data_1bja_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1bja _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 121.076 0.465 . . . . 31.03 111.563 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 58.09 4.65 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.778 1.029 . . . . 26.47 113.778 -164.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -69.44 -22.77 25.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 114.703 1.372 . . . . 28.43 114.703 -167.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 m -63.69 -40.17 96.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.09 0.471 . . . . 31.49 111.854 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -64.01 -39.66 94.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.914 -0.585 . . . . 32.01 111.576 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.8 mm -66.23 -51.6 57.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.692 -0.403 . . . . 34.02 111.227 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -55.02 -32.33 26.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 28.07 110.546 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -71.1 -57.83 4.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.648 -0.705 . . . . 53.45 112.299 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.8 -20.36 49.42 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.604 0.594 . . . . 38.08 112.604 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -87.7 6.7 33.61 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.041 0.756 . . . . 43.26 113.041 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 49.84 34.93 8.35 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.899 0.703 . . . . 56.62 112.899 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 66.75 28.23 9.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.701 1.371 . . . . 51.66 114.701 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 30.9 m -80.79 -28.61 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 N-CA-C 109.153 -0.684 . . . . 40.71 109.153 167.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.0 mt -94.22 139.79 30.58 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.443 -0.798 . . . . 40.98 112.702 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -100.57 -172.55 2.22 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.846 -0.742 . . . . 39.0 111.715 168.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -65.84 -20.99 66.44 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.141 0.496 . . . . 54.72 110.782 -172.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -91.07 -46.81 7.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.46 -0.791 . . . . 39.86 111.876 -173.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . 0.433 ' CB ' ' O ' ' A' ' 116' ' ' HOH . 12.6 t -68.46 -25.49 65.02 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.647 0.737 . . . . 40.45 111.668 177.506 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.27 -45.07 57.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.985 -1.007 . . . . 26.83 112.888 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.1 t -69.32 -34.56 74.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.48 0.548 . . . . 23.41 112.48 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.0 mt -68.83 -36.39 73.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.316 -0.553 . . . . 25.36 111.025 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.5 tp -58.72 -40.62 84.27 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.826 1.417 . . . . 31.75 114.826 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.44 -43.34 94.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.107 -0.637 . . . . 33.4 110.9 -179.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.9 m -57.53 -44.17 84.91 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.571 . . . . 22.67 112.149 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.7 mt -69.76 -36.78 71.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.683 -0.69 . . . . 25.73 111.563 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.55 71.27 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.548 0.689 . . . . 25.35 111.609 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -21.85 32.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.42 -1.264 . . . . 36.73 112.851 -171.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' A' ' 130' ' ' HOH . 6.2 tttt -143.68 105.32 4.31 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.25 -0.58 . . . . 39.41 109.594 -177.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -58.52 134.96 57.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.22 -0.9 . . . . 35.69 112.288 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 69.46 17.13 8.11 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.611 0.597 . . . . 38.2 112.611 176.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.01 152.09 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 120.574 -0.45 . . . . 28.21 109.991 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.6 p -101.38 166.86 10.52 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.962 -1.086 . . . . 24.71 111.862 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.99 -35.63 79.09 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.47 0.308 . . . . 24.59 110.609 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.99 -33.38 75.46 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.306 0.484 . . . . 20.6 112.306 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -80.5 -31.88 37.08 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.617 1.34 . . . . 38.16 114.617 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.5 t -58.83 -37.72 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 119.937 -0.705 . . . . 25.03 111.202 169.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 88.9 mtm-85 -67.87 -35.92 79.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.156 0.428 . . . . 28.5 112.156 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.56 -27.85 56.05 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.642 0.978 . . . . 42.62 113.642 -173.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 18.5 m -88.19 2.54 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 113.202 0.816 . . . . 26.67 113.202 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -127.12 66.01 66.38 Favored Pre-proline 0 C--O 1.221 -0.422 0 O-C-N 121.999 -0.438 . . . . 24.51 110.288 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.26 -34.43 93.63 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 120.86 1.04 . . . . 36.46 111.081 177.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -28.46 3.57 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.223 -0.899 . . . . 56.37 113.423 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.7 mt -109.04 153.42 23.66 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.576 0.954 . . . . 45.74 113.576 -171.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.45 145.48 49.58 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.263 -0.97 . . . . 45.18 112.857 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -62.52 -37.62 86.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.95 -0.7 . . . . 