Å; S34-C36 PolarHBondContact O-N 2.89Å; C36-T68 PolarHBondContact N-O 2.98Å; C36-T68 PolarHBondContact SG-O 2.86Å; C36-R70 VanDerWaalsContact CB-NH1 3.33Å
37	Q	88.9	Confident	90.2	Very high	85 Å²	85	76.7 Å²	76.7	40%	0.397	39%	0.388	S	S	.	.			trans	-62.4	146.5	170.1	-74.3	171.5	41.8	0	0	111	P39 F40 D44	Q37-P39 CarbonylContact C-O 3.51Å; Q37-P39 CarbonylContact O-C 3.51Å; Q37-F40 WeakPolarHBondContact O-CA 3.16Å; Q37-D44 PolarHBondContact NE2-OD2 3.45Å
38	D	84.8	Confident	90.9	Very high	78 Å²	78	79.6 Å²	79.6	42%	0.417	39%	0.394	S	S	.	.	S	Bend	trans	-131.4	118.2	172.6	-136.5	-64.3	0	0	0	107.9	L65 T68	D38-L65 HydrophobicContact CB-CD2 3.68Å; D38-T68 PolarHBondContact OD2-OG1 3.35Å
39	P	85.9	Confident	91.2	Very high	101 Å²	101	82.5 Å²	82.5	66%	0.656	41%	0.411	S	S	*	.	S	Bend	cis	-65.1	149.9	7.3	29.1	-36	0	0	0	113.1	Q37	Q37-P39 CarbonylContact C-O 3.51Å; Q37-P39 CarbonylContact O-C 3.51Å
40	F	87.4	Confident	91.2	Very high	41 Å²	41	80.2 Å²	80.2	18%	0.18	42%	0.418	C	S	.	.			trans	-58.7	136.4	-173.1	-177.7	-117.2	0	0	0	113.1	Y31 Q37 V42 T45 R70 S100	Y31-F40 HydrophobicContact CD1-CE1 4.24Å; Y31-F40 AromaticContact CD1-CZ 3.73Å; Y31-F40 HydrophobicContact CD1-CZ 3.73Å; Y31-F40 AromaticContact CD2-CE1 3.84Å; Y31-F40 HydrophobicContact CD2-CE1 3.84Å; Y31-F40 AromaticContact CD2-CZ 3.72Å; Y31-F40 HydrophobicContact CD2-CZ 3.72Å; Y31-F40 HydrophobicContact CE1-CE1 4.29Å; Y31-F40 HydrophobicContact CE1-CZ 4.22Å; Y31-F40 AromaticContact CE2-CE1 3.92Å; Y31-F40 HydrophobicContact CE2-CE1 3.92Å; Y31-F40 HydrophobicContact CE2-CZ 4.22Å; Y31-F40 HydrophobicContact CG-CE1 4.01Å; Y31-F40 HydrophobicContact CG-CE2 4.46Å; Y31-F40 AromaticContact CG-CZ 3.45Å; Y31-F40 HydrophobicContact CG-CZ 3.45Å; Y31-F40 VanDerWaalsContact CG-CZ 3.45Å; Q37-F40 WeakPolarHBondContact O-CA 3.16Å; F40-V42 HydrophobicContact CD1-CG2 4.37Å; F40-V42 HydrophobicContact CE1-CG2 3.69Å; F40-V42 HydrophobicContact CZ-CG2 4.39Å; F40-T45 HydrophobicContact CE2-CG2 3.52Å; F40-T45 HydrophobicContact CZ-CG2 3.86Å; F40-R70 VanDerWaalsContact CD2-NH1 3.28Å; F40-S100 WeakPolarHBondContact CB-O 3.47Å; F40-S100 WeakPolarHBondContact CD1-O 3.28Å; F40-S100 WeakPolarHBondContact CG-O 3.49Å
41	R	84.7	Confident	91.1	Very high	153 Å²	153	80.2 Å²	80.2	58%	0.577	42%	0.419	S	S	*	.			trans	-130	123.1	172.3	-64.1	-172.2	-178.5	164.3	-9.7	110.1	K43	R41-K43 PolarHBondContact O-N 2.91Å
42	V	86.3	Confident	91	Very high	73 Å²	73	82.3 Å²	82.3	44%	0.442	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-62	-29.1	-179.3	176.7	0	0	0	0	112.6	Y31 F40 D44 T45	Y31-V42 HydrophobicContact CE1-CB 4.41Å; Y31-V42 HydrophobicContact CE1-CG1 3.81Å; Y31-V42 HydrophobicContact CE1-CG2 3.98Å; F40-V42 HydrophobicContact CD1-CG2 4.37Å; F40-V42 HydrophobicContact CE1-CG2 3.69Å; F40-V42 HydrophobicContact CZ-CG2 4.39Å; V42-D44 PolarHBondContact O-N 3.49Å; V42-D44 VanDerWaalsContact O-N 3.15Å; V42-T45 PolarHBondContact O-N 2.02Å; V42-T45 VanDerWaalsContact O-N 3.14Å; V42-T45 PolarHBondContact O-OG1 2.89Å
43	K	85	Confident	90.9	Very high	194 Å²	194	82.7 Å²	82.7	84%	0.843	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-59.5	-30.5	-171.9	-169.4	179.1	177.7	-175.6	0	114.1	R41	R41-K43 PolarHBondContact O-N 2.91Å
44	D	81.2	Confident	91	Very high	91 Å²	91	82 Å²	82	49%	0.487	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-104.9	25.5	-175.8	-53.9	-43.5	0	0	0	111.6	Q37 V42	Q37-D44 PolarHBondContact NE2-OD2 3.45Å; V42-D44 PolarHBondContact O-N 3.49Å; V42-D44 VanDerWaalsContact O-N 3.15Å
45	T	90.1	Very high	91.2	Very high	23 Å²	23	77 Å²	77	14%	0.141	39%	0.393	C	S	.	.			trans	-131.7	148.4	-176.5	64.6	0	0	0	0	112.3	Y31 C33 F40 V42	Y31-T45 WeakPolarHBondContact CD1-OG1 3.18Å; C33-T45 HydrophobicContact CB-CG2 3.78Å; C33-T45 WeakPolarHBondContact SG-CG2 3.45Å; F40-T45 HydrophobicContact CE2-CG2 3.52Å; F40-T45 HydrophobicContact CZ-CG2 3.86Å; V42-T45 PolarHBondContact O-N 2.02Å; V42-T45 VanDerWaalsContact O-N 3.14Å; V42-T45 PolarHBondContact O-OG1 2.89Å
46	E	95.4	Very high	91.3	Very high	152 Å²	152	69.3 Å²	69.3	71%	0.71	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	152.2	170.5	-65.7	177.2	-172	0	0	109.5	Y31 V32	Y31-E46 CarbonylContact C-O 3.55Å; Y31-E46 WeakPolarHBondContact CA-O 2.93Å; V32-E46 PolarHBondContact N-O 2.02Å; V32-E46 PolarHBondContact O-N 2.85Å
47	I	95.6	Very high	91.5	Very high	75 Å²	75	71.5 Å²	71.5	39%	0.385	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.5	171.3	-64.6	173.9	0	0	0	107.4	R29 C30 Y31 L97	R29-I47 HydrophobicContact CB-CG2 3.81Å; R29-I47 HydrophobicContact CG-CG2 4.48Å; C30-I47 WeakPolarHBondContact O-CA 3.38Å; Y31-I47 HydrophobicContact CD1-CG1 3.91Å; Y31-I47 HydrophobicContact CE1-CD1 4.04Å; Y31-I47 HydrophobicContact CE1-CG1 3.89Å; I47-L97 HydrophobicContact CD1-CD2 4.14Å; I47-L97 HydrophobicContact CG1-CD2 4.14Å; I47-L97 HydrophobicContact CG2-CD2 3.82Å
48	Q	96.2	Very high	91.9	Very high	93 Å²	93	68.8 Å²	68.8	44%	0.435	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.8	173.6	-172.5	172.3	-8.9	0	0	109.6	R29 C30 V32 C51 C72	R29-Q48 CarbonylContact C-O 3.5Å; R29-Q48 VanDerWaalsContact CA-O 3.22Å; R29-Q48 WeakPolarHBondContact CA-O 3.46Å; C30-Q48 PolarHBondContact N-O 2.02Å; C30-Q48 PolarHBondContact O-N 3.14Å; V32-Q48 HydrophobicContact CG2-CB 3.66Å; Q48-C51 PolarHBondContact O-SG 3.18Å; Q48-C72 HydrophobicContact CB-CB 4.15Å; Q48-C72 VanDerWaalsContact CD-CB 3.45Å; Q48-C72 VanDerWaalsContact CD-SG 3.57Å; Q48-C72 HydrophobicContact CG-CB 4.04Å; Q48-C72 VanDerWaalsContact OE1-CB 3.26Å
