EGGS_SCHMA Loading...

Putative eggshell protein

AlphaFold DB , UniProt , Accession P08016, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 149 aa.

						>EGGS_SCHMA|P08016
YGYDKYGYDKYGYDKYGYDKYGYDKYGYEKGYDKYGYDKYGYEKYGYDKYGNEKYGYDKYGDDKHGHGKDYEKYGYTKEYSKNYKDYYKKYDKYDYGSRYEKYSYRKDHDKHDHDEHDHHDDHHDHRHHHHEHDHHHHHEHDHKNGKGY
					

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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	Y	55.3	Low	75.8	Confident	283 Å²	283	124.3 Å²	124.3	100%	1.11	58%	0.578	S	S	*	*				0	102.4	0	-61.3	-82	0	0	0	107.2
2	G	65.6	Low	76.2	Confident	70 Å²	70	116.6 Å²	116.6	72%	0.722	56%	0.557	S	S	*	*			trans	-100.8	133.4	-169.9	0	0	0	0	0	111.9
3	Y	74	Confident	76.8	Confident	120 Å²	120	112.5 Å²	112.5	47%	0.471	53%	0.533	S	S	.	.			trans	-83.5	151.3	167.6	-64	-91.1	0	0	0	109.3	G7 Y8 D9 K15	Y3-G7 WeakPolarHBondContact CD1-O 3.35Å; Y3-Y8 CarbonylContact C-O 3.49Å; Y3-Y8 VanDerWaalsContact CA-O 3.27Å; Y3-Y8 WeakPolarHBondContact CA-O 3.21Å; Y3-D9 HydrophobicContact CD1-CB 4.16Å; Y3-D9 HydrophobicContact CE1-CB 4.05Å; Y3-K15 HydrophobicContact CE1-CB 4.04Å; Y3-K15 HydrophobicContact CE2-CB 4.36Å; Y3-K15 WeakPolarHBondContact OH-CA 3.37Å
4	D	77.2	Confident	77.2	Confident	83 Å²	83	106.3 Å²	106.3	44%	0.444	51%	0.505	S	S	.	.			trans	-69.2	178.6	175.9	76.2	-1.6	0	0	0	112	Y6 G7 Y8	D4-Y6 PolarHBondContact O-N 3.45Å; D4-Y6 VanDerWaalsContact OD1-C 3.25Å; D4-Y6 VanDerWaalsContact OD1-CA 3.28Å; D4-Y6 WeakPolarHBondContact OD1-CA 3.45Å; D4-Y6 WeakPolarHBondContact OD1-CB 3.41Å; D4-Y6 PolarHBondContact OD1-N 3.17Å; D4-G7 PolarHBondContact O-N 2.75Å; D4-G7 PolarHBondContact OD1-N 3.48Å; D4-Y8 PolarHBondContact N-O 3.04Å; D4-Y8 PolarHBondContact OD1-N 3.36Å
5	K	79.2	Confident	77.6	Confident	179 Å²	179	108.3 Å²	108.3	78%	0.778	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.4	177.2	58.1	165.1	162	158.6	0	114.3
6	Y	75.8	Confident	77.8	Confident	155 Å²	155	110.6 Å²	110.6	61%	0.608	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-0	179.3	-59.9	-66.1	0	0	0	112.5	D4 Y8	D4-Y6 PolarHBondContact O-N 3.45Å; D4-Y6 VanDerWaalsContact OD1-C 3.25Å; D4-Y6 VanDerWaalsContact OD1-CA 3.28Å; D4-Y6 WeakPolarHBondContact OD1-CA 3.45Å; D4-Y6 WeakPolarHBondContact OD1-CB 3.41Å; D4-Y6 PolarHBondContact OD1-N 3.17Å; Y6-Y8 WeakPolarHBondContact O-CD2 3.46Å; Y6-Y8 WeakPolarHBondContact O-CE2 3.49Å
7	G	78.1	Confident	77.9	Confident	32 Å²	32	105.9 Å²	105.9	33%	0.33	50%	0.503	S	S	.	.	S	Bend	trans	86	18.5	177.6	0	0	0	0	0	114.8	Y3 D4 D14	Y3-G7 WeakPolarHBondContact CD1-O 3.35Å; D4-G7 PolarHBondContact O-N 2.75Å; D4-G7 PolarHBondContact OD1-N 3.48Å; G7-D14 WeakPolarHBondContact O-CA 3.26Å
8	Y	81.9	Confident	78.2	Confident	58 Å²	58	103.2 Å²	103.2	23%	0.227	49%	0.487	C	S	.	.	B	Isolated β-bridge	trans	-106.6	145	178.2	-59.3	-87.4	0	0	0	112.2	Y3 D4 Y6 G12 Y13 D14 K20	Y3-Y8 CarbonylContact C-O 3.49Å; Y3-Y8 VanDerWaalsContact CA-O 3.27Å; Y3-Y8 WeakPolarHBondContact CA-O 3.21Å; D4-Y8 PolarHBondContact N-O 3.04Å; D4-Y8 PolarHBondContact OD1-N 3.36Å; Y6-Y8 WeakPolarHBondContact O-CD2 3.46Å; Y6-Y8 WeakPolarHBondContact O-CE2 3.49Å; Y8-G12 WeakPolarHBondContact CD1-O 3.36Å; Y8-Y13 CarbonylContact C-O 3.5Å; Y8-Y13 VanDerWaalsContact CA-O 3.28Å; Y8-Y13 WeakPolarHBondContact CA-O 3.26Å; Y8-D14 HydrophobicContact CD1-CB 4.08Å; Y8-D14 HydrophobicContact CE1-CB 3.93Å; Y8-K20 HydrophobicContact CE1-CB 4.12Å; Y8-K20 HydrophobicContact CE2-CB 4.43Å; Y8-K20 WeakPolarHBondContact OH-CA 3.23Å
9	D	83	Confident	78.4	Confident	51 Å²	51	100 Å²	100	27%	0.273	47%	0.473	S	S	.	.			trans	-74.7	179.3	176.7	76.1	-2	0	0	0	111.6	Y3 Y11 G12 Y13	Y3-D9 HydrophobicContact CD1-CB 4.16Å; Y3-D9 HydrophobicContact CE1-CB 4.05Å; D9-Y11 PolarHBondContact O-N 3.14Å; D9-Y11 VanDerWaalsContact OD1-C 3.27Å; D9-Y11 VanDerWaalsContact OD1-CA 3.26Å; D9-Y11 WeakPolarHBondContact OD1-CA 3.46Å; D9-Y11 WeakPolarHBondContact OD1-CB 3.28Å; D9-Y11 PolarHBondContact OD1-N 2.96Å; D9-G12 PolarHBondContact O-N 2.9Å; D9-G12 PolarHBondContact OD1-N 2.91Å; D9-Y13 PolarHBondContact N-O 3.04Å; D9-Y13 PolarHBondContact OD1-N 2.84Å
10	K	84.1	Confident	78.6	Confident	175 Å²	175	102.1 Å²	102.1	76%	0.761	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-11.7	177.1	66.6	176.2	180	169.1	0	114.3
11	Y	80	Confident	78.5	Confident	161 Å²	161	104.7 Å²	104.7	63%	0.631	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	0.4	177.2	-59.6	-68.7	0	0	0	112.4	D9 Y13	D9-Y11 PolarHBondContact O-N 3.14Å; D9-Y11 VanDerWaalsContact OD1-C 3.27Å; D9-Y11 VanDerWaalsContact OD1-CA 3.26Å; D9-Y11 WeakPolarHBondContact OD1-CA 3.46Å; D9-Y11 WeakPolarHBondContact OD1-CB 3.28Å; D9-Y11 PolarHBondContact OD1-N 2.96Å; Y11-Y13 WeakPolarHBondContact O-CD2 3.36Å; Y11-Y13 WeakPolarHBondContact O-CE2 3.3Å