55.97 111.443 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.06 -18.77 45.53 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.759 0.79 . . . . 46.73 112.029 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.5 -46.46 83.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 119.444 -0.902 . . . . 42.38 111.083 170.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.4 -44.03 91.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 112.023 0.379 . . . . 37.25 112.023 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.45 -42.92 99.51 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.594 0.961 . . . . 40.02 113.594 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.2 m -58.43 -51.21 70.79 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.404 0.621 . . . . 44.13 111.181 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -73.63 -24.7 60.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.713 -0.676 . . . . 42.7 112.544 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.32 -40.58 88.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 109.602 -0.518 . . . . 30.53 109.602 167.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -66.91 -38.16 92.69 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 121.131 -0.557 . . . . 36.49 112.863 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.43 -27.79 43.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 111.947 0.351 . . . . 35.11 111.947 173.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.38 -28.39 34.4 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 112.962 0.727 . . . . 37.67 112.962 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.5 mt -76.77 -32.51 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.978 0.732 . . . . 45.8 112.978 173.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -75.95 -4.34 40.49 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.185 0.809 . . . . 61.14 113.185 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -109.06 -12.85 14.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.087 1.143 . . . . 62.96 114.087 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 91.26 25.86 22.8 Favored Glycine 0 CA--C 1.501 -0.783 0 N-CA-C 109.149 -1.58 . . . . 48.18 109.149 173.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 78.1 mt -103.8 -36.48 7.82 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-O 121.68 0.752 . . . . 46.14 110.766 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.4 t -125.31 149.78 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 114.031 -1.44 . . . . 48.37 111.539 172.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -134.94 151.96 51.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.005 -1.109 . . . . 53.86 108.005 171.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -87.66 132.5 34.08 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.795 0.665 . . . . 60.17 112.795 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.1 t -110.62 97.89 7.21 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.041 -0.527 . . . . 49.63 110.335 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.74 -103.33 0.49 Allowed Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 116.019 -0.537 . . . . 41.37 112.09 -170.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -102.71 -12.17 17.86 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.119 0.485 . . . . 51.32 111.754 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -103.22 163.34 15.81 Favored Glycine 0 C--O 1.236 0.245 0 C-N-CA 121.022 -0.608 . . . . 38.97 113.682 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.9 mt -114.13 137.23 52.01 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.094 0.473 . . . . 30.57 111.12 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.36 145.47 19.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.784 -0.644 . . . . 36.64 109.346 -174.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.4 pt -90.74 145.06 7.88 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.408 0.623 . . . . 32.07 111.703 -172.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.5 p -79.18 168.62 19.35 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.919 -1.037 . . . . 40.12 109.325 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.82 -43.03 94.84 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 120.529 -0.843 . . . . 37.18 113.378 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.87 -54.05 13.77 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 117.713 0.756 . . . . 58.49 111.317 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.52 -39.93 74.18 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.663 1.357 . . . . 38.08 114.663 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -75.3 -13.53 60.43 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.35 0.87 . . . . 50.48 113.35 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -75.31 -43.95 48.15 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.316 -0.553 . . . . 52.3 110.539 171.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 73.3 mt -58.99 -44.12 90.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.679 -0.691 . . . . 35.18 111.666 174.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mm -63.04 -43.79 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.156 0.582 . . . . 32.04 112.429 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 t -76.06 -38.43 57.1 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.195 0.521 . . . . 33.23 111.395 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -55.51 -57.33 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 34.52 110.061 168.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.38 -46.92 62.96 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.735 1.383 . . . . 23.89 114.735 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.29 62.96 Favored 'General case' 0 C--O 1.243 0.749 0 O-C-N 121.966 -0.458 . . . . 22.01 112.183 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 93.6 m -72.38 -44.1 63.02 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.216 -0.447 . . . . 26.12 111.465 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -47.9 -62.2 1.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.34 1.056 . . . . 34.12 111.736 167.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -53.71 -53.37 53.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.579 -0.737 . . . . 39.8 110.74 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.97 -36.66 65.6 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.43 0.9 . . . . 29.2 113.43 -174.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -74.69 -30.18 61.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.748 0.647 . . . . 36.64 112.748 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -79.57 -15.81 57.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 112.88 0.696 . . . . 28.68 112.88 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.11 13.96 10.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.157 0.799 . . . . 38.59 113.157 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.56 -47.46 89.43 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 115.44 1.645 . . . . 30.84 115.44 -165.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -70.29 -21.64 30.75 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 117.994 -0.87 . . . . 