49	N	94.5	Very high	92.5	Very high	110 Å²	110	67.2 Å²	67.2	59%	0.588	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	161.6	179	-52.9	-56.8	0	0	0	110.9	R29	R29-N49 WeakPolarHBondContact CD-OD1 3.44Å; R29-N49 HydrophobicContact CG-CB 4.5Å; R29-N49 WeakPolarHBondContact CG-OD1 3.49Å
50	G	93.8	Very high	93	Very high	52 Å²	52	64.6 Å²	64.6	54%	0.536	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78.1	23.4	172.8	0	0	0	0	0	114	G27 H28	G27-G50 WeakPolarHBondContact O-CA 3.13Å; G27-G50 PolarHBondContact O-N 3.45Å; H28-G50 PolarHBondContact O-N 3.5Å
51	C	95	Very high	93.5	Very high	1 Å²	1	66 Å²	66	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.3	-178.2	-55.4	0	0	0	0	111.9	G27 H28 C30 Q48 C72	G27-C51 CarbonylContact C-O 3.43Å; G27-C51 WeakPolarHBondContact CA-O 2.93Å; H28-C51 PolarHBondContact N-O 3.31Å; H28-C51 VanDerWaalsContact O-CB 3.23Å; H28-C51 WeakPolarHBondContact O-CB 3.45Å; H28-C51 PolarHBondContact O-N 3.04Å; C30-C51 HydrophobicContact CB-CB 4.35Å; C30-C51 WeakPolarHBondContact SG-CB 3.33Å; Q48-C51 PolarHBondContact O-SG 3.18Å; C51-C72 WeakPolarHBondContact CA-SG 3.31Å; C51-C72 HydrophobicContact CB-CB 3.99Å; C51-C72 WeakPolarHBondContact CB-SG 3.11Å; C51-C72 WeakPolarHBondContact SG-CB 3.22Å; C51-C72 CovalentContact SG-SG 2.01Å; C51-C72 PolarHBondContact SG-SG 2.81Å
52	T	95.6	Very high	94.1	Very high	68 Å²	68	65.7 Å²	65.7	42%	0.417	34%	0.344	S	S	.	.	S	Bend	trans	-74.5	-42.3	171.2	-46.2	0	0	0	0	111
53	F	95.9	Very high	94.5	Very high	42 Å²	42	67.4 Å²	67.4	18%	0.184	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145.9	176.2	-60.1	-93.4	0	0	0	110.6	V73 P74 C76 Q94	F53-V73 HydrophobicContact CB-CG2 3.95Å; F53-V73 PolarHBondContact N-O 2.74Å; F53-V73 PolarHBondContact O-N 2.82Å; F53-P74 WeakPolarHBondContact CD2-O 3.44Å; F53-P74 VanDerWaalsContact CE2-O 3.32Å; F53-P74 WeakPolarHBondContact CE2-O 3.45Å; F53-C76 HydrophobicContact CB-CB 3.68Å; F53-C76 HydrophobicContact CD1-CB 4.07Å; F53-C76 HydrophobicContact CD2-CB 4.42Å; F53-C76 HydrophobicContact CG-CB 3.82Å; F53-Q94 HydrophobicContact CD1-CG 3.25Å; F53-Q94 HydrophobicContact CE1-CG 3.43Å; F53-Q94 VanDerWaalsContact CE1-CG 3.43Å; F53-Q94 VanDerWaalsContact CE1-OE1 3.3Å; F53-Q94 HydrophobicContact CG-CG 4.15Å; F53-Q94 HydrophobicContact CZ-CG 4.41Å
54	C	96.2	Very high	95.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.9	163.1	-51.5	0	0	0	0	109.2	R29 C30 C92 C93 C98 N99	R29-C54 PolarHBondContact O-SG 3.06Å; C30-C54 WeakPolarHBondContact CA-SG 3.37Å; C30-C54 HydrophobicContact CB-CB 3.7Å; C30-C54 WeakPolarHBondContact CB-SG 2.95Å; C30-C54 WeakPolarHBondContact SG-CA 3.01Å; C30-C54 WeakPolarHBondContact SG-CB 3.03Å; C30-C54 PolarHBondContact SG-N 2.99Å; C30-C54 CovalentContact SG-SG 2.02Å; C30-C54 PolarHBondContact SG-SG 2.96Å; C54-C92 WeakPolarHBondContact O-CA 3.36Å; C54-C93 PolarHBondContact N-O 2.69Å; C54-C93 PolarHBondContact O-N 2.89Å; C54-C98 VanDerWaalsContact CB-SG 3.6Å; C54-C98 VanDerWaalsContact SG-SG 3.62Å; C54-N99 HydrophobicContact CB-CB 3.7Å
55	S	97	Very high	95.7	Very high	5 Å²	5	63.3 Å²	63.3	4%	0.035	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.7	177.9	179.4	0	0	0	0	111.2	R70 S71 S91	S55-R70 VanDerWaalsContact O-CA 3.28Å; S55-R70 WeakPolarHBondContact O-CA 3.39Å; S55-S71 PolarHBondContact N-O 3.46Å; S55-S71 PolarHBondContact O-N 3.27Å; S55-S91 CarbonylContact C-O 3.52Å; S55-S91 WeakPolarHBondContact CA-O 3.05Å
56	T	96.4	Very high	96	Very high	6 Å²	6	67.3 Å²	67.3	4%	0.037	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.3	167.8	-54.5	0	0	0	0	109	R58 T68 S69 R70 T90 S91 N99	T56-R58 HydrophobicContact CG2-CG 4.26Å; T56-T68 HydrophobicContact CG2-CG2 3.74Å; T56-S69 CarbonylContact C-O 3.57Å; T56-S69 WeakPolarHBondContact CA-O 3.34Å; T56-R70 HydrophobicContact CG2-CG 4.23Å; T56-T90 CarbonylContact O-C 3.57Å; T56-T90 WeakPolarHBondContact O-CA 3.33Å; T56-S91 PolarHBondContact N-O 2.83Å; T56-S91 PolarHBondContact O-N 2.95Å; T56-N99 WeakPolarHBondContact OG1-CB 3.47Å
57	I	96.6	Very high	96	Very high	58 Å²	58	62.3 Å²	62.3	30%	0.297	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.3	177.4	-61.6	179	0	0	0	108.4	T68 S69 I88 V89 T90	I57-T68 CarbonylContact O-C 3.52Å; I57-T68 WeakPolarHBondContact O-CA 3Å; I57-S69 PolarHBondContact N-O 2.68Å; I57-S69 PolarHBondContact O-N 2.84Å; I57-I88 HydrophobicContact CG2-CG2 3.45Å; I57-I88 VanDerWaalsContact CG2-CG2 3.45Å; I57-V89 CarbonylContact C-O 3.57Å; I57-V89 WeakPolarHBondContact CA-O 3.33Å; I57-T90 HydrophobicContact CG1-CG2 4.25Å
58	R	96.1	Very high	96	Very high	29 Å²	29	58.9 Å²	58.9	11%	0.109	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123	178.2	-66.6	-173	-178.2	99.9	-3.3	109.9	T56 Y60 L65 V67 T68 I88 V89	T56-R58 HydrophobicContact CG2-CG 4.26Å; R58-Y60 HydrophobicContact CB-CD2 4.29Å; R58-Y60 HydrophobicContact CB-CE2 3.5Å; R58-Y60 WeakPolarHBondContact CD-OH 3.33Å; R58-L65 HydrophobicContact CB-CD1 3.7Å; R58-L65 HydrophobicContact CG-CD1 4.04Å; R58-V67 CarbonylContact C-O 3.49Å; R58-V67 WeakPolarHBondContact CA-O 3.25Å; R58-T68 HydrophobicContact CG-CG2 4.15Å; R58-I88 CarbonylContact O-C 3.58Å; R58-I88 WeakPolarHBondContact O-CA 3.48Å; R58-V89 HydrophobicContact CB-CB 4.45Å; R58-V89 PolarHBondContact N-O 3.45Å; R58-V89 PolarHBondContact O-N 2.79Å