12	G	80.2	Confident	79.6	Confident	32 Å²	32	92 Å²	92	33%	0.33	44%	0.442	S	S	.	.	S	Bend	trans	84.4	17.7	177.9	0	0	0	0	0	114.5	Y8 D9 D19	Y8-G12 WeakPolarHBondContact CD1-O 3.36Å; D9-G12 PolarHBondContact O-N 2.9Å; D9-G12 PolarHBondContact OD1-N 2.91Å; G12-D19 WeakPolarHBondContact O-CA 3.49Å
13	Y	84.1	Confident	80.3	Confident	63 Å²	63	93.3 Å²	93.3	25%	0.247	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-107	139.4	178.3	-61.1	-83.4	0	0	0	112.2	Y8 D9 Y11 G17 Y18 D19 K25	Y8-Y13 CarbonylContact C-O 3.5Å; Y8-Y13 VanDerWaalsContact CA-O 3.28Å; Y8-Y13 WeakPolarHBondContact CA-O 3.26Å; D9-Y13 PolarHBondContact N-O 3.04Å; D9-Y13 PolarHBondContact OD1-N 2.84Å; Y11-Y13 WeakPolarHBondContact O-CD2 3.36Å; Y11-Y13 WeakPolarHBondContact O-CE2 3.3Å; Y13-G17 VanDerWaalsContact CD1-O 3.23Å; Y13-G17 WeakPolarHBondContact CD1-O 3.33Å; Y13-Y18 CarbonylContact C-O 3.42Å; Y13-Y18 WeakPolarHBondContact CA-O 3.44Å; Y13-D19 HydrophobicContact CD1-CB 4.24Å; Y13-D19 HydrophobicContact CE1-CB 4.21Å; Y13-K25 HydrophobicContact CE1-CB 4.11Å; Y13-K25 HydrophobicContact CE2-CB 4.46Å; Y13-K25 WeakPolarHBondContact OH-CA 3.31Å
14	D	83	Confident	80.6	Confident	26 Å²	26	89.2 Å²	89.2	14%	0.139	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-66.6	173.8	175.5	77.6	0.4	0	0	0	110.9	G7 Y8 Y16 G17 Y18 K30	G7-D14 WeakPolarHBondContact O-CA 3.26Å; Y8-D14 HydrophobicContact CD1-CB 4.08Å; Y8-D14 HydrophobicContact CE1-CB 3.93Å; D14-Y16 PolarHBondContact O-N 2.89Å; D14-Y16 VanDerWaalsContact OD1-C 3.24Å; D14-Y16 WeakPolarHBondContact OD1-CA 3.49Å; D14-Y16 VanDerWaalsContact OD1-CB 3.28Å; D14-Y16 WeakPolarHBondContact OD1-CB 3.24Å; D14-Y16 PolarHBondContact OD1-N 2.99Å; D14-G17 PolarHBondContact O-N 2.86Å; D14-G17 PolarHBondContact OD1-N 3.01Å; D14-Y18 PolarHBondContact N-O 3.4Å; D14-Y18 PolarHBondContact OD1-N 2.95Å; D14-K30 IonicContact OD2-NZ 3.53Å
15	K	82.9	Confident	80.7	Confident	137 Å²	137	92 Å²	92	60%	0.596	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-11.6	176.1	67.4	179.3	178.7	177	0	115	Y3	Y3-K15 HydrophobicContact CE1-CB 4.04Å; Y3-K15 HydrophobicContact CE2-CB 4.36Å; Y3-K15 WeakPolarHBondContact OH-CA 3.37Å
16	Y	79.8	Confident	80.4	Confident	145 Å²	145	91 Å²	91	57%	0.569	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-1.1	176.4	-57.7	-71.8	0	0	0	112.6	D14 Y18	D14-Y16 PolarHBondContact O-N 2.89Å; D14-Y16 VanDerWaalsContact OD1-C 3.24Å; D14-Y16 WeakPolarHBondContact OD1-CA 3.49Å; D14-Y16 VanDerWaalsContact OD1-CB 3.28Å; D14-Y16 WeakPolarHBondContact OD1-CB 3.24Å; D14-Y16 PolarHBondContact OD1-N 2.99Å; Y16-Y18 WeakPolarHBondContact O-CD2 3.43Å; Y16-Y18 WeakPolarHBondContact O-CE2 3.28Å
17	G	80.7	Confident	80.1	Confident	30 Å²	30	85.9 Å²	85.9	31%	0.309	41%	0.407	S	S	.	.	S	Bend	trans	87	19.8	178.6	0	0	0	0	0	114.6	Y13 D14 D24	Y13-G17 VanDerWaalsContact CD1-O 3.23Å; Y13-G17 WeakPolarHBondContact CD1-O 3.33Å; D14-G17 PolarHBondContact O-N 2.86Å; D14-G17 PolarHBondContact OD1-N 3.01Å; G17-D24 VanDerWaalsContact O-CA 3.31Å; G17-D24 WeakPolarHBondContact O-CA 3.4Å
18	Y	83.6	Confident	79.8	Confident	58 Å²	58	88.5 Å²	88.5	23%	0.227	41%	0.408	C	S	.	.	B	Isolated β-bridge	trans	-111.7	139.6	179.2	-61.9	-86.4	0	0	0	112.2	Y13 D14 Y16 G22 Y23 D24 K30	Y13-Y18 CarbonylContact C-O 3.42Å; Y13-Y18 WeakPolarHBondContact CA-O 3.44Å; D14-Y18 PolarHBondContact N-O 3.4Å; D14-Y18 PolarHBondContact OD1-N 2.95Å; Y16-Y18 WeakPolarHBondContact O-CD2 3.43Å; Y16-Y18 WeakPolarHBondContact O-CE2 3.28Å; Y18-G22 VanDerWaalsContact CD1-O 3.24Å; Y18-G22 WeakPolarHBondContact CD1-O 3.4Å; Y18-Y23 CarbonylContact C-O 3.47Å; Y18-Y23 WeakPolarHBondContact CA-O 3.33Å; Y18-D24 HydrophobicContact CD1-CB 4.05Å; Y18-D24 HydrophobicContact CE1-CB 3.99Å; Y18-K30 HydrophobicContact CD1-CB 3.66Å; Y18-K30 HydrophobicContact CD1-CG 4.19Å; Y18-K30 HydrophobicContact CD2-CB 4.46Å; Y18-K30 HydrophobicContact CD2-CD 4.05Å; Y18-K30 HydrophobicContact CD2-CG 4.12Å; Y18-K30 HydrophobicContact CE1-CB 3.65Å; Y18-K30 HydrophobicContact CE1-CG 4.06Å; Y18-K30 HydrophobicContact CE2-CB 4.48Å; Y18-K30 HydrophobicContact CE2-CD 4.36Å; Y18-K30 HydrophobicContact CE2-CG 4Å; Y18-K30 HydrophobicContact CG-CB 4.07Å; Y18-K30 HydrophobicContact CG-CD 4.16Å; Y18-K30 HydrophobicContact CG-CG 4.21Å