39.84 112.943 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -35.27 42.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.527 -0.761 . . . . 65.03 112.009 177.149 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.0 -34.44 59.72 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 112.76 0.652 . . . . 41.3 112.76 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -4.49 59.18 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.856 2.169 . . . . 38.79 116.856 -165.05 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 17.4 mttt . . . . . 0 C--O 1.256 1.439 0 N-CA-C 113.253 0.835 . . . . 58.96 113.253 -177.625 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.501 2.084 0 N-CA-C 116.018 1.859 . . . . 63.8 116.018 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.36 32.44 5.93 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 122.568 1.175 . . . . 55.85 109.456 162.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 t -71.08 -27.7 30.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 113.572 -1.649 . . . . 36.58 112.4 -170.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -61.91 -19.98 63.29 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 121.513 -0.742 . . . . 37.97 112.997 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -68.83 -30.78 69.4 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.835 -0.346 . . . . 31.12 111.809 173.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 6.5 mt -69.17 -40.63 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.867 -0.79 . . . . 29.42 108.867 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 79.7 mt -60.58 -45.74 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.469 -0.787 . . . . 29.18 112.462 176.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.45 -54.97 39.12 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 122.365 -0.209 . . . . 47.81 111.517 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.1 -34.4 60.13 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.122 -0.49 . . . . 23.09 111.621 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 51.9 p -81.0 10.71 4.76 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.185 0.809 . . . . 27.47 113.185 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 52.16 42.8 30.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.353 0.661 . . . . 34.81 111.893 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 62.5 17.03 9.21 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 116.16 1.911 . . . . 40.67 116.16 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 2.7 m -90.32 2.28 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.177 0.806 . . . . 38.26 113.177 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.1 mt -115.54 151.53 34.7 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.398 -0.593 . . . . 34.73 109.398 170.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.97 -171.57 1.91 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 112.853 0.686 . . . . 36.47 112.853 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.03 -29.68 70.45 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 118.754 -1.179 . . . . 61.95 112.353 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -85.17 -51.48 6.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 116.966 2.21 . . . . 64.68 116.966 -173.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 8.1 p -57.89 -31.34 66.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.628 0.252 . . . . 33.34 111.642 172.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.68 -41.0 63.26 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.428 -0.351 . . . . 30.07 111.061 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -57.06 -50.23 73.4 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.439 -0.346 . . . . 31.3 111.226 170.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 5.4 mt -62.23 -38.73 81.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.096 -0.502 . . . . 23.72 111.282 -179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -45.71 87.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 30.19 111.579 174.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 4.7 mm -60.32 -44.49 95.95 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.601 -0.272 . . . . 25.09 111.461 178.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 60.1 m -57.59 -39.44 76.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.725 -0.39 . . . . 22.09 111.127 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 42.9 mt -77.61 -34.66 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.082 0.468 . . . . 19.68 111.907 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.41 -27.64 68.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.956 -0.565 . . . . 20.27 111.363 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -73.37 -23.06 60.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.206 1.558 . . . . 45.9 115.206 176.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -142.73 101.51 3.87 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.505 -0.478 . . . . 36.86 111.742 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -53.93 130.58 37.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.842 -0.617 . . . . 26.85 111.912 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 73.8 12.6 4.4 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.988 0.736 . . . . 18.27 112.988 174.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 15.6 tt -56.94 141.06 14.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.457 0.646 . . . . 18.04 110.188 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' THR . . . . . . . . . . . . . 31.9 p -86.16 160.36 19.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.959 -0.696 . . . . 19.54 110.572 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.6 -34.85 73.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.498 -0.319 . . . . 21.15 111.05 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.08 77.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.009 0.744 . . . . 22.69 113.009 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -69.21 -43.55 73.89 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.636 0.976 . . . . 40.64 113.636 174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.28 -51.57 46.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.06 0.393 . . . . 23.18 112.06 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 -60.65 -31.46 70.68 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.773 0.321 . . . . 33.2 111.325 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.13 -45.73 83.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 56.14 111.159 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 m -81.78 3.16 2.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 114.38 1.252 . . . . 43.72 114.38 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -130.72 59.54 46.62 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 114.305 1.224 . . . . 35.33 114.305 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -66.78 -23.15 48.61 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.699 1.599 . . . . 34.57 113.919 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -73.45 -18.1 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.687 0.625 . . . . 