59	T	97.1	Very high	96	Very high	45 Å²	45	56.1 Å²	56.1	28%	0.276	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129	176.4	-55.1	0	0	0	0	109.7	Q66 V67 I88	T59-Q66 PolarHBondContact O-N 3.44Å; T59-V67 PolarHBondContact N-O 2.75Å; T59-V67 PolarHBondContact O-N 3.34Å; T59-I88 HydrophobicContact CG2-CG1 4.44Å
60	Y	97.7	Very high	96.1	Very high	46 Å²	46	51.1 Å²	51.1	18%	0.18	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.7	-179.9	-66.7	-97.7	0	0	0	111	R58 K64 L65 R82 G85 S86 G87 V89	R58-Y60 HydrophobicContact CB-CD2 4.29Å; R58-Y60 HydrophobicContact CB-CE2 3.5Å; R58-Y60 WeakPolarHBondContact CD-OH 3.33Å; Y60-K64 WeakPolarHBondContact CA-O 3.39Å; Y60-L65 HydrophobicContact CD1-CB 4.19Å; Y60-L65 HydrophobicContact CE1-CB 3.82Å; Y60-L65 HydrophobicContact CE1-CD1 4.16Å; Y60-L65 HydrophobicContact CE2-CD1 4.14Å; Y60-R82 HydrophobicContact CD2-CG 4.47Å; Y60-G85 WeakPolarHBondContact CB-O 2.85Å; Y60-S86 CarbonylContact O-C 3.57Å; Y60-S86 VanDerWaalsContact O-CA 3.3Å; Y60-S86 WeakPolarHBondContact O-CA 3.09Å; Y60-G87 PolarHBondContact N-O 3.15Å; Y60-G87 PolarHBondContact O-N 2.78Å; Y60-V89 HydrophobicContact CD2-CG2 4.03Å; Y60-V89 HydrophobicContact CE2-CB 4.24Å; Y60-V89 HydrophobicContact CE2-CG2 3.78Å
61	V	98	Very high	96.3	Very high	69 Å²	69	50.1 Å²	50.1	42%	0.418	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.2	168.7	175.1	0	0	0	0	107	D63 K64 Q66	V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 2.76Å; V61-K64 PolarHBondContact N-O 3.29Å; V61-K64 WeakPolarHBondContact O-CB 3.28Å; V61-K64 PolarHBondContact O-N 2.01Å; V61-Q66 HydrophobicContact CB-CG 3.83Å; V61-Q66 HydrophobicContact CG2-CG 3.68Å
62	Q	97.1	Very high	96.4	Very high	147 Å²	147	51.4 Å²	51.4	69%	0.687	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	49.6	-178	-60.2	178.5	-33	0	0	112.6	K64 S86	Q62-K64 PolarHBondContact O-N 3.14Å; Q62-S86 PolarHBondContact N-OG 2.8Å
63	D	95.1	Very high	96.5	Very high	110 Å²	110	49.8 Å²	49.8	59%	0.588	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	3.7	-178.1	-61.6	-61.7	0	0	0	115.4	V61 G85	V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 2.76Å; D63-G85 WeakPolarHBondContact CA-O 3.04Å; D63-G85 PolarHBondContact N-O 2.8Å; D63-G85 WeakPolarHBondContact OD1-CA 3.22Å
64	K	96.5	Very high	96.5	Very high	141 Å²	141	52.5 Å²	52.5	61%	0.613	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.4	176.2	-63.5	178.6	-177.7	177.4	0	110.4	Y60 V61 Q62 Q66	Y60-K64 WeakPolarHBondContact CA-O 3.39Å; V61-K64 PolarHBondContact N-O 3.29Å; V61-K64 WeakPolarHBondContact O-CB 3.28Å; V61-K64 PolarHBondContact O-N 2.01Å; Q62-K64 PolarHBondContact O-N 3.14Å; K64-Q66 PolarHBondContact O-N 3.15Å; K64-Q66 PolarHBondContact O-NE2 3.25Å; K64-Q66 VanDerWaalsContact O-NE2 3.15Å
65	L	94.9	Very high	96.5	Very high	58 Å²	58	57.7 Å²	57.7	30%	0.304	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	122.1	170.6	-179.9	64	0	0	0	109.4	D38 R58 Y60	D38-L65 HydrophobicContact CB-CD2 3.68Å; R58-L65 HydrophobicContact CB-CD1 3.7Å; R58-L65 HydrophobicContact CG-CD1 4.04Å; Y60-L65 HydrophobicContact CD1-CB 4.19Å; Y60-L65 HydrophobicContact CE1-CB 3.82Å; Y60-L65 HydrophobicContact CE1-CD1 4.16Å; Y60-L65 HydrophobicContact CE2-CD1 4.14Å
66	Q	96.4	Very high	96.5	Very high	107 Å²	107	58.4 Å²	58.4	50%	0.5	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-45.5	179.2	-62.1	-55	-55	0	0	111.6	T59 V61 K64	T59-Q66 PolarHBondContact O-N 3.44Å; V61-Q66 HydrophobicContact CB-CG 3.83Å; V61-Q66 HydrophobicContact CG2-CG 3.68Å; K64-Q66 PolarHBondContact O-N 3.15Å; K64-Q66 PolarHBondContact O-NE2 3.25Å; K64-Q66 VanDerWaalsContact O-NE2 3.15Å
67	V	95.2	Very high	96.5	Very high	46 Å²	46	63.2 Å²	63.2	28%	0.279	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133.2	-172.9	177.2	0	0	0	0	109.3	K35 R58 T59	K35-V67 HydrophobicContact CB-CG1 4.33Å; K35-V67 HydrophobicContact CG-CG1 3.87Å; R58-V67 CarbonylContact C-O 3.49Å; R58-V67 WeakPolarHBondContact CA-O 3.25Å; T59-V67 PolarHBondContact N-O 2.75Å; T59-V67 PolarHBondContact O-N 3.34Å
68	T	95.5	Very high	96.5	Very high	3 Å²	3	65.8 Å²	65.8	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.6	164.8	-58.5	0	0	0	0	108.8	K35 C36 D38 T56 I57 R58 R70	K35-T68 CarbonylContact C-O 3.53Å; K35-T68 VanDerWaalsContact CA-O 3.22Å; K35-T68 WeakPolarHBondContact CA-O 3.28Å; K35-T68 PolarHBondContact N-O 3.31Å; C36-T68 PolarHBondContact N-O 2.98Å; C36-T68 PolarHBondContact SG-O 2.86Å; D38-T68 PolarHBondContact OD2-OG1 3.35Å; T56-T68 HydrophobicContact CG2-CG2 3.74Å; I57-T68 CarbonylContact O-C 3.52Å; I57-T68 WeakPolarHBondContact O-CA 3Å; R58-T68 HydrophobicContact CG-CG2 4.15Å; T68-R70 VanDerWaalsContact CG2-NH1 3.28Å
69	S	96	Very high	96.5	Very high	35 Å²	35	66.6 Å²	66.6	25%	0.245	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.4	171.5	-59.6	0	0	0	0	109.8	C33 K35 T56 I57	C33-S69 WeakPolarHBondContact O-CA 3.23Å; K35-S69 PolarHBondContact N-OG 3.45Å; T56-S69 CarbonylContact C-O 3.57Å; T56-S69 WeakPolarHBondContact CA-O 3.34Å; I57-S69 PolarHBondContact N-O 2.68Å; I57-S69 PolarHBondContact O-N 2.84Å