19	D	81.5	Confident	79.1	Confident	42 Å²	42	90.1 Å²	90.1	23%	0.225	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-71.7	176.3	175.7	80	-0.8	0	0	0	112	G12 Y13 Y21 G22 Y23	G12-D19 WeakPolarHBondContact O-CA 3.49Å; Y13-D19 HydrophobicContact CD1-CB 4.24Å; Y13-D19 HydrophobicContact CE1-CB 4.21Å; D19-Y21 PolarHBondContact O-N 3.08Å; D19-Y21 VanDerWaalsContact OD1-C 3.24Å; D19-Y21 VanDerWaalsContact OD1-CA 3.26Å; D19-Y21 WeakPolarHBondContact OD1-CA 3.22Å; D19-Y21 WeakPolarHBondContact OD1-CB 3.42Å; D19-Y21 PolarHBondContact OD1-N 2.96Å; D19-G22 PolarHBondContact O-N 2.84Å; D19-G22 PolarHBondContact OD1-N 3.39Å; D19-Y23 PolarHBondContact N-O 3.22Å; D19-Y23 PolarHBondContact OD1-N 2.9Å
20	K	81.7	Confident	78.1	Confident	141 Å²	141	93.1 Å²	93.1	61%	0.613	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.8	178.4	70.2	-178.4	-174.5	177.8	0	114.7	Y8	Y8-K20 HydrophobicContact CE1-CB 4.12Å; Y8-K20 HydrophobicContact CE2-CB 4.43Å; Y8-K20 WeakPolarHBondContact OH-CA 3.23Å
21	Y	77.8	Confident	77	Confident	157 Å²	157	85.8 Å²	85.8	62%	0.616	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	1.6	176.2	-56.7	-65.9	0	0	0	112	D19	D19-Y21 PolarHBondContact O-N 3.08Å; D19-Y21 VanDerWaalsContact OD1-C 3.24Å; D19-Y21 VanDerWaalsContact OD1-CA 3.26Å; D19-Y21 WeakPolarHBondContact OD1-CA 3.22Å; D19-Y21 WeakPolarHBondContact OD1-CB 3.42Å; D19-Y21 PolarHBondContact OD1-N 2.96Å
22	G	78.4	Confident	75.6	Confident	17 Å²	17	84 Å²	84	18%	0.175	40%	0.395	C	S	.	.	S	Bend	trans	87.2	13.8	178	0	0	0	0	0	114.4	Y18 D19 E29 K30	Y18-G22 VanDerWaalsContact CD1-O 3.24Å; Y18-G22 WeakPolarHBondContact CD1-O 3.4Å; D19-G22 PolarHBondContact O-N 2.84Å; D19-G22 PolarHBondContact OD1-N 3.39Å; G22-E29 CarbonylContact O-C 3.47Å; G22-E29 VanDerWaalsContact O-CA 3.28Å; G22-E29 WeakPolarHBondContact O-CA 3.26Å; G22-K30 WeakPolarHBondContact O-CB 3.33Å; G22-K30 PolarHBondContact O-N 2.97Å
23	Y	79.2	Confident	74.3	Confident	97 Å²	97	86 Å²	86	38%	0.38	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-99.8	137.4	-179.7	-64.6	-87.5	0	0	0	112.4	Y18 D19 G27 Y28 E29	Y18-Y23 CarbonylContact C-O 3.47Å; Y18-Y23 WeakPolarHBondContact CA-O 3.33Å; D19-Y23 PolarHBondContact N-O 3.22Å; D19-Y23 PolarHBondContact OD1-N 2.9Å; Y23-G27 WeakPolarHBondContact CD1-O 3.21Å; Y23-Y28 CarbonylContact C-O 3.49Å; Y23-Y28 VanDerWaalsContact CA-O 3.3Å; Y23-Y28 WeakPolarHBondContact CA-O 3.37Å; Y23-E29 HydrophobicContact CD1-CB 4.21Å; Y23-E29 HydrophobicContact CE1-CB 4Å
24	D	81	Confident	72.6	Confident	34 Å²	34	90.2 Å²	90.2	18%	0.182	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-74.1	175.4	171.3	82.9	-5.9	0	0	0	112.1	G17 Y18 Y26 G27 Y28	G17-D24 VanDerWaalsContact O-CA 3.31Å; G17-D24 WeakPolarHBondContact O-CA 3.4Å; Y18-D24 HydrophobicContact CD1-CB 4.05Å; Y18-D24 HydrophobicContact CE1-CB 3.99Å; D24-Y26 PolarHBondContact O-N 2.79Å; D24-Y26 VanDerWaalsContact OD1-C 3.27Å; D24-Y26 VanDerWaalsContact OD1-CA 3.26Å; D24-Y26 WeakPolarHBondContact OD1-CA 3.48Å; D24-Y26 WeakPolarHBondContact OD1-CB 3.43Å; D24-Y26 PolarHBondContact OD1-N 2.74Å; D24-G27 PolarHBondContact O-N 2.81Å; D24-G27 PolarHBondContact OD1-N 2.94Å; D24-Y28 PolarHBondContact N-O 2.81Å; D24-Y28 WeakPolarHBondContact OD1-CD2 3.28Å; D24-Y28 PolarHBondContact OD1-N 2.92Å; D24-Y28 WeakPolarHBondContact OD2-CD2 3.34Å
25	K	78	Confident	71	Confident	141 Å²	141	97.5 Å²	97.5	61%	0.613	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-10	177.4	67.2	179.9	177.7	175.7	0	115.2	Y13	Y13-K25 HydrophobicContact CE1-CB 4.11Å; Y13-K25 HydrophobicContact CE2-CB 4.46Å; Y13-K25 WeakPolarHBondContact OH-CA 3.31Å
26	Y	74.9	Confident	69.2	Low	160 Å²	160	93.2 Å²	93.2	63%	0.627	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	0.8	176.8	-56.7	-69.9	0	0	0	112.5	D24 Y28	D24-Y26 PolarHBondContact O-N 2.79Å; D24-Y26 VanDerWaalsContact OD1-C 3.27Å; D24-Y26 VanDerWaalsContact OD1-CA 3.26Å; D24-Y26 WeakPolarHBondContact OD1-CA 3.48Å; D24-Y26 WeakPolarHBondContact OD1-CB 3.43Å; D24-Y26 PolarHBondContact OD1-N 2.74Å; Y26-Y28 VanDerWaalsContact CB-CE2 3.45Å; Y26-Y28 HydrophobicContact CG-CE2 4.32Å
27	G	68	Low	67.5	Low	47 Å²	47	93.6 Å²	93.6	49%	0.485	44%	0.441	S	S	.	.	S	Bend	trans	84.1	19.4	-179.4	0	0	0	0	0	114.5	Y23 D24	Y23-G27 WeakPolarHBondContact CD1-O 3.21Å; D24-G27 PolarHBondContact O-N 2.81Å; D24-G27 PolarHBondContact OD1-N 2.94Å
28	Y	71.5	Confident	65.8	Low	87 Å²	87	96 Å²	96	34%	0.341	45%	0.446	S	S	.	.			trans	-89.5	128	173.5	-60	-74.7	0	0	0	111	Y23 D24 Y26 K34	Y23-Y28 CarbonylContact C-O 3.49Å; Y23-Y28 VanDerWaalsContact CA-O 3.3Å; Y23-Y28 WeakPolarHBondContact CA-O 3.37Å; D24-Y28 PolarHBondContact N-O 2.81Å; D24-Y28 WeakPolarHBondContact OD1-CD2 3.28Å; D24-Y28 PolarHBondContact OD1-N 2.92Å; D24-Y28 WeakPolarHBondContact OD2-CD2 3.34Å; Y26-Y28 VanDerWaalsContact CB-CE2 3.45Å; Y26-Y28 HydrophobicContact CG-CE2 4.32Å; Y28-K34 HydrophobicContact CE1-CB 4.38Å