42.54 112.687 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 58.0 mt -89.33 -40.07 13.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.055 0.761 . . . . 34.47 113.055 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.14 155.7 32.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 121.427 -0.416 . . . . 29.88 113.73 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -58.3 -52.21 66.54 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 117.127 0.464 . . . . 31.56 110.77 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.01 -48.5 64.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.951 -0.568 . . . . 23.5 112.489 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.1 t -72.24 -40.75 66.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.88 -0.328 . . . . 25.02 111.532 -175.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.5 t -61.89 -48.48 88.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.264 -0.574 . . . . 19.75 111.866 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -59.55 -43.71 93.46 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.994 -0.548 . . . . 22.08 110.875 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 19.5 t -58.62 -47.98 82.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.352 -0.84 . . . . 19.03 112.238 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -71.84 -35.18 69.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.287 -0.87 . . . . 27.58 111.485 -175.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 57.7 mt -57.44 -43.92 83.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.303 . . . . 18.52 110.502 169.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.61 -38.73 95.48 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.802 -0.635 . . . . 19.04 113.492 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.9 t -62.9 -46.07 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.183 0.593 . . . . 19.09 111.015 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.88 -40.2 95.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.455 -0.339 . . . . 21.77 111.701 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 39.2 mt -61.8 -49.19 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.622 -0.263 . . . . 19.68 111.067 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -24.33 67.24 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.94 0.718 . . . . 41.67 112.94 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -86.01 -9.02 57.53 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.467 0.914 . . . . 48.07 113.467 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . 77.92 18.75 76.46 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.609 -0.805 . . . . 21.32 113.581 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 48.3 mt -88.29 -30.28 19.75 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.354 0.597 . . . . 21.17 111.134 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 71.7 t -129.11 155.18 40.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.539 -1.282 . . . . 20.16 107.539 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -133.43 128.94 36.57 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.682 -1.229 . . . . 49.06 107.682 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -66.05 127.68 33.07 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.673 -0.862 . . . . 41.17 108.673 167.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -136.29 97.12 3.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.752 -1.203 . . . . 21.81 107.752 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.17 -129.03 12.16 Favored Glycine 0 C--O 1.22 -0.756 0 C-N-CA 120.381 -0.914 . . . . 17.38 113.119 -172.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 39.5 p-10 -90.4 9.4 29.16 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.181 0.515 . . . . 30.23 111.823 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -136.86 -173.13 12.78 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 119.954 -1.117 . . . . 18.95 113.892 -169.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 23.7 mt -128.49 138.11 52.12 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.463 -0.569 . . . . 19.1 109.463 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 9.5 tt -137.83 142.16 36.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.15 -0.477 . . . . 29.1 110.981 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 4.4 pt -77.34 154.22 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 C-N-CA 120.245 -0.582 . . . . 22.23 110.392 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 66.9 p -92.8 177.71 6.01 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 121.231 0.539 . . . . 24.11 111.284 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.0 -36.39 93.4 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.214 -0.994 . . . . 24.44 113.201 172.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -59.3 -40.95 87.81 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 122.375 -0.486 . . . . 46.3 111.796 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.32 63.77 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.802 1.038 . . . . 22.25 113.802 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -42.61 93.72 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.039 -0.413 . . . . 64.36 110.688 175.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -55.12 -57.01 13.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.349 1.06 . . . . 34.1 113.57 171.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ILE . . . . . . . . . . . . . 62.9 mt -51.31 -43.62 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.968 -0.56 . . . . 23.26 111.449 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 13.7 mt -74.2 -31.13 28.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 113.381 0.882 . . . . 27.54 113.381 -176.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.6 p -74.18 -39.25 63.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.322 -0.551 . . . . 36.49 110.889 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -58.96 -41.93 88.68 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.633 0.605 . . . . 41.07 112.633 172.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.85 -46.65 88.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.841 0.682 . . . . 25.06 112.841 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -43.58 98.52 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 116.025 -0.534 . . . . 24.21 111.34 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 83.1 m -62.1 -46.91 86.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.844 1.053 . . . . 29.87 113.844 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 16.9 mt -54.1 -50.06 67.7 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.163 0.506 . . . . 25.35 111.022 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -61.95 -40.34 95.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.701 -0.681 . . . . 37.25 111.022 -177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.61 -43.98 75.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 25.04 110.218 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -59.43 -28.37 66.88 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 113.282 0.845 . . . . 