70	R	96.7	Very high	96.5	Very high	5 Å²	5	68.7 Å²	68.7	2%	0.019	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.3	-178.6	-68.9	176.6	173.4	75.7	0.4	110	Y31 V32 C33 C36 F40 S55 T56 T68 N99	Y31-R70 VanDerWaalsContact O-CB 3.28Å; Y31-R70 WeakPolarHBondContact O-CB 3.36Å; V32-R70 WeakPolarHBondContact CA-O 3.46Å; C33-R70 PolarHBondContact N-O 2.82Å; C33-R70 PolarHBondContact O-N 3.03Å; C36-R70 VanDerWaalsContact CB-NH1 3.33Å; F40-R70 VanDerWaalsContact CD2-NH1 3.28Å; S55-R70 VanDerWaalsContact O-CA 3.28Å; S55-R70 WeakPolarHBondContact O-CA 3.39Å; T56-R70 HydrophobicContact CG2-CG 4.23Å; T68-R70 VanDerWaalsContact CG2-NH1 3.28Å; R70-N99 WeakPolarHBondContact CD-O 3.06Å; R70-N99 PolarHBondContact NE-O 2.79Å
71	S	97.2	Very high	96.5	Very high	31 Å²	31	69.5 Å²	69.5	22%	0.217	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153.5	-172.4	41.5	0	0	0	0	113.1	S55	S55-S71 PolarHBondContact N-O 3.46Å; S55-S71 PolarHBondContact O-N 3.27Å
72	C	97.7	Very high	96.4	Very high	29 Å²	29	70.5 Å²	70.5	20%	0.196	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.6	168	-179.4	0	0	0	0	108.1	C30 V32 Q48 C51	C30-C72 HydrophobicContact CB-CB 4.46Å; V32-C72 HydrophobicContact CG2-CB 4.19Å; Q48-C72 HydrophobicContact CB-CB 4.15Å; Q48-C72 VanDerWaalsContact CD-CB 3.45Å; Q48-C72 VanDerWaalsContact CD-SG 3.57Å; Q48-C72 HydrophobicContact CG-CB 4.04Å; Q48-C72 VanDerWaalsContact OE1-CB 3.26Å; C51-C72 WeakPolarHBondContact CA-SG 3.31Å; C51-C72 HydrophobicContact CB-CB 3.99Å; C51-C72 WeakPolarHBondContact CB-SG 3.11Å; C51-C72 WeakPolarHBondContact SG-CB 3.22Å; C51-C72 CovalentContact SG-SG 2.01Å; C51-C72 PolarHBondContact SG-SG 2.81Å
73	V	97	Very high	96.5	Very high	33 Å²	33	73.4 Å²	73.4	20%	0.2	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.5	-174.8	-61.9	0	0	0	0	112.1	F53 V75 C76	F53-V73 HydrophobicContact CB-CG2 3.95Å; F53-V73 PolarHBondContact N-O 2.74Å; F53-V73 PolarHBondContact O-N 2.82Å; V73-V75 VanDerWaalsContact C-N 3.34Å; V73-V75 VanDerWaalsContact CG2-O 3.22Å; V73-V75 WeakPolarHBondContact CG2-O 3.49Å; V73-C76 HydrophobicContact CG2-CB 3.82Å
74	P	96.3	Very high	96.5	Very high	100 Å²	100	74.1 Å²	74.1	65%	0.649	41%	0.409	S	S	*	.	S	Bend	trans	-74.9	-26.4	177	29.9	-35.2	0	0	0	112.6	F53	F53-P74 WeakPolarHBondContact CD2-O 3.44Å; F53-P74 VanDerWaalsContact CE2-O 3.32Å; F53-P74 WeakPolarHBondContact CE2-O 3.45Å
75	V	96.3	Very high	96.4	Very high	108 Å²	108	68 Å²	68	66%	0.655	39%	0.385	S	S	*	.			trans	-137.5	136.5	178.7	-178.5	0	0	0	0	107.8	V73	V73-V75 VanDerWaalsContact C-N 3.34Å; V73-V75 VanDerWaalsContact CG2-O 3.22Å; V73-V75 WeakPolarHBondContact CG2-O 3.49Å
76	C	96.8	Very high	96.6	Very high	21 Å²	21	67.3 Å²	67.3	14%	0.142	39%	0.385	C	S	.	.			trans	-135.9	133.7	175.7	-165.7	0	0	0	0	109.5	F53 V73 C92	F53-C76 HydrophobicContact CB-CB 3.68Å; F53-C76 HydrophobicContact CD1-CB 4.07Å; F53-C76 HydrophobicContact CD2-CB 4.42Å; F53-C76 HydrophobicContact CG-CB 3.82Å; V73-C76 HydrophobicContact CG2-CB 3.82Å; C76-C92 HydrophobicContact CB-CB 3.69Å; C76-C92 WeakPolarHBondContact CB-SG 3.43Å; C76-C92 VanDerWaalsContact SG-CA 3.55Å; C76-C92 WeakPolarHBondContact SG-CB 3.46Å; C76-C92 CovalentContact SG-SG 2.02Å; C76-C92 PolarHBondContact SG-SG 3.24Å
77	V	96.7	Very high	96.7	Very high	106 Å²	106	63.2 Å²	63.2	64%	0.642	37%	0.372	S	S	*	.			trans	-119.5	117.5	177.2	-178.9	0	0	0	0	108.2	A79 T90 C92	V77-A79 PolarHBondContact O-N 3.19Å; V77-T90 WeakPolarHBondContact O-CG2 3.44Å; V77-C92 VanDerWaalsContact C-SG 3.52Å; V77-C92 PolarHBondContact N-SG 3.38Å; V77-C92 VanDerWaalsContact N-SG 3.45Å
78	E	96.5	Very high	96.8	Very high	113 Å²	113	64.7 Å²	64.7	53%	0.528	38%	0.378	S	S	.	.			trans	-59.3	124.3	170.4	-74.2	-74.1	175.1	0	0	109.4	S91 C92	E78-S91 WeakPolarHBondContact OE2-CA 3.01Å; E78-C92 HydrophobicContact CG-CB 4.04Å; E78-C92 WeakPolarHBondContact OE1-CA 3.44Å; E78-C92 WeakPolarHBondContact OE1-CB 3.4Å; E78-C92 PolarHBondContact OE1-N 3.27Å; E78-C92 VanDerWaalsContact OE1-O 3.05Å
79	A	96.4	Very high	96.8	Very high	45 Å²	45	65.6 Å²	65.6	37%	0.372	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	137.9	-177.8	0	0	0	0	0	111.5	V77 V89 T90	V77-A79 PolarHBondContact O-N 3.19Å; A79-V89 CarbonylContact O-C 3.59Å; A79-V89 WeakPolarHBondContact O-CA 3.41Å; A79-T90 PolarHBondContact N-O 2.79Å; A79-T90 VanDerWaalsContact N-O 3.17Å; A79-T90 PolarHBondContact O-N 3.21Å
80	D	97.3	Very high	96.9	Very high	89 Å²	89	65.2 Å²	65.2	48%	0.476	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	99.8	164.6	-168.9	-20.9	0	0	0	108.4	R82 V89	D80-R82 VanDerWaalsContact C-N 3.31Å; D80-R82 WeakPolarHBondContact OD1-CB 3.49Å; D80-R82 WeakPolarHBondContact OD1-CG 3.49Å; D80-R82 IonicContact OD1-CZ 3.96Å; D80-R82 PolarHBondContact OD1-N 2.74Å; D80-R82 IonicContact OD1-NE 3.39Å; D80-R82 PolarHBondContact OD1-NE 2.8Å; D80-R82 IonicContact OD2-CZ 2.72Å; D80-R82 IonicContact OD2-NE 3.01Å; D80-R82 PolarHBondContact OD2-NE 2.78Å; D80-R82 VanDerWaalsContact OD2-NE 3.16Å; D80-R82 IonicContact OD2-NH2 3.16Å; D80-R82 PolarHBondContact OD2-NH2 3.49Å; D80-V89 HydrophobicContact CB-CG2 4.48Å
81	A	96.8	Very high	96.9	Very high	64 Å²	64	66.6 Å²	66.6	53%	0.529	39%	0.389	S	S	.	.			trans	-95.6	21.8	179.3	0	0	0	0	0	112	I88	A81-I88 WeakPolarHBondContact CA-O 3.33Å; A81-I88 WeakPolarHBondContact CB-O 3.42Å; A81-I88 PolarHBondContact N-O 3.5Å