29	E	67.2	Low	64	Low	91 Å²	91	102 Å²	102	43%	0.425	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	-68.9	143.9	175.2	-175.9	176.5	-163.6	0	0	110.9	G22 Y23 G31 Y32	G22-E29 CarbonylContact O-C 3.47Å; G22-E29 VanDerWaalsContact O-CA 3.28Å; G22-E29 WeakPolarHBondContact O-CA 3.26Å; Y23-E29 HydrophobicContact CD1-CB 4.21Å; Y23-E29 HydrophobicContact CE1-CB 4Å; E29-G31 PolarHBondContact O-N 3.41Å; E29-Y32 HydrophobicContact CB-CD2 4.05Å; E29-Y32 HydrophobicContact CG-CD2 4.44Å; E29-Y32 PolarHBondContact O-N 2.91Å
30	K	63.2	Low	62.2	Low	114 Å²	114	109.1 Å²	109.1	50%	0.496	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	91.8	178.8	-170.6	173.8	-174.3	167.6	0	110.9	D14 Y18 G22	D14-K30 IonicContact OD2-NZ 3.53Å; Y18-K30 HydrophobicContact CD1-CB 3.66Å; Y18-K30 HydrophobicContact CD1-CG 4.19Å; Y18-K30 HydrophobicContact CD2-CB 4.46Å; Y18-K30 HydrophobicContact CD2-CD 4.05Å; Y18-K30 HydrophobicContact CD2-CG 4.12Å; Y18-K30 HydrophobicContact CE1-CB 3.65Å; Y18-K30 HydrophobicContact CE1-CG 4.06Å; Y18-K30 HydrophobicContact CE2-CB 4.48Å; Y18-K30 HydrophobicContact CE2-CD 4.36Å; Y18-K30 HydrophobicContact CE2-CG 4Å; Y18-K30 HydrophobicContact CG-CB 4.07Å; Y18-K30 HydrophobicContact CG-CD 4.16Å; Y18-K30 HydrophobicContact CG-CG 4.21Å; G22-K30 WeakPolarHBondContact O-CB 3.33Å; G22-K30 PolarHBondContact O-N 2.97Å
31	G	60.9	Low	60.3	Low	21 Å²	21	104.8 Å²	104.8	22%	0.216	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	144.4	-30.9	-176.8	0	0	0	0	0	112.6	E29 D38 K39	E29-G31 PolarHBondContact O-N 3.41Å; G31-D38 CarbonylContact O-C 3.52Å; G31-D38 WeakPolarHBondContact O-CA 3.27Å; G31-K39 PolarHBondContact O-N 3.16Å
32	Y	50.6	Low	58.5	Low	123 Å²	123	107.7 Å²	107.7	48%	0.482	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-99.8	123.4	-175.6	-65.4	-86.6	0	0	0	111.3	E29	E29-Y32 HydrophobicContact CB-CD2 4.05Å; E29-Y32 HydrophobicContact CG-CD2 4.44Å; E29-Y32 PolarHBondContact O-N 2.91Å
33	D	51.9	Low	56.6	Low	76 Å²	76	115.2 Å²	115.2	41%	0.406	54%	0.537	S	S	.	.			trans	-72.2	172.2	164.9	75.6	9.2	0	0	0	111.3	Y35 G36 Y37	D33-Y35 PolarHBondContact O-N 2.91Å; D33-Y35 WeakPolarHBondContact OD1-CA 3.45Å; D33-Y35 WeakPolarHBondContact OD1-CB 3.28Å; D33-Y35 PolarHBondContact OD1-N 3.06Å; D33-G36 PolarHBondContact O-N 2.83Å; D33-G36 PolarHBondContact OD1-N 2.82Å; D33-G36 VanDerWaalsContact OD1-N 3.14Å; D33-Y37 PolarHBondContact N-O 2.75Å; D33-Y37 VanDerWaalsContact N-O 3.08Å; D33-Y37 PolarHBondContact OD1-N 2.93Å
34	K	48.3	Very low	54.7	Low	151 Å²	151	118.9 Å²	118.9	66%	0.657	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-13.2	178.4	-178.5	175.2	177.5	-173.1	0	114.2	Y28	Y28-K34 HydrophobicContact CE1-CB 4.38Å
35	Y	49.2	Very low	52.5	Low	178 Å²	178	127.4 Å²	127.4	70%	0.698	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	9.3	-178.5	-61.2	-75.9	0	0	0	113.2	D33 Y37	D33-Y35 PolarHBondContact O-N 2.91Å; D33-Y35 WeakPolarHBondContact OD1-CA 3.45Å; D33-Y35 WeakPolarHBondContact OD1-CB 3.28Å; D33-Y35 PolarHBondContact OD1-N 3.06Å; Y35-Y37 VanDerWaalsContact C-N 3.31Å; Y35-Y37 WeakPolarHBondContact O-CD2 3.41Å; Y35-Y37 WeakPolarHBondContact O-CE2 3.19Å
36	G	46.9	Very low	50.5	Low	47 Å²	47	122.9 Å²	122.9	49%	0.485	58%	0.579	S	S	.	*	S	Bend	trans	75.7	16.9	177.4	0	0	0	0	0	114	D33	D33-G36 PolarHBondContact O-N 2.83Å; D33-G36 PolarHBondContact OD1-N 2.82Å; D33-G36 VanDerWaalsContact OD1-N 3.14Å
37	Y	42.9	Very low	48.6	Very low	154 Å²	154	126.6 Å²	126.6	60%	0.604	59%	0.593	S	S	*	*			trans	-89.6	124.7	174.8	-65.5	-86.7	0	0	0	109.7	D33 Y35 K39	D33-Y37 PolarHBondContact N-O 2.75Å; D33-Y37 VanDerWaalsContact N-O 3.08Å; D33-Y37 PolarHBondContact OD1-N 2.93Å; Y35-Y37 VanDerWaalsContact C-N 3.31Å; Y35-Y37 WeakPolarHBondContact O-CD2 3.41Å; Y35-Y37 WeakPolarHBondContact O-CE2 3.19Å; Y37-K39 PolarHBondContact O-N 3.39Å
38	D	45.3	Very low	47.1	Very low	79 Å²	79	131.6 Å²	131.6	42%	0.422	61%	0.609	S	S	.	*	B	Isolated β-bridge	trans	-56.1	131.9	166.5	-173.7	-7.4	0	0	0	108.4	G31 Y40 G41	G31-D38 CarbonylContact O-C 3.52Å; G31-D38 WeakPolarHBondContact O-CA 3.27Å; D38-Y40 PolarHBondContact O-N 2.89Å; D38-Y40 PolarHBondContact OD1-N 2.93Å; D38-G41 PolarHBondContact O-N 2.87Å