25.81 113.282 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.82 -26.32 22.88 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 114.532 1.308 . . . . 30.54 114.532 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -131.48 36.81 3.74 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.819 1.044 . . . . 33.97 113.819 -177.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.24 -58.39 8.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 116.708 2.114 . . . . 29.46 116.708 -167.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.02 -20.07 34.07 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 117.603 -1.131 . . . . 31.5 113.833 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -27.31 60.32 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.787 0.662 . . . . 52.92 112.787 175.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mt -70.27 -39.05 75.16 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.695 0.998 . . . . 32.56 113.695 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 91.1 mt -83.82 -6.85 59.52 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.373 0.879 . . . . 26.94 113.373 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.765 -1.112 . . . . 44.45 111.407 -172.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . 0.433 ' O ' ' CB ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' A' ' 29' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 121.076 0.465 . . . . 31.03 111.563 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 58.09 4.65 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.778 1.029 . . . . 26.47 113.778 -164.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -69.44 -22.77 25.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 114.703 1.372 . . . . 28.43 114.703 -167.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 m -63.69 -40.17 96.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.09 0.471 . . . . 31.49 111.854 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -64.01 -39.66 94.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.914 -0.585 . . . . 32.01 111.576 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . 0.851 HD11 HD13 ' B' ' 95' ' ' LEU . 37.8 mm -66.23 -51.6 57.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.692 -0.403 . . . . 34.02 111.227 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -55.02 -32.33 26.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 28.07 110.546 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' HD2' HD11 ' A' ' 85' ' ' LEU . 10.5 tmtt? -71.1 -57.83 4.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.648 -0.705 . . . . 53.45 112.299 179.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 134' ' ' HOH . . . -58.8 -20.36 49.42 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.604 0.594 . . . . 38.08 112.604 177.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 14' ' ' VAL . 1.1 p -87.7 6.7 33.61 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.041 0.756 . . . . 43.26 113.041 179.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 49.84 34.93 8.35 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.899 0.703 . . . . 56.62 112.899 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 66.75 28.23 9.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.701 1.371 . . . . 51.66 114.701 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 11' ' ' SER . 30.9 m -80.79 -28.61 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 N-CA-C 109.153 -0.684 . . . . 40.71 109.153 167.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.402 ' HB3' HG23 ' A' ' 19' ' ' THR . 38.0 mt -94.22 139.79 30.58 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.443 -0.798 . . . . 40.98 112.702 -178.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.451 ' H ' HG22 ' A' ' 19' ' ' THR . 32.3 p30 -100.57 -172.55 2.22 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.846 -0.742 . . . . 39.0 111.715 168.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 3.5 mp0 -65.84 -20.99 66.44 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.141 0.496 . . . . 54.72 110.782 -172.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -91.07 -46.81 7.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.46 -0.791 . . . . 39.86 111.876 -173.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 116' ' ' HOH . 12.6 t -68.46 -25.49 65.02 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.647 0.737 . . . . 40.45 111.668 177.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 24' ' ' ILE . . . -73.27 -45.07 57.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.985 -1.007 . . . . 26.83 112.888 176.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.1 t -69.32 -34.56 74.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.48 0.548 . . . . 23.41 112.48 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.0 mt -68.83 -36.39 73.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.316 -0.553 . . . . 25.36 111.025 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.5 tp -58.72 -40.62 84.27 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.826 1.417 . . . . 31.75 114.826 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . 0.602 HD11 HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER -65.44 -43.34 94.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.107 -0.637 . . . . 33.4 110.9 -179.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.9 m -57.53 -44.17 84.91 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.571 . . . . 22.67 112.149 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . 0.558 HG22 HG23 ' A' ' 71' ' ' ILE . 26.7 mt -69.76 -36.78 71.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.683 -0.69 . . . . 25.73 111.563 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.55 71.27 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.548 0.689 . . . . 25.35 111.609 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HD2' ' HG3' ' B' ' 96' ' ' LYS . 0.0 OUTLIER -83.6 -21.85 32.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.42 -1.264 . . . . 36.73 112.851 -171.021 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' A' ' 130' ' ' HOH . 6.2 tttt -143.68 105.32 4.31 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.25 -0.58 . . . . 39.41 109.594 -177.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -58.52 134.96 57.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.22 -0.9 . . . . 35.69 112.288 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 69.46 17.13 8.11 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.611 0.597 . . . . 38.2 112.611 176.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.01 152.09 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 120.574 -0.45 . . . . 28.21 109.991 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.6 p -101.38 166.86 10.52 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.962 -1.086 . . . . 24.71 111.862 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.99 -35.63 79.09 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.47 0.308 . . . . 24.59 110.609 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.99 -33.38 75.46 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.306 0.484 . . . . 20.6 112.306 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -80.5 -31.88 37.08 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.617 1.34 . . . . 