82	R	96.7	Very high	96.8	Very high	89 Å²	89	66 Å²	66	34%	0.336	39%	0.385	S	S	.	.			trans	-73	138.7	176.7	-65.7	-179.8	-65.3	159.9	-2.7	111.7	Y60 D80 S86 V89	Y60-R82 HydrophobicContact CD2-CG 4.47Å; D80-R82 VanDerWaalsContact C-N 3.31Å; D80-R82 WeakPolarHBondContact OD1-CB 3.49Å; D80-R82 WeakPolarHBondContact OD1-CG 3.49Å; D80-R82 IonicContact OD1-CZ 3.96Å; D80-R82 PolarHBondContact OD1-N 2.74Å; D80-R82 IonicContact OD1-NE 3.39Å; D80-R82 PolarHBondContact OD1-NE 2.8Å; D80-R82 IonicContact OD2-CZ 2.72Å; D80-R82 IonicContact OD2-NE 3.01Å; D80-R82 PolarHBondContact OD2-NE 2.78Å; D80-R82 VanDerWaalsContact OD2-NE 3.16Å; D80-R82 IonicContact OD2-NH2 3.16Å; D80-R82 PolarHBondContact OD2-NH2 3.49Å; R82-S86 CarbonylContact C-O 3.38Å; R82-S86 VanDerWaalsContact CA-O 3.28Å; R82-S86 WeakPolarHBondContact CA-O 3.47Å; R82-V89 HydrophobicContact CG-CG2 3.9Å
83	R	97.6	Very high	96.6	Very high	209 Å²	209	65.2 Å²	65.2	79%	0.789	38%	0.38	S	S	*	.	B	Isolated β-bridge	trans	-128.8	125.1	169.7	-62.4	-63.4	-175.2	-176.1	-0.7	107.8	G85 S86	R83-G85 VanDerWaalsContact C-N 3.25Å; R83-G85 PolarHBondContact O-N 2.88Å; R83-S86 PolarHBondContact N-O 2.78Å; R83-S86 PolarHBondContact O-N 3.24Å; R83-S86 VanDerWaalsContact O-O 3.07Å
84	S	96.6	Very high	96.4	Very high	125 Å²	125	68.3 Å²	68.3	87%	0.874	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	48.3	-178.3	-52.7	0	0	0	0	112.5	S86	S84-S86 PolarHBondContact O-N 3.17Å; S84-S86 VanDerWaalsContact O-N 3.16Å
85	G	94.9	Very high	96.2	Very high	11 Å²	11	68.7 Å²	68.7	11%	0.113	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	2	179.3	0	0	0	0	0	116.1	Y60 D63 R83	Y60-G85 WeakPolarHBondContact CB-O 2.85Å; D63-G85 WeakPolarHBondContact CA-O 3.04Å; D63-G85 PolarHBondContact N-O 2.8Å; D63-G85 WeakPolarHBondContact OD1-CA 3.22Å; R83-G85 VanDerWaalsContact C-N 3.25Å; R83-G85 PolarHBondContact O-N 2.88Å
86	S	98	Very high	96	Very high	44 Å²	44	67.3 Å²	67.3	31%	0.308	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-121	135.6	-177	-52.6	0	0	0	0	111	Y60 Q62 R82 R83 S84	Y60-S86 CarbonylContact O-C 3.57Å; Y60-S86 VanDerWaalsContact O-CA 3.3Å; Y60-S86 WeakPolarHBondContact O-CA 3.09Å; Q62-S86 PolarHBondContact N-OG 2.8Å; R82-S86 CarbonylContact C-O 3.38Å; R82-S86 VanDerWaalsContact CA-O 3.28Å; R82-S86 WeakPolarHBondContact CA-O 3.47Å; R83-S86 PolarHBondContact N-O 2.78Å; R83-S86 PolarHBondContact O-N 3.24Å; R83-S86 VanDerWaalsContact O-O 3.07Å; S84-S86 PolarHBondContact O-N 3.17Å; S84-S86 VanDerWaalsContact O-N 3.16Å
87	G	97.9	Very high	95.8	Very high	22 Å²	22	67.6 Å²	67.6	23%	0.227	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140.5	-162.2	-179.1	0	0	0	0	0	112.1	Y60	Y60-G87 PolarHBondContact N-O 3.15Å; Y60-G87 PolarHBondContact O-N 2.78Å
88	I	97.7	Very high	95.7	Very high	77 Å²	77	63.2 Å²	63.2	40%	0.395	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.9	-169.8	-61.7	172.7	0	0	0	109.9	I57 R58 T59 A81	I57-I88 HydrophobicContact CG2-CG2 3.45Å; I57-I88 VanDerWaalsContact CG2-CG2 3.45Å; R58-I88 CarbonylContact O-C 3.58Å; R58-I88 WeakPolarHBondContact O-CA 3.48Å; T59-I88 HydrophobicContact CG2-CG1 4.44Å; A81-I88 WeakPolarHBondContact CA-O 3.33Å; A81-I88 WeakPolarHBondContact CB-O 3.42Å; A81-I88 PolarHBondContact N-O 3.5Å
89	V	96.8	Very high	95.6	Very high	21 Å²	21	58 Å²	58	13%	0.127	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.9	169	-174.6	0	0	0	0	108.2	I57 R58 Y60 A79 D80 R82	I57-V89 CarbonylContact C-O 3.57Å; I57-V89 WeakPolarHBondContact CA-O 3.33Å; R58-V89 HydrophobicContact CB-CB 4.45Å; R58-V89 PolarHBondContact N-O 3.45Å; R58-V89 PolarHBondContact O-N 2.79Å; Y60-V89 HydrophobicContact CD2-CG2 4.03Å; Y60-V89 HydrophobicContact CE2-CB 4.24Å; Y60-V89 HydrophobicContact CE2-CG2 3.78Å; A79-V89 CarbonylContact O-C 3.59Å; A79-V89 WeakPolarHBondContact O-CA 3.41Å; D80-V89 HydrophobicContact CB-CG2 4.48Å; R82-V89 HydrophobicContact CG-CG2 3.9Å
90	T	96.8	Very high	95.4	Very high	27 Å²	27	58.3 Å²	58.3	17%	0.166	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.2	174.4	-56.4	0	0	0	0	108.4	T56 I57 V77 A79	T56-T90 CarbonylContact O-C 3.57Å; T56-T90 WeakPolarHBondContact O-CA 3.33Å; I57-T90 HydrophobicContact CG1-CG2 4.25Å; V77-T90 WeakPolarHBondContact O-CG2 3.44Å; A79-T90 PolarHBondContact N-O 2.79Å; A79-T90 VanDerWaalsContact N-O 3.17Å; A79-T90 PolarHBondContact O-N 3.21Å
91	S	96.1	Very high	94.5	Very high	34 Å²	34	55.4 Å²	55.4	24%	0.238	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.5	172.4	-56.1	0	0	0	0	110.8	S55 T56 E78	S55-S91 CarbonylContact C-O 3.52Å; S55-S91 WeakPolarHBondContact CA-O 3.05Å; T56-S91 PolarHBondContact N-O 2.83Å; T56-S91 PolarHBondContact O-N 2.95Å; E78-S91 WeakPolarHBondContact OE2-CA 3.01Å
92	C	95.8	Very high	93	Very high	18 Å²	18	58.1 Å²	58.1	12%	0.122	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	143.5	-171.7	-57.4	0	0	0	0	109.8	C54 C76 V77 E78	C54-C92 WeakPolarHBondContact O-CA 3.36Å; C76-C92 HydrophobicContact CB-CB 3.69Å; C76-C92 WeakPolarHBondContact CB-SG 3.43Å; C76-C92 VanDerWaalsContact SG-CA 3.55Å; C76-C92 WeakPolarHBondContact SG-CB 3.46Å; C76-C92 CovalentContact SG-SG 2.02Å; C76-C92 PolarHBondContact SG-SG 3.24Å; V77-C92 VanDerWaalsContact C-SG 3.52Å; V77-C92 PolarHBondContact N-SG 3.38Å; V77-C92 VanDerWaalsContact N-SG 3.45Å; E78-C92 HydrophobicContact CG-CB 4.04Å; E78-C92 WeakPolarHBondContact OE1-CA 3.44Å; E78-C92 WeakPolarHBondContact OE1-CB 3.4Å; E78-C92 PolarHBondContact OE1-N 3.27Å; E78-C92 VanDerWaalsContact OE1-O 3.05Å