39	K	45	Very low	45.3	Very low	186 Å²	186	134.9 Å²	134.9	81%	0.809	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-14.1	171.2	-166.9	175.4	180	-177.4	0	112.8	G31 Y37	G31-K39 PolarHBondContact O-N 3.16Å; Y37-K39 PolarHBondContact O-N 3.39Å
40	Y	45.2	Very low	43.9	Very low	190 Å²	190	141 Å²	141	75%	0.745	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	38.8	168.8	-64.5	-78.9	0	0	0	114.1	D38 Y42	D38-Y40 PolarHBondContact O-N 2.89Å; D38-Y40 PolarHBondContact OD1-N 2.93Å; Y40-Y42 PolarHBondContact O-N 3.25Å
41	G	40.5	Very low	42.7	Very low	51 Å²	51	138.6 Å²	138.6	53%	0.526	65%	0.653	S	S	.	*			trans	-38.1	113.4	169.3	0	0	0	0	0	112	D38	D38-G41 PolarHBondContact O-N 2.87Å
42	Y	40.3	Very low	41.7	Very low	218 Å²	218	144.9 Å²	144.9	86%	0.855	68%	0.682	S	S	*	*	S	Bend	trans	71.3	96.8	175.6	-63	-93.2	0	0	0	115.1	Y40 K44	Y40-Y42 PolarHBondContact O-N 3.25Å; Y42-K44 PolarHBondContact O-N 2.73Å
43	E	39.1	Very low	41	Very low	174 Å²	174	147.3 Å²	147.3	81%	0.813	70%	0.698	S	S	*	*			trans	-45.5	105.5	155.7	-80.7	175.5	153.7	0	0	109.5	Y45	E43-Y45 PolarHBondContact O-N 2.93Å
44	K	37.9	Very low	40.1	Very low	174 Å²	174	152.2 Å²	152.2	76%	0.757	72%	0.715	S	S	*	*	S	Bend	trans	-62.5	-9.3	-174.7	-171.8	175.3	175	177.9	0	114	Y42	Y42-K44 PolarHBondContact O-N 2.73Å
45	Y	36.8	Very low	39.7	Very low	214 Å²	214	154.9 Å²	154.9	84%	0.839	72%	0.723	S	S	*	*	S	Bend	trans	-159.9	95.8	177.5	-74.8	-77.5	0	0	0	108.9	E43	E43-Y45 PolarHBondContact O-N 2.93Å
46	G	35.5	Very low	38.9	Very low	45 Å²	45	149.2 Å²	149.2	46%	0.464	72%	0.719	S	S	.	*			trans	-145.8	-41.5	-169.1	0	0	0	0	0	118
47	Y	35.1	Very low	38.4	Very low	239 Å²	239	156.8 Å²	156.8	94%	0.937	73%	0.734	S	S	*	*			trans	-141.7	87	176.4	-86.3	-83.2	0	0	0	111.5
48	D	35.2	Very low	38.1	Very low	152 Å²	152	155.9 Å²	155.9	81%	0.813	74%	0.74	S	S	*	*			trans	-74.9	135.1	165.6	-151.1	-6.8	0	0	0	108.9
49	K	34.5	Very low	37.8	Very low	156 Å²	156	160.1 Å²	160.1	68%	0.678	75%	0.754	S	S	*	*	S	Bend	trans	62.1	89	147.8	-144.8	-178.3	-174.7	179.4	0	118.8
50	Y	38.7	Very low	37.4	Very low	219 Å²	219	161.2 Å²	161.2	86%	0.859	76%	0.755	S	S	*	*			trans	97.7	87.8	166.5	-55.9	-75	0	0	0	115.6
51	G	36.4	Very low	37	Very low	63 Å²	63	155.6 Å²	155.6	65%	0.649	75%	0.754	S	S	*	*	S	Bend	trans	178.6	78.6	167.6	0	0	0	0	0	113.6
52	N	39.4	Very low	36.9	Very low	154 Å²	154	160.7 Å²	160.7	82%	0.824	77%	0.77	S	S	*	*			trans	73.5	78.3	165.9	-52.3	-59	0	0	0	114.3
53	E	36.1	Very low	36.7	Very low	174 Å²	174	155.7 Å²	155.7	81%	0.813	76%	0.758	S	S	*	*				54.6	83.3	76.8	-148.2	161.8	-146.8	0	0	112
54	K	34.7	Very low	36.5	Very low	179 Å²	179	154.4 Å²	154.4	78%	0.778	75%	0.75	S	S	*	*				56.9	78.6	123.1	-159.1	-177.3	-177.7	-174.3	0	116.6
55	Y	39	Very low	36.8	Very low	207 Å²	207	154.9 Å²	154.9	81%	0.812	75%	0.754	S	S	*	*			trans	-125	90.6	132	-78.3	-77.8	0	0	0	106.9	Y57	Y55-Y57 AromaticContact CD1-CD2 3.95Å; Y55-Y57 HydrophobicContact CD1-CD2 3.95Å; Y55-Y57 AromaticContact CD1-CE2 3.6Å; Y55-Y57 HydrophobicContact CD1-CE2 3.6Å; Y55-Y57 AromaticContact CE1-CE2 3.96Å; Y55-Y57 HydrophobicContact CE1-CE2 3.96Å
56	G	33.5	Very low	36.8	Very low	59 Å²	59	148.5 Å²	148.5	61%	0.608	75%	0.754	S	S	*	*			cis	75.1	23.4	20.8	0	0	0	0	0	112.8	D58	G56-D58 VanDerWaalsContact C-N 3.3Å; G56-D58 PolarHBondContact O-N 2.96Å
57	Y	35	Very low	37	Very low	206 Å²	206	155.2 Å²	155.2	81%	0.808	77%	0.772	S	S	*	*			trans	-90.1	87.1	155.1	-88.3	-77.3	0	0	0	108.4	Y55	Y55-Y57 AromaticContact CD1-CD2 3.95Å; Y55-Y57 HydrophobicContact CD1-CD2 3.95Å; Y55-Y57 AromaticContact CD1-CE2 3.6Å; Y55-Y57 HydrophobicContact CD1-CE2 3.6Å; Y55-Y57 AromaticContact CE1-CE2 3.96Å; Y55-Y57 HydrophobicContact CE1-CE2 3.96Å
58	D	36.9	Very low	37.3	Very low	135 Å²	135	147 Å²	147	72%	0.722	76%	0.76	S	S	*	*			trans	-57.7	148.3	164.3	-150.2	-12.9	0	0	0	109.6	G56 Y60	G56-D58 VanDerWaalsContact C-N 3.3Å; G56-D58 PolarHBondContact O-N 2.96Å; D58-Y60 PolarHBondContact O-N 2.82Å
59	K	38.3	Very low	37.5	Very low	168 Å²	168	148 Å²	148	73%	0.73	76%	0.758	S	S	*	*	S	Bend	trans	-56.5	109.9	165.5	-174.2	-174.5	178.2	-175.6	0	106.6
60	Y	37.8	Very low	37.9	Very low	208 Å²	208	147.4 Å²	147.4	82%	0.816	76%	0.762	S	S	*	*	S	Bend	trans	78.9	133.8	177.9	-53.2	-84	0	0	0	117.2	D58	D58-Y60 PolarHBondContact O-N 2.82Å
61	G	36.3	Very low	38.2	Very low	72 Å²	72	145.4 Å²	145.4	74%	0.742	75%	0.754	S	S	*	*			trans	124.6	81.4	147.5	0	0	0	0	0	116.5
62	D	39.3	Very low	38.4	Very low	159 Å²	159	152 Å²	152	85%	0.85	77%	0.768	S	S	*	*			trans	36.9	117.4	136.9	-81.5	-57.9	0	0	0	121.5
63	D	34.9	Very low	38.7	Very low	112 Å²	112	153 Å²	153	60%	0.599	77%	0.765	S	S	*	*				84.7	130.1	120.1	-147.8	13.1	0	0	0	118.7