38.16 114.617 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.5 t -58.83 -37.72 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 119.937 -0.705 . . . . 25.03 111.202 169.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 88.9 mtm-85 -67.87 -35.92 79.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.156 0.428 . . . . 28.5 112.156 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.56 -27.85 56.05 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.642 0.978 . . . . 42.62 113.642 -173.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 18.5 m -88.19 2.54 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 113.202 0.816 . . . . 26.67 113.202 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -127.12 66.01 66.38 Favored Pre-proline 0 C--O 1.221 -0.422 0 O-C-N 121.999 -0.438 . . . . 24.51 110.288 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.26 -34.43 93.63 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 120.86 1.04 . . . . 36.46 111.081 177.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -28.46 3.57 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.223 -0.899 . . . . 56.37 113.423 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.7 mt -109.04 153.42 23.66 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.576 0.954 . . . . 45.74 113.576 -171.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.45 145.48 49.58 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.263 -0.97 . . . . 45.18 112.857 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -62.52 -37.62 86.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.95 -0.7 . . . . 55.97 111.443 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.06 -18.77 45.53 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.759 0.79 . . . . 46.73 112.029 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.5 -46.46 83.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 119.444 -0.902 . . . . 42.38 111.083 170.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 53' ' ' ILE . 46.8 t -59.4 -44.03 91.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 112.023 0.379 . . . . 37.25 112.023 177.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.45 -42.92 99.51 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.594 0.961 . . . . 40.02 113.594 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.2 m -58.43 -51.21 70.79 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.404 0.621 . . . . 44.13 111.181 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -73.63 -24.7 60.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.713 -0.676 . . . . 42.7 112.544 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 49' ' ' VAL . 42.9 mt -65.32 -40.58 88.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 109.602 -0.518 . . . . 30.53 109.602 167.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -66.91 -38.16 92.69 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 121.131 -0.557 . . . . 36.49 112.863 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.43 -27.79 43.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 111.947 0.351 . . . . 35.11 111.947 173.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.38 -28.39 34.4 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 112.962 0.727 . . . . 37.67 112.962 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 62' ' ' VAL . 15.5 mt -76.77 -32.51 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.978 0.732 . . . . 45.8 112.978 173.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -75.95 -4.34 40.49 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.185 0.809 . . . . 61.14 113.185 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -109.06 -12.85 14.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.087 1.143 . . . . 62.96 114.087 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 91.26 25.86 22.8 Favored Glycine 0 CA--C 1.501 -0.783 0 N-CA-C 109.149 -1.58 . . . . 48.18 109.149 173.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 78.1 mt -103.8 -36.48 7.82 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-O 121.68 0.752 . . . . 46.14 110.766 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 57' ' ' ILE . 58.4 t -125.31 149.78 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 114.031 -1.44 . . . . 48.37 111.539 172.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -134.94 151.96 51.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.005 -1.109 . . . . 53.86 108.005 171.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -87.66 132.5 34.08 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.795 0.665 . . . . 60.17 112.795 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.1 t -110.62 97.89 7.21 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.041 -0.527 . . . . 49.63 110.335 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.74 -103.33 0.49 Allowed Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 116.019 -0.537 . . . . 41.37 112.09 -170.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -102.71 -12.17 17.86 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.119 0.485 . . . . 51.32 111.754 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -103.22 163.34 15.81 Favored Glycine 0 C--O 1.236 0.245 0 C-N-CA 121.022 -0.608 . . . . 38.97 113.682 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.9 mt -114.13 137.23 52.01 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.094 0.473 . . . . 30.57 111.12 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.36 145.47 19.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.784 -0.644 . . . . 36.64 109.346 -174.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . 0.558 HG23 HG22 ' A' ' 26' ' ' ILE . 18.4 pt -90.74 145.06 7.88 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.408 0.623 . . . . 32.07 111.703 -172.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.5 p -79.18 168.62 19.35 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.919 -1.037 . . . . 40.12 109.325 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.82 -43.03 94.84 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 120.529 -0.843 . . . . 37.18 113.378 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.87 -54.05 13.77 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 117.713 0.756 . . . . 58.49 111.317 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.52 -39.93 74.18 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.663 1.357 . . . . 38.08 114.663 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -75.3 -13.53 60.43 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.35 0.87 . . . . 50.48 113.35 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -75.31 -43.95 48.15 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.316 -0.553 . . . . 52.3 110.539 171.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 73.3 mt -58.99 -44.12 90.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.679 -0.691 . . . . 35.18 111.666 174.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mm -63.04 -43.79 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.156 0.582 . . . . 32.04 112.429 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 t -76.06 -38.43 57.1 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.195 0.521 . . . . 