93	C	94.7	Very high	91.2	Very high	13 Å²	13	58.8 Å²	58.8	9%	0.088	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.7	171.6	58.6	0	0	0	0	110.8	C54 C98 N99 Q103	C54-C93 PolarHBondContact N-O 2.69Å; C54-C93 PolarHBondContact O-N 2.89Å; C93-C98 HydrophobicContact CB-CB 3.71Å; C93-C98 WeakPolarHBondContact CB-SG 3.41Å; C93-C98 WeakPolarHBondContact SG-CB 3.41Å; C93-C98 CovalentContact SG-SG 2.02Å; C93-C98 PolarHBondContact SG-SG 2.91Å; C93-N99 PolarHBondContact SG-N 3.01Å; C93-Q103 VanDerWaalsContact CB-NE2 3.33Å
94	Q	92.4	Very high	89.3	Confident	99 Å²	99	54.9 Å²	54.9	46%	0.463	33%	0.334	S	S	.	.			trans	-130.4	47.1	-174.2	-62.9	-173.9	-94.5	0	0	111.1	H28 F53	H28-Q94 PolarHBondContact CE1-O 2.96Å; H28-Q94 PolarHBondContact NE2-O 3.46Å; F53-Q94 HydrophobicContact CD1-CG 3.25Å; F53-Q94 HydrophobicContact CE1-CG 3.43Å; F53-Q94 VanDerWaalsContact CE1-CG 3.43Å; F53-Q94 VanDerWaalsContact CE1-OE1 3.3Å; F53-Q94 HydrophobicContact CG-CG 4.15Å; F53-Q94 HydrophobicContact CZ-CG 4.41Å
95	D	90.7	Very high	87.5	Confident	107 Å²	107	57.4 Å²	57.4	57%	0.572	33%	0.332	S	S	*	.	S	Bend	trans	-131.6	162.7	175.5	-71.4	-58.4	0	0	0	109.5	L97 C98	D95-L97 PolarHBondContact O-N 3.16Å; D95-C98 HydrophobicContact CB-CB 3.73Å; D95-C98 WeakPolarHBondContact O-CB 3.41Å; D95-C98 PolarHBondContact O-N 3.45Å; D95-C98 PolarHBondContact O-SG 3.18Å
96	D	92.7	Very high	85.8	Confident	80 Å²	80	62.6 Å²	62.6	43%	0.428	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	121.6	178.4	-169.1	61.3	0	0	0	111.1	R29 C98	R29-D96 WeakPolarHBondContact CB-OD1 3.49Å; R29-D96 WeakPolarHBondContact CG-OD1 3.4Å; R29-D96 IonicContact CZ-OD1 2.66Å; R29-D96 IonicContact CZ-OD2 3.67Å; R29-D96 PolarHBondContact N-OD1 2.96Å; R29-D96 IonicContact NE-OD1 3.37Å; R29-D96 PolarHBondContact NE-OD1 3.33Å; R29-D96 IonicContact NE-OD2 2.78Å; R29-D96 PolarHBondContact NE-OD2 3.37Å; R29-D96 IonicContact NH2-OD1 3.3Å; R29-D96 IonicContact NH2-OD2 3.71Å; R29-D96 PolarHBondContact NH2-OD2 3.49Å; D96-C98 PolarHBondContact O-N 3Å
97	L	93.5	Very high	84.2	Confident	27 Å²	27	63.1 Å²	63.1	14%	0.141	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	26.1	177.5	-57.7	177.4	0	0	0	113.7	R29 Y31 I47 D95 N99 S100	R29-L97 HydrophobicContact CB-CD2 3.69Å; R29-L97 HydrophobicContact CB-CG 4.14Å; R29-L97 WeakPolarHBondContact O-CA 3.45Å; R29-L97 PolarHBondContact O-N 2.97Å; Y31-L97 HydrophobicContact CD1-CD2 4.48Å; Y31-L97 HydrophobicContact CD2-CB 4.39Å; Y31-L97 HydrophobicContact CD2-CD2 4.37Å; Y31-L97 HydrophobicContact CE1-CD2 4.16Å; Y31-L97 HydrophobicContact CE2-CB 3.63Å; Y31-L97 HydrophobicContact CE2-CD2 4.01Å; Y31-L97 HydrophobicContact CE2-CG 4.29Å; Y31-L97 WeakPolarHBondContact CE2-O 3.29Å; I47-L97 HydrophobicContact CD1-CD2 4.14Å; I47-L97 HydrophobicContact CG1-CD2 4.14Å; I47-L97 HydrophobicContact CG2-CD2 3.82Å; D95-L97 PolarHBondContact O-N 3.16Å; L97-N99 PolarHBondContact O-N 2.95Å; L97-S100 PolarHBondContact O-N 3.44Å; L97-S100 PolarHBondContact O-OG 2.89Å
98	C	94.1	Very high	82.6	Confident	14 Å²	14	69 Å²	69	10%	0.095	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-66.6	-21	-171.8	65.2	0	0	0	0	114	C54 C93 D95 D96 S100	C54-C98 VanDerWaalsContact CB-SG 3.6Å; C54-C98 VanDerWaalsContact SG-SG 3.62Å; C93-C98 HydrophobicContact CB-CB 3.71Å; C93-C98 WeakPolarHBondContact CB-SG 3.41Å; C93-C98 WeakPolarHBondContact SG-CB 3.41Å; C93-C98 CovalentContact SG-SG 2.02Å; C93-C98 PolarHBondContact SG-SG 2.91Å; D95-C98 HydrophobicContact CB-CB 3.73Å; D95-C98 WeakPolarHBondContact O-CB 3.41Å; D95-C98 PolarHBondContact O-N 3.45Å; D95-C98 PolarHBondContact O-SG 3.18Å; D96-C98 PolarHBondContact O-N 3Å; C98-S100 PolarHBondContact O-N 3.15Å
99	N	94.9	Very high	81.3	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.011	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-83.4	16.2	178.1	68.2	-21.7	0	0	0	113.8	Y31 C54 T56 R70 C93 L97 G101	Y31-N99 WeakPolarHBondContact CD2-OD1 3.41Å; Y31-N99 PolarHBondContact N-OD1 2.99Å; Y31-N99 PolarHBondContact O-ND2 3.5Å; C54-N99 HydrophobicContact CB-CB 3.7Å; T56-N99 WeakPolarHBondContact OG1-CB 3.47Å; R70-N99 WeakPolarHBondContact CD-O 3.06Å; R70-N99 PolarHBondContact NE-O 2.79Å; C93-N99 PolarHBondContact SG-N 3.01Å; L97-N99 PolarHBondContact O-N 2.95Å; N99-G101 VanDerWaalsContact C-N 3.28Å; N99-G101 PolarHBondContact O-N 3.39Å
100	S	91.2	Very high	80.2	Confident	53 Å²	53	74 Å²	74	37%	0.371	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-63.6	-27.2	175.7	43.2	0	0	0	0	114	F40 L97 C98	F40-S100 WeakPolarHBondContact CB-O 3.47Å; F40-S100 WeakPolarHBondContact CD1-O 3.28Å; F40-S100 WeakPolarHBondContact CG-O 3.49Å; L97-S100 PolarHBondContact O-N 3.44Å; L97-S100 PolarHBondContact O-OG 2.89Å; C98-S100 PolarHBondContact O-N 3.15Å
101	G	79.1	Confident	79.2	Confident	27 Å²	27	76.4 Å²	76.4	28%	0.278	42%	0.424	S	S	.	.	S	Bend	trans	-167.1	-170.6	-170.9	0	0	0	0	0	115	N99 Q103	N99-G101 VanDerWaalsContact C-N 3.28Å; N99-G101 PolarHBondContact O-N 3.39Å; G101-Q103 PolarHBondContact O-N 3.01Å; G101-Q103 VanDerWaalsContact O-N 3.15Å