64	K	36.3	Very low	39.1	Very low	148 Å²	148	155.1 Å²	155.1	64%	0.643	77%	0.767	S	S	*	*			trans	85.3	105.8	140.1	-105.3	168	-154.6	140	0	119.8
65	H	42.3	Very low	39.4	Very low	183 Å²	183	149.9 Å²	149.9	85%	0.847	76%	0.764	S	S	*	*			trans	102.3	114.6	146.5	-50.6	95.9	0	0	0	117.6
66	G	37.7	Very low	39.6	Very low	81 Å²	81	150.2 Å²	150.2	84%	0.835	77%	0.765	S	S	*	*			trans	162.4	55.9	160.2	0	0	0	0	0	115.8
67	H	40	Very low	40.1	Very low	185 Å²	185	150.8 Å²	150.8	86%	0.856	76%	0.757	S	S	*	*			trans	-66.9	129.2	172.9	-127.6	-70.7	0	0	0	111.1
68	G	41.7	Very low	40.6	Very low	66 Å²	66	151.4 Å²	151.4	68%	0.68	76%	0.764	S	S	*	*			trans	178.8	77.4	165.9	0	0	0	0	0	110.2
69	K	38.9	Very low	41	Very low	174 Å²	174	151.7 Å²	151.7	76%	0.757	76%	0.761	S	S	*	*				42.4	79.5	96.3	-68	-169.6	-177.9	179.9	0	113.3
70	D	43.1	Very low	41.1	Very low	144 Å²	144	154.1 Å²	154.1	77%	0.77	77%	0.767	S	S	*	*			trans	-132.4	126.5	142.8	-82.2	-37.9	0	0	0	109.5
71	Y	44.2	Very low	41.5	Very low	177 Å²	177	149.5 Å²	149.5	69%	0.694	77%	0.765	S	S	*	*			trans	-97.1	138.1	-159	24	-84.4	0	0	0	109.2	K73	Y71-K73 PolarHBondContact O-N 2.95Å
72	E	41.9	Very low	42	Very low	201 Å²	201	155.3 Å²	155.3	94%	0.939	77%	0.77	S	S	*	*			trans	14.8	100.9	150.2	-65.1	178.3	160.4	0	0	116.6
73	K	44.2	Very low	42.3	Very low	176 Å²	176	153.5 Å²	153.5	77%	0.765	76%	0.76	S	S	*	*			trans	-144.1	90.9	173.8	-168.3	161.1	-179.2	-168.6	0	111.7	Y71	Y71-K73 PolarHBondContact O-N 2.95Å
74	Y	45.1	Very low	42.7	Very low	217 Å²	217	158.2 Å²	158.2	85%	0.851	77%	0.771	S	S	*	*			trans	70.1	111.5	167.4	-57.9	-84.2	0	0	0	116.3
75	G	40.6	Very low	43.3	Very low	69 Å²	69	159.7 Å²	159.7	71%	0.711	78%	0.777	S	S	*	*			cis	108.1	91.9	24.9	0	0	0	0	0	109.3
76	Y	43.8	Very low	43.7	Very low	215 Å²	215	156 Å²	156	84%	0.843	76%	0.764	S	S	*	*			trans	-151.6	87.1	152.3	-132.1	-95.5	0	0	0	111.8
77	T	44.5	Very low	44.3	Very low	71 Å²	71	161.7 Å²	161.7	44%	0.436	76%	0.761	S	S	.	*			trans	51.1	109.1	140.2	64.5	0	0	0	0	119.9	E79	T77-E79 PolarHBondContact O-N 2.76Å
78	K	45.4	Very low	44.7	Very low	219 Å²	219	162.2 Å²	162.2	95%	0.952	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.5	37.2	145.2	-149.7	172.9	-174.4	175.7	0	114.7
79	E	43.9	Very low	45.1	Very low	140 Å²	140	166.8 Å²	166.8	65%	0.654	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-18.7	177	-88.4	-167.1	139.4	0	0	113.5	T77 S81 K82	T77-E79 PolarHBondContact O-N 2.76Å; E79-S81 PolarHBondContact O-N 2.91Å; E79-K82 PolarHBondContact O-N 2.85Å
80	Y	41	Very low	45.7	Very low	220 Å²	220	167.3 Å²	167.3	86%	0.863	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	0.1	-179.9	-107.6	-94.9	0	0	0	114.9
81	S	47.4	Very low	45.8	Very low	110 Å²	110	169.5 Å²	169.5	77%	0.769	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	1.6	-178.5	-169.4	0	0	0	0	114.6	E79	E79-S81 PolarHBondContact O-N 2.91Å
82	K	46	Very low	46	Very low	194 Å²	194	168.2 Å²	168.2	84%	0.843	77%	0.765	S	S	*	*	S	Bend	trans	-110.6	-8.7	-179.9	-81	-179.3	179.2	173.8	0	115.6	E79	E79-K82 PolarHBondContact O-N 2.85Å
83	N	45.5	Very low	46.5	Very low	121 Å²	121	167.4 Å²	167.4	65%	0.647	76%	0.758	S	S	*	*	S	Bend	trans	-105.5	7.6	-170.3	-132.4	-17.3	0	0	0	115.5
84	Y	44.2	Very low	46.6	Very low	211 Å²	211	168.2 Å²	168.2	83%	0.827	76%	0.758	S	S	*	*	S	Bend	trans	-85.9	-3.3	-178.7	-127.4	-89.6	0	0	0	114.5
85	K	48.9	Very low	46.7	Very low	180 Å²	180	165.2 Å²	165.2	78%	0.783	76%	0.756	S	S	*	*	S	Bend	trans	-96.6	-16.4	-178.6	-97.1	-179	177.4	178.9	0	114.7
86	D	50.2	Low	46.9	Very low	106 Å²	106	172.5 Å²	172.5	57%	0.567	76%	0.764	S	S	*	*	S	Bend	trans	-92.1	-18.1	-179.5	-71.3	-24.1	0	0	0	113.1	Y88 K89	D86-Y88 PolarHBondContact O-N 3Å; D86-K89 PolarHBondContact O-N 2.99Å
87	Y	48.7	Very low	47	Very low	199 Å²	199	164.7 Å²	164.7	78%	0.78	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-16.8	-179.2	-155.7	-100.6	0	0	0	114
88	Y	49.5	Very low	47	Very low	197 Å²	197	166.9 Å²	166.9	77%	0.773	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	4.4	-179.9	-103.9	-86.6	0	0	0	115	D86	D86-Y88 PolarHBondContact O-N 3Å
89	K	50.6	Low	47	Very low	162 Å²	162	167.8 Å²	167.8	70%	0.704	77%	0.765	S	S	*	*	S	Bend	trans	-94.8	4.1	-179.6	-90.5	-178.6	177.2	176	0	115.4	D86	D86-K89 PolarHBondContact O-N 2.99Å
90	K	49.8	Very low	46.8	Very low	185 Å²	185	170.7 Å²	170.7	80%	0.804	77%	0.771	S	S	*	*	S	Bend	trans	-99.5	-1.3	-179.6	-159	169	-179.9	176	0	114.3
91	Y	45.9	Very low	47.1	Very low	190 Å²	190	169 Å²	169	75%	0.745	77%	0.771	S	S	*	*	S	Bend	trans	-110.7	14.3	-178.3	-79.8	-80.7	0	0	0	115.1	K93	Y91-K93 VanDerWaalsContact C-N 3.32Å; Y91-K93 PolarHBondContact O-N 3.42Å