33.23 111.395 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -55.51 -57.33 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 34.52 110.061 168.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . 0.455 ' CB ' HD13 ' A' ' 7' ' ' ILE . . . -51.38 -46.92 62.96 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.735 1.383 . . . . 23.89 114.735 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.29 62.96 Favored 'General case' 0 C--O 1.243 0.749 0 O-C-N 121.966 -0.458 . . . . 22.01 112.183 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 93.6 m -72.38 -44.1 63.02 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.216 -0.447 . . . . 26.12 111.465 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.649 HD11 ' HD2' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -47.9 -62.2 1.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.34 1.056 . . . . 34.12 111.736 167.629 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -53.71 -53.37 53.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.579 -0.737 . . . . 39.8 110.74 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.97 -36.66 65.6 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.43 0.9 . . . . 29.2 113.43 -174.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -74.69 -30.18 61.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.748 0.647 . . . . 36.64 112.748 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -79.57 -15.81 57.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 112.88 0.696 . . . . 28.68 112.88 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.11 13.96 10.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.157 0.799 . . . . 38.59 113.157 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.56 -47.46 89.43 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 115.44 1.645 . . . . 30.84 115.44 -165.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -70.29 -21.64 30.75 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 117.994 -0.87 . . . . 39.84 112.943 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -35.27 42.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.527 -0.761 . . . . 65.03 112.009 177.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.0 -34.44 59.72 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 112.76 0.652 . . . . 41.3 112.76 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -4.49 59.18 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.856 2.169 . . . . 38.79 116.856 -165.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 2' ' ' SER . 17.4 mttt . . . . . 0 C--O 1.256 1.439 0 N-CA-C 113.253 0.835 . . . . 58.96 113.253 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' SER . . . . . 0.46 ' OG ' ' HB ' ' B' ' 4' ' ' VAL . 2.0 t . . . . . 0 N--CA 1.501 2.084 0 N-CA-C 116.018 1.859 . . . . 63.8 116.018 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.36 32.44 5.93 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 122.568 1.175 . . . . 55.85 109.456 162.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' VAL . . . . . 0.46 ' HB ' ' OG ' ' B' ' 2' ' ' SER . 1.1 t -71.08 -27.7 30.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 113.572 -1.649 . . . . 36.58 112.4 -170.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' THR . . . . . 0.503 ' HA ' HD12 ' B' ' 8' ' ' ILE . 20.8 p -61.91 -19.98 63.29 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 121.513 -0.742 . . . . 37.97 112.997 -179.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TYR . . . . . 0.405 ' CE2' ' HD1' ' B' ' 86' ' ' TYR . 65.2 m-85 -68.83 -30.78 69.4 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.835 -0.346 . . . . 31.12 111.809 173.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 6.5 mt -69.17 -40.63 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.867 -0.79 . . . . 29.42 108.867 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' B' ' 5' ' ' THR . 79.7 mt -60.58 -45.74 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.469 -0.787 . . . . 29.18 112.462 176.24 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.45 -54.97 39.12 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 122.365 -0.209 . . . . 47.81 111.517 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.1 -34.4 60.13 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.122 -0.49 . . . . 23.09 111.621 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 51.9 p -81.0 10.71 4.76 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.185 0.809 . . . . 27.47 113.185 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 57.5 t30 52.16 42.8 30.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.353 0.661 . . . . 34.81 111.893 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 62.5 17.03 9.21 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 116.16 1.911 . . . . 40.67 116.16 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 2.7 m -90.32 2.28 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.177 0.806 . . . . 38.26 113.177 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' B' ' 101' ' ' HOH . 36.1 mt -115.54 151.53 34.7 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.398 -0.593 . . . . 34.73 109.398 170.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.97 -171.57 1.91 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 112.853 0.686 . . . . 36.47 112.853 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.03 -29.68 70.45 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 118.754 -1.179 . . . . 61.95 112.353 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LYS . . . . . 0.415 ' HE2' ' HB2' ' B' ' 18' ' ' LYS . 3.6 mppt? -85.17 -51.48 6.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 116.966 2.21 . . . . 64.68 116.966 -173.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 8.1 p -57.89 -31.34 66.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.628 0.252 . . . . 33.34 111.642 172.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.68 -41.0 63.26 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.428 -0.351 . . . . 30.07 111.061 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -57.06 -50.23 73.4 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.439 -0.346 . . . . 31.3 111.226 170.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' B' ' 52' ' ' ASN . 5.4 mt -62.23 -38.73 81.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.096 -0.502 . . . . 23.72 111.282 -179.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -45.71 87.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 30.19 111.579 174.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' B' ' 24' ' ' ILE . 4.7 mm -60.32 -44.49 95.95 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.601 -0.272 . . . . 25.09 111.461 178.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 60.1 m -57.59 -39.44 76.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.725 -0.39 . . . . 22.09 111.127 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 42.9 mt -77.61 -34.66 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.082 0.468 . . . . 19.68 111.907 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.41 -27.64 68.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.956 -0.565 . . . . 20.27 111.363 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . 0.416 ' HD3' ' NZ ' ' A' ' 96' ' ' LYS . 