102	T	65.5	Low	78.2	Confident	121 Å²	121	79.6 Å²	79.6	74%	0.742	44%	0.438	S	S	*	.			trans	-65.2	113.2	171.3	-33.1	0	0	0	0	107.3	T104	T102-T104 PolarHBondContact O-N 3.27Å
103	Q	58.8	Low	77.3	Confident	104 Å²	104	81.5 Å²	81.5	49%	0.486	45%	0.451	S	S	.	.			trans	-61.6	101	-179.9	-68.4	-122.8	72.9	0	0	109.3	C93 G101 Q105	C93-Q103 VanDerWaalsContact CB-NE2 3.33Å; G101-Q103 PolarHBondContact O-N 3.01Å; G101-Q103 VanDerWaalsContact O-N 3.15Å; Q103-Q105 VanDerWaalsContact C-N 3.35Å; Q103-Q105 PolarHBondContact O-N 3.31Å; Q103-Q105 VanDerWaalsContact O-N 3.09Å
104	T	57.6	Low	76.5	Confident	127 Å²	127	83.5 Å²	83.5	78%	0.779	47%	0.466	S	S	*	.			trans	-74.5	96.4	164.4	-16.5	0	0	0	0	106.2	T102 I106	T102-T104 PolarHBondContact O-N 3.27Å; T104-I106 VanDerWaalsContact C-N 3.27Å; T104-I106 PolarHBondContact O-N 2.72Å
105	Q	58.4	Low	75.7	Confident	178 Å²	178	83.1 Å²	83.1	83%	0.832	47%	0.466	S	S	*	.			trans	-68.5	90.1	171.7	-68.6	-170.8	-10.3	0	0	108.3	Q103 S107	Q103-Q105 VanDerWaalsContact C-N 3.35Å; Q103-Q105 PolarHBondContact O-N 3.31Å; Q103-Q105 VanDerWaalsContact O-N 3.09Å; Q105-S107 PolarHBondContact O-N 3.2Å
106	I	59.8	Low	75	Confident	120 Å²	120	85.5 Å²	85.5	62%	0.615	47%	0.472	S	S	*	.			trans	-73.4	111.8	169	-59.2	176.1	0	0	0	106.1	T104 M108 I111	T104-I106 VanDerWaalsContact C-N 3.27Å; T104-I106 PolarHBondContact O-N 2.72Å; I106-M108 PolarHBondContact O-N 3.16Å; I106-M108 VanDerWaalsContact O-N 3.16Å; I106-I111 HydrophobicContact CG2-CD1 4.25Å; I106-I111 HydrophobicContact CG2-CG1 4.43Å
107	S	63.1	Low	74.3	Confident	55 Å²	55	85.4 Å²	85.4	39%	0.385	48%	0.477	S	S	.	.			trans	-62.4	120	177.7	-173.8	0	0	0	0	109.6	Q105 T109 L110	Q105-S107 PolarHBondContact O-N 3.2Å; S107-T109 PolarHBondContact O-N 3.23Å; S107-T109 PolarHBondContact OG-OG1 3.24Å; S107-L110 WeakPolarHBondContact O-CB 3.22Å; S107-L110 PolarHBondContact O-N 2.98Å
108	M	64.9	Low	73.5	Confident	144 Å²	144	88 Å²	88	71%	0.709	49%	0.491	S	S	*	.	H	α-helix	trans	-51	-28.1	173.7	-77.1	-85.7	-107.7	0	0	112.3	I106 L110 I111 L112	I106-M108 PolarHBondContact O-N 3.16Å; I106-M108 VanDerWaalsContact O-N 3.16Å; M108-L110 VanDerWaalsContact C-N 3.28Å; M108-L110 PolarHBondContact O-N 3.01Å; M108-I111 PolarHBondContact O-N 2.87Å; M108-L112 PolarHBondContact O-N 3.16Å
109	T	69.6	Low	72.7	Confident	91 Å²	91	92.6 Å²	92.6	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-59.9	-35	177	59.4	0	0	0	0	113.3	S107 L112 S113	S107-T109 PolarHBondContact O-N 3.23Å; S107-T109 PolarHBondContact OG-OG1 3.24Å; T109-L112 PolarHBondContact O-N 2.86Å; T109-S113 WeakPolarHBondContact O-CB 3.21Å; T109-S113 PolarHBondContact O-N 3.09Å; T109-S113 PolarHBondContact O-OG 2.77Å
110	L	74.6	Confident	71.5	Confident	113 Å²	113	95.8 Å²	95.8	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-70.2	-34.5	178.4	-67.8	171.2	0	0	0	111.8	S107 M108 S113 S114	S107-L110 WeakPolarHBondContact O-CB 3.22Å; S107-L110 PolarHBondContact O-N 2.98Å; M108-L110 VanDerWaalsContact C-N 3.28Å; M108-L110 PolarHBondContact O-N 3.01Å; L110-S113 WeakPolarHBondContact CA-OG 3.47Å; L110-S113 PolarHBondContact O-OG 3.04Å; L110-S113 VanDerWaalsContact O-OG 3.04Å; L110-S114 WeakPolarHBondContact O-CB 3.3Å; L110-S114 PolarHBondContact O-N 3.13Å; L110-S114 VanDerWaalsContact O-N 3.13Å; L110-S114 PolarHBondContact O-OG 3.02Å
111	I	75	Confident	70.6	Confident	78 Å²	78	98.8 Å²	98.8	40%	0.4	55%	0.545	S	S	.	.	H	α-helix	trans	-70.4	-45	176.1	-57.1	175.3	0	0	0	109.4	I106 M108 S114 L115	I106-I111 HydrophobicContact CG2-CD1 4.25Å; I106-I111 HydrophobicContact CG2-CG1 4.43Å; M108-I111 PolarHBondContact O-N 2.87Å; I111-S114 PolarHBondContact O-N 2.9Å; I111-S114 PolarHBondContact O-OG 2.92Å; I111-L115 HydrophobicContact CG2-CD1 4Å; I111-L115 WeakPolarHBondContact O-CB 3.41Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.46Å; I111-L115 PolarHBondContact O-N 2.98Å
112	L	75.9	Confident	70.1	Confident	100 Å²	100	102.3 Å²	102.3	52%	0.524	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-41.2	177.9	-69.5	172.3	0	0	0	112.2	M108 T109 S114 L115 F116	M108-L112 PolarHBondContact O-N 3.16Å; T109-L112 PolarHBondContact O-N 2.86Å; L112-S114 PolarHBondContact O-N 2.96Å; L112-L115 PolarHBondContact O-N 3.15Å; L112-F116 WeakPolarHBondContact O-CD2 3.43Å; L112-F116 PolarHBondContact O-N 2.97Å
113	S	77.4	Confident	70.3	Confident	59 Å²	59	100.3 Å²	100.3	41%	0.413	55%	0.549	S	S	.	.	H	α-helix	trans	-66.3	-37.7	178.7	62.5	0	0	0	0	112.9	T109 L110 S117	T109-S113 WeakPolarHBondContact O-CB 3.21Å; T109-S113 PolarHBondContact O-N 3.09Å; T109-S113 PolarHBondContact O-OG 2.77Å; L110-S113 WeakPolarHBondContact CA-OG 3.47Å; L110-S113 PolarHBondContact O-OG 3.04Å; L110-S113 VanDerWaalsContact O-OG 3.04Å; S113-S117 PolarHBondContact O-N 3.04Å; S113-S117 VanDerWaalsContact O-N 3.16Å; S113-S117 PolarHBondContact O-OG 3.44Å
114	S	76.4	Confident	70.7	Confident	55 Å²	55	105.6 Å²	105.6	39%	0.385	56%	0.564	S	S	.	*	H	α-helix	trans	-69	-42.4	175.3	53.4	0	0	0	0	111.5	L110 I111 L112 F116 S117 I118	L110-S114 WeakPolarHBondContact O-CB 3.3Å; L110-S114 PolarHBondContact O-N 3.13Å; L110-S114 VanDerWaalsContact O-N 3.13Å; L110-S114 PolarHBondContact O-OG 3.02Å; I111-S114 PolarHBondContact O-N 2.9Å; I111-S114 PolarHBondContact O-OG 2.92Å; L112-S114 PolarHBondContact O-N 2.96Å; S114-F116 PolarHBondContact O-N 3.49Å; S114-S117 PolarHBondContact O-N 3.13Å; S114-S117 VanDerWaalsContact O-N 3.13Å; S114-I118 WeakPolarHBondContact O-CD1 3.39Å; S114-I118 VanDerWaalsContact O-CG1 3.25Å; S114-I118 WeakPolarHBondContact O-CG1 3.34Å; S114-I118 PolarHBondContact O-N 2.89Å