92	D	48.3	Very low	47.1	Very low	149 Å²	149	172.5 Å²	172.5	80%	0.797	77%	0.772	S	S	*	*	S	Bend	trans	-93	35.9	172.2	-74.1	-34.3	0	0	0	113
93	K	53.6	Low	47	Very low	185 Å²	185	172.8 Å²	172.8	80%	0.804	77%	0.77	S	S	*	*			trans	-134.2	20.6	-179.1	-145.8	-173.9	-179.4	-175.6	0	115.5	Y91	Y91-K93 VanDerWaalsContact C-N 3.32Å; Y91-K93 PolarHBondContact O-N 3.42Å
94	Y	44.6	Very low	46.9	Very low	193 Å²	193	171.8 Å²	171.8	76%	0.757	77%	0.772	S	S	*	*			trans	-123.9	87.3	165.9	-69.5	-76.4	0	0	0	109.3	Y96	Y94-Y96 PolarHBondContact O-N 2.97Å
95	D	47.9	Very low	46.7	Very low	154 Å²	154	172.5 Å²	172.5	82%	0.824	78%	0.775	S	S	*	*			trans	-53.1	91.1	152.9	179.2	26.1	0	0	0	108.8	G97	D95-G97 VanDerWaalsContact C-N 3.32Å; D95-G97 PolarHBondContact OD1-N 2.85Å; D95-G97 VanDerWaalsContact OD1-N 3.16Å
96	Y	45.8	Very low	46.8	Very low	221 Å²	221	175 Å²	175	87%	0.867	78%	0.779	S	S	*	*			trans	-104.9	57.1	157.2	-108.2	-89.3	0	0	0	107.5	Y94 S98	Y94-Y96 PolarHBondContact O-N 2.97Å; Y96-S98 PolarHBondContact O-N 2.89Å
97	G	44.6	Very low	46.8	Very low	52 Å²	52	178.4 Å²	178.4	54%	0.536	79%	0.789	S	S	.	*			trans	-56.6	125.8	161	0	0	0	0	0	110.5	D95	D95-G97 VanDerWaalsContact C-N 3.32Å; D95-G97 PolarHBondContact OD1-N 2.85Å; D95-G97 VanDerWaalsContact OD1-N 3.16Å
98	S	45.3	Very low	46.7	Very low	117 Å²	117	175.3 Å²	175.3	82%	0.818	79%	0.786	S	S	*	*	S	Bend	trans	60	76.3	144.7	-150.9	0	0	0	0	117.6	Y96	Y96-S98 PolarHBondContact O-N 2.89Å
99	R	44.4	Very low	46.4	Very low	238 Å²	238	174.3 Å²	174.3	90%	0.898	79%	0.788	S	S	*	*			trans	-165.6	86.8	151.3	-127.4	178.8	-109.3	174.8	-5.8	112.9
100	Y	41.4	Very low	46.5	Very low	200 Å²	200	173.8 Å²	173.8	78%	0.784	79%	0.793	S	S	*	*			trans	-152.7	66.9	151.9	-116.1	-82.4	0	0	0	109.4	K102 Y103	Y100-K102 PolarHBondContact O-N 2.87Å; Y100-Y103 HydrophobicContact CD1-CE2 4.48Å; Y100-Y103 HydrophobicContact CE1-CD2 4.16Å; Y100-Y103 AromaticContact CE1-CE2 3.71Å; Y100-Y103 HydrophobicContact CE1-CE2 3.71Å
101	E	46.9	Very low	46.5	Very low	185 Å²	185	172.3 Å²	172.3	86%	0.864	79%	0.787	S	S	*	*			trans	-69	107.6	157.9	-83.9	177.8	138.9	0	0	108.9
102	K	46.1	Very low	46.5	Very low	183 Å²	183	170.6 Å²	170.6	80%	0.796	79%	0.785	S	S	*	*				47.3	84.2	124.4	-155.9	176.6	-173.1	-178.1	0	116.4	Y100 S104	Y100-K102 PolarHBondContact O-N 2.87Å; K102-S104 PolarHBondContact O-N 2.77Å
103	Y	43.8	Very low	46.5	Very low	200 Å²	200	169.9 Å²	169.9	78%	0.784	78%	0.781	S	S	*	*			trans	-70.5	90.2	160.4	-77.8	-82.9	0	0	0	110.6	Y100	Y100-Y103 HydrophobicContact CD1-CE2 4.48Å; Y100-Y103 HydrophobicContact CE1-CD2 4.16Å; Y100-Y103 AromaticContact CE1-CE2 3.71Å; Y100-Y103 HydrophobicContact CE1-CE2 3.71Å
104	S	44.6	Very low	46	Very low	100 Å²	100	170.3 Å²	170.3	70%	0.699	79%	0.786	S	S	*	*			trans	-86.8	106	160.1	42.7	0	0	0	0	109.6	K102 R106	K102-S104 PolarHBondContact O-N 2.77Å; S104-R106 PolarHBondContact O-N 2.99Å
105	Y	39.6	Very low	46.3	Very low	226 Å²	226	168.9 Å²	168.9	89%	0.886	79%	0.791	S	S	*	*			trans	-56.8	121.9	164.9	-125.8	-100.4	0	0	0	109.5
106	R	51.2	Low	45.8	Very low	233 Å²	233	169.8 Å²	169.8	88%	0.879	79%	0.79	S	S	*	*			trans	170.6	135.7	141.6	-94.7	155.7	-165	-167.5	4.9	114.3	S104	S104-R106 PolarHBondContact O-N 2.99Å
107	K	49.6	Very low	45.8	Very low	177 Å²	177	167.8 Å²	167.8	77%	0.77	79%	0.789	S	S	*	*			trans	81.1	106.1	147.3	-71.8	-164	166.9	-178.3	0	120.3
108	D	47.2	Very low	45.9	Very low	135 Å²	135	170.9 Å²	170.9	72%	0.722	79%	0.793	S	S	*	*				66.1	110	116.7	-50.9	-28.5	0	0	0	118.8
109	H	43.2	Very low	46.1	Very low	176 Å²	176	172.4 Å²	172.4	82%	0.815	79%	0.787	S	S	*	*			trans	-14.7	127.9	152	-77.3	-119	0	0	0	115.8
110	D	51.8	Low	46.3	Very low	150 Å²	150	168.9 Å²	168.9	80%	0.802	78%	0.78	S	S	*	*				-166.3	158.1	112	-114.6	-40.6	0	0	0	113
111	K	51.1	Low	46.5	Very low	155 Å²	155	165.9 Å²	165.9	67%	0.674	78%	0.778	S	S	*	*			trans	-86.5	174.1	-158.1	-60.9	160.8	-178.2	164.7	0	114.7
112	H	46.1	Very low	46.7	Very low	153 Å²	153	163.7 Å²	163.7	71%	0.708	77%	0.772	S	S	*	*			trans	85.1	141	158.6	-61.2	-82.2	0	0	0	116.3
113	D	48.4	Very low	46.6	Very low	135 Å²	135	162.8 Å²	162.8	72%	0.722	77%	0.77	S	S	*	*			cis	-166.2	135.7	-20.7	-98.3	-22.8	0	0	0	102.2
114	H	42.8	Very low	46.9	Very low	193 Å²	193	161.9 Å²	161.9	89%	0.894	77%	0.773	S	S	*	*			trans	-100.7	118.7	172.3	-86.8	-75.7	0	0	0	108
115	D	50	Low	46.9	Very low	163 Å²	163	163.7 Å²	163.7	87%	0.872	78%	0.775	S	S	*	*			trans	-111.7	124.7	156.1	-86.7	-38.5	0	0	0	108.5
116	E	38.4	Very low	47.5	Very low	173 Å²	173	160.9 Å²	160.9	81%	0.808	77%	0.769	S	S	*	*			trans	-70.7	147.8	174.6	-63.4	171.3	159.9	0	0	110.2
117	H	44.9	Very low	47	Very low	180 Å²	180	159.5 Å²	159.5	83%	0.833	76%	0.764	S	S	*	*			trans	-171.7	99.5	140.3	-94.1	-54.4	0	0	0	110.7
118	D	47.2	Very low	46.7	Very low	117 Å²	117	157.6 Å²	157.6	63%	0.626	76%	0.758	S	S	*	*				42.2	123.5	117	-83.5	-28	0	0	0	122.1
119	H	50.2	Low	46.9	Very low	149 Å²	149	159.6 Å²	159.6	69%	0.69	76%	0.762	S	S	*	*				96.2	137.7	127.9	-65.4	-42	0	0	0	122.2
120	H	47.3	Very low	46.9	Very low	164 Å²	164	158.8 Å²	158.8	76%	0.759	76%	0.759	S	S	*	*			trans	101.9	102.3	148	-70.7	-61.5	0	0	0	118.9
121	D	45.3	Very low	46.8	Very low	137 Å²	137	161 Å²	161	73%	0.733	76%	0.764	S	S	*	*			trans	-31	145.8	144	-56.7	-74.2	0	0	0	113.7
122	D	51.5	Low	46.3	Very low	139 Å²	139	160.6 Å²	160.6	74%	0.743	76%	0.764	S	S	*	*				175.4	125.9	116.8	-88.2	-34.3	0	0	0	111.7
123	H	44.4	Very low	46.6	Very low	164 Å²	164	160.3 Å²	160.3	76%	0.759	76%	0.763	S	S	*	*			trans	26	126.5	140.8	-66.4	-80	0	0	0	119.7
124	H	49.1	Very low	46.9	Very low	180 Å²	180	158.8 Å²	158.8	83%	0.833	76%	0.755	S	S	*	*				-170.1	118.9	116.8	-100.2	-70.5	0	0	0	112.1
125	D	45.8	Very low	47.6	Very low	139 Å²	139	157.1 Å²	157.1	74%	0.743	75%	0.747	S	S	*	*			trans	-90.9	126.2	175.1	-171.7	-0.4	0	0	0	108.5
126	H	51.2	Low	47.8	Very low	167 Å²	167	155.7 Å²	155.7	77%	0.773	74%	0.735	S	S	*	*			trans	-161.8	92.7	163.4	-85.6	-42.3	0	0	0	113.4
127	R	41.7	Very low	48.6	Very low	203 Å²	203	155.6 Å²	155.6	77%	0.766	73%	0.734	S	S	*	*				33.1	138.5	118.4	-84.4	-173.5	-171.5	-153.9	7.3	122.3
128	H	43.3	Very low	49	Very low	138 Å²	138	154.3 Å²	154.3	64%	0.639	73%	0.728	S	S	*	*			trans	75.7	116.6	147.9	-65.4	-74.1	0	0	0	119.3
129	H	51.8	Low	49.5	Very low	176 Å²	176	156.4 Å²	156.4	82%	0.815	73%	0.734	S	S	*	*				173.3	137.6	96.6	-98.7	-76.5	0	0	0	112.6
130	H	41.7	Very low	49.3	Very low	159 Å²	159	157.3 Å²	157.3	74%	0.736	74%	0.738	S	S	*	*			trans	-52.4	143.2	167.8	-76.4	-118.7	0	0	0	112.8
131	H	51	Low	49.8	Very low	198 Å²	198	157.5 Å²	157.5	92%	0.917	74%	0.739	S	S	*	*			trans	-149	142.8	133.4	-116	65.4	0	0	0	111.5
132	E	40	Very low	50.3	Low	146 Å²	146	156.7 Å²	156.7	68%	0.682	74%	0.735	S	S	*	*			trans	-116.5	175.8	-160.8	-167.4	173	-117.7	0	0	106.5
133	H	53.7	Low	50.7	Low	147 Å²	147	159.1 Å²	159.1	68%	0.681	74%	0.742	S	S	*	*			trans	81.4	140.8	174.1	-61.1	-102.4	0	0	0	117.4
134	D	53.6	Low	51.6	Low	103 Å²	103	160.5 Å²	160.5	55%	0.551	75%	0.745	S	S	*	*			cis	-178.1	171.4	-14.4	-113.1	-29.5	0	0	0	107.7
135	H	56.5	Low	51.7	Low	157 Å²	157	160.1 Å²	160.1	73%	0.727	75%	0.749	S	S	*	*			trans	90.7	134.1	151.7	-57.8	-52.2	0	0	0	119.5
136	H	55.3	Low	52.3	Low	134 Å²	134	157.2 Å²	157.2	62%	0.62	75%	0.753	S	S	*	*			cis	174.5	168.4	-19.6	-124	-121.9	0	0	0	106
137	H	54.8	Low	52.7	Low	170 Å²	170	159.4 Å²	159.4	79%	0.787	76%	0.76	S	S	*	*			trans	107.2	88.4	166.1	-60	91.8	0	0	0	114.6
138	H	53.5	Low	53.7	Low	153 Å²	153	151.8 Å²	151.8	71%	0.708	75%	0.745	S	S	*	*				47.1	116.3	77.3	-87.9	-109	0	0	0	114
139	H	57.3	Low	54	Low	161 Å²	161	160.1 Å²	160.1	75%	0.745	77%	0.773	S	S	*	*				-173.8	136.6	80.2	-130.8	-78.2	0	0	0	111.5
140	E	47.3	Very low	54.2	Low	168 Å²	168	159.3 Å²	159.3	79%	0.785	77%	0.771	S	S	*	*			trans	-69.9	155.4	171.3	-63.9	170.7	146.5	0	0	111.7
141	H	56.6	Low	54.8	Low	168 Å²	168	159.3 Å²	159.3	78%	0.778	77%	0.772	S	S	*	*				-165.3	136.5	125.8	-100.8	-67.8	0	0	0	112.6
142	D	55.7	Low	55	Low	120 Å²	120	157.2 Å²	157.2	64%	0.642	76%	0.764	S	S	*	*			trans	-42.8	152	178.1	-59.3	-88.5	0	0	0	116.9
143	H	60.7	Low	55.9	Low	191 Å²	191	157.8 Å²	157.8	88%	0.884	77%	0.769	S	S	*	*			trans	-158	98.4	130.3	-88.8	-61	0	0	0	112.6
144	K	63.2	Low	56	Low	192 Å²	192	158.5 Å²	158.5	84%	0.835	78%	0.775	S	S	*	*			trans	18.5	126.9	141.4	-65.2	177.5	-179.8	174.4	0	120.6
145	N	50.2	Low	56.2	Low	172 Å²	172	162.2 Å²	162.2	92%	0.92	79%	0.79	S	S	*	*			trans	-37	132.6	159.4	-65.7	-41.4	0	0	0	116.2
146	G	59.4	Low	56.2	Low	79 Å²	79	162.6 Å²	162.6	81%	0.814	79%	0.794	S	S	*	*			trans	-133.8	110	158.5	0	0	0	0	0	109.6
147	K	60.5	Low	56.3	Low	212 Å²	212	164.8 Å²	164.8	92%	0.922	81%	0.807	S	S	*	*			trans	-72	130	171.4	-71.6	179.6	175.8	177.8	0	109
148	G	61.6	Low	56.4	Low	44 Å²	44	164.3 Å²	164.3	45%	0.454	81%	0.809	S	S	.	*			trans	-88.7	155.1	166.6	0	0	0	0	0	111.7
149	Y	50.6	Low	56.6	Low	312 Å²	312	165.4 Å²	165.4	100%	1.224	82%	0.818	S	S	*	*			trans	73.9	0	166.9	-13.1	-71.9	0	0	0	117.5

Retrieved 149 of 149 residues in 104.7 ms (Link to these results)

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