115	L	75.9	Confident	71.1	Confident	91 Å²	91	109.4 Å²	109.4	48%	0.476	57%	0.566	S	S	.	*	H	α-helix	trans	-59.4	-44.3	174	-73.7	169.5	0	0	0	112.1	I111 L112 S117 I118 L119	I111-L115 HydrophobicContact CG2-CD1 4Å; I111-L115 WeakPolarHBondContact O-CB 3.41Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.46Å; I111-L115 PolarHBondContact O-N 2.98Å; L112-L115 PolarHBondContact O-N 3.15Å; L115-S117 PolarHBondContact O-N 3.16Å; L115-I118 PolarHBondContact O-N 3.46Å; L115-L119 WeakPolarHBondContact O-CB 3.25Å; L115-L119 WeakPolarHBondContact O-CD1 3.49Å; L115-L119 WeakPolarHBondContact O-CG 3.03Å; L115-L119 PolarHBondContact O-N 3.02Å
116	F	76.2	Confident	70.8	Confident	156 Å²	156	110.1 Å²	110.1	68%	0.684	57%	0.566	S	S	*	*	H	α-helix	trans	-62.7	-29.3	176.1	-102	-83.5	0	0	0	113.5	L112 S114 P120	L112-F116 WeakPolarHBondContact O-CD2 3.43Å; L112-F116 PolarHBondContact O-N 2.97Å; S114-F116 PolarHBondContact O-N 3.49Å; F116-P120 WeakPolarHBondContact O-CD 3.02Å; F116-P120 WeakPolarHBondContact O-CG 3.45Å
117	S	77.4	Confident	71.3	Confident	78 Å²	78	109.7 Å²	109.7	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-81.4	-29.6	178.8	-58.9	0	0	0	0	112.5	S113 S114 L115	S113-S117 PolarHBondContact O-N 3.04Å; S113-S117 VanDerWaalsContact O-N 3.16Å; S113-S117 PolarHBondContact O-OG 3.44Å; S114-S117 PolarHBondContact O-N 3.13Å; S114-S117 VanDerWaalsContact O-N 3.13Å; L115-S117 PolarHBondContact O-N 3.16Å
118	I	78.5	Confident	71.8	Confident	83 Å²	83	112.5 Å²	112.5	43%	0.426	57%	0.573	S	S	.	*	H	α-helix	trans	-86.3	-34.8	-177.7	-61.4	160.7	0	0	0	111.9	S114 L115 L121 L122	S114-I118 WeakPolarHBondContact O-CD1 3.39Å; S114-I118 VanDerWaalsContact O-CG1 3.25Å; S114-I118 WeakPolarHBondContact O-CG1 3.34Å; S114-I118 PolarHBondContact O-N 2.89Å; L115-I118 PolarHBondContact O-N 3.46Å; I118-L121 WeakPolarHBondContact O-CB 3.4Å; I118-L121 PolarHBondContact O-N 3.2Å; I118-L122 HydrophobicContact CG2-CD1 3.9Å; I118-L122 HydrophobicContact CG2-CG 4.03Å; I118-L122 PolarHBondContact O-N 2.96Å
119	L	75.7	Confident	72.1	Confident	110 Å²	110	110.8 Å²	110.8	58%	0.576	57%	0.566	S	S	*	*	H	α-helix	trans	-51.9	-46.2	178.9	-86.1	157.1	0	0	0	113.7	L115 L121 L122 S123	L115-L119 WeakPolarHBondContact O-CB 3.25Å; L115-L119 WeakPolarHBondContact O-CD1 3.49Å; L115-L119 WeakPolarHBondContact O-CG 3.03Å; L115-L119 PolarHBondContact O-N 3.02Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 PolarHBondContact O-N 2.88Å; L119-L122 PolarHBondContact O-N 3.46Å; L119-S123 PolarHBondContact O-N 3.15Å; L119-S123 VanDerWaalsContact O-N 3.15Å
120	P	70.7	Confident	72.3	Confident	68 Å²	68	111.9 Å²	111.9	44%	0.442	57%	0.566	S	S	.	*	H	α-helix	trans	-70.8	-24.8	176.8	-16.6	29.6	0	0	0	114.2	F116 S123 R124	F116-P120 WeakPolarHBondContact O-CD 3.02Å; F116-P120 WeakPolarHBondContact O-CG 3.45Å; P120-S123 WeakPolarHBondContact CA-OG 3.43Å; P120-S123 PolarHBondContact O-OG 3.02Å; P120-R124 WeakPolarHBondContact O-CG 3.44Å; P120-R124 PolarHBondContact O-N 3.21Å
121	L	72.8	Confident	72.2	Confident	116 Å²	116	111.9 Å²	111.9	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-73.8	-40.8	176.4	-75.2	164.8	0	0	0	110.4	I118 L119 S123 R124	I118-L121 WeakPolarHBondContact O-CB 3.4Å; I118-L121 PolarHBondContact O-N 3.2Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 PolarHBondContact O-N 2.88Å; L121-S123 VanDerWaalsContact C-N 3.34Å; L121-R124 PolarHBondContact O-N 3.08Å
122	L	68.4	Low	72	Confident	101 Å²	101	114.1 Å²	114.1	53%	0.529	58%	0.576	S	S	.	*	H	α-helix	trans	-66.9	-36.4	175.5	-66.3	174.8	0	0	0	111.8	I118 L119 R124 Y125	I118-L122 HydrophobicContact CG2-CD1 3.9Å; I118-L122 HydrophobicContact CG2-CG 4.03Å; I118-L122 PolarHBondContact O-N 2.96Å; L119-L122 PolarHBondContact O-N 3.46Å; L122-R124 PolarHBondContact O-N 3.32Å; L122-Y125 PolarHBondContact O-N 3Å; L122-Y125 VanDerWaalsContact O-N 3.08Å
123	S	68.4	Low	71.7	Confident	80 Å²	80	115.1 Å²	115.1	56%	0.559	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-9.3	175.1	72	0	0	0	0	114.3	L119 P120 L121	L119-S123 PolarHBondContact O-N 3.15Å; L119-S123 VanDerWaalsContact O-N 3.15Å; P120-S123 WeakPolarHBondContact CA-OG 3.43Å; P120-S123 PolarHBondContact O-OG 3.02Å; L121-S123 VanDerWaalsContact C-N 3.34Å
124	R	68.8	Low	71.2	Confident	214 Å²	214	119.5 Å²	119.5	81%	0.808	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-14.1	171.5	-74.9	177.5	-179.7	-102.9	1.9	112.7	P120 L121 L122	P120-R124 WeakPolarHBondContact O-CG 3.44Å; P120-R124 PolarHBondContact O-N 3.21Å; L121-R124 PolarHBondContact O-N 3.08Å; L122-R124 PolarHBondContact O-N 3.32Å
125	Y	64.5	Low	70.8	Confident	207 Å²	207	124.8 Å²	124.8	81%	0.812	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-11.5	-178.2	-143.2	-93.2	0	0	0	113.2	L122	L122-Y125 PolarHBondContact O-N 3Å; L122-Y125 VanDerWaalsContact O-N 3.08Å
126	F	52.5	Low	70.3	Confident	194 Å²	194	127.9 Å²	127.9	85%	0.851	62%	0.622	S	S	*	*			trans	-122.5	0	176.5	-71.3	-81.6	0	0	0	111.4	Y3	Y3-F126 PolarHBondContact OH-O 3.26Å

Retrieved 126 of 126 residues in 271.7 ms (Link to these results)

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