3.5 mtmt -73.37 -23.06 60.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.206 1.558 . . . . 45.9 115.206 176.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -142.73 101.51 3.87 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.505 -0.478 . . . . 36.86 111.742 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -53.93 130.58 37.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.842 -0.617 . . . . 26.85 111.912 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 73.8 12.6 4.4 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.988 0.736 . . . . 18.27 112.988 174.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 15.6 tt -56.94 141.06 14.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.457 0.646 . . . . 18.04 110.188 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' THR . . . . . 0.477 ' OG1' ' HG3' ' B' ' 36' ' ' GLU . 31.9 p -86.16 160.36 19.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.959 -0.696 . . . . 19.54 110.572 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.6 -34.85 73.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.498 -0.319 . . . . 21.15 111.05 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.08 77.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.009 0.744 . . . . 22.69 113.009 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' OG1' ' B' ' 33' ' ' THR . 40.5 mt-10 -69.21 -43.55 73.89 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.636 0.976 . . . . 40.64 113.636 174.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.28 -51.57 46.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.06 0.393 . . . . 23.18 112.06 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' B' ' 50' ' ' ASN . 83.4 mtm-85 -60.65 -31.46 70.68 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.773 0.321 . . . . 33.2 111.325 176.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.13 -45.73 83.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 56.14 111.159 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 m -81.78 3.16 2.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 114.38 1.252 . . . . 43.72 114.38 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -130.72 59.54 46.62 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 114.305 1.224 . . . . 35.33 114.305 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -66.78 -23.15 48.61 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.699 1.599 . . . . 34.57 113.919 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -73.45 -18.1 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.687 0.625 . . . . 42.54 112.687 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 58.0 mt -89.33 -40.07 13.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.055 0.761 . . . . 34.47 113.055 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.14 155.7 32.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 121.427 -0.416 . . . . 29.88 113.73 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -58.3 -52.21 66.54 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 117.127 0.464 . . . . 31.56 110.77 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.01 -48.5 64.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.951 -0.568 . . . . 23.5 112.489 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.1 t -72.24 -40.75 66.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.88 -0.328 . . . . 25.02 111.532 -175.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' VAL . . . . . 0.429 HG11 ' HG2' ' B' ' 38' ' ' ARG . 53.5 t -61.89 -48.48 88.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.264 -0.574 . . . . 19.75 111.866 176.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ASN . . . . . 0.508 ' OD1' ' HD3' ' B' ' 38' ' ' ARG . 93.2 m-20 -59.55 -43.71 93.46 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.994 -0.548 . . . . 22.08 110.875 178.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 19.5 t -58.62 -47.98 82.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.352 -0.84 . . . . 19.03 112.238 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASN . . . . . 0.478 ' HB2' HD13 ' B' ' 22' ' ' ILE . 75.6 m-20 -71.84 -35.18 69.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.287 -0.87 . . . . 27.58 111.485 -175.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 57.7 mt -57.44 -43.92 83.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.303 . . . . 18.52 110.502 169.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.61 -38.73 95.48 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.802 -0.635 . . . . 19.04 113.492 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.9 t -62.9 -46.07 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.183 0.593 . . . . 19.09 111.015 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.88 -40.2 95.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.455 -0.339 . . . . 21.77 111.701 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 39.2 mt -61.8 -49.19 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.622 -0.263 . . . . 19.68 111.067 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -24.33 67.24 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.94 0.718 . . . . 41.67 112.94 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -86.01 -9.02 57.53 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.467 0.914 . . . . 48.07 113.467 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . 77.92 18.75 76.46 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.609 -0.805 . . . . 21.32 113.581 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 48.3 mt -88.29 -30.28 19.75 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.354 0.597 . . . . 21.17 111.134 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 71.7 t -129.11 155.18 40.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.539 -1.282 . . . . 20.16 107.539 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -133.43 128.94 36.57 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.682 -1.229 . . . . 49.06 107.682 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 64' ' ' LYS . 2.1 tppm? -66.05 127.68 33.07 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.673 -0.862 . . . . 41.17 108.673 167.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -136.29 97.12 3.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.752 -1.203 . . . . 21.81 107.752 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.17 -129.03 12.16 Favored Glycine 0 C--O 1.22 -0.756 0 C-N-CA 120.381 -0.914 . . . . 17.38 113.119 -172.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 39.5 p-10 -90.4 9.4 29.16 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.181 0.515 . . . . 30.23 111.823 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -136.86 -173.13 12.78 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 119.954 -1.117 . . . . 18.95 113.892 -169.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 23.7 mt -128.49 138.11 52.12 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.463 -0.569 . . . . 19.1 109.463 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 9.5 tt -137.83 142.16 36.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.15 -0.477 . . . . 29.1 110.981 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 4.4 pt -77.34 154.22 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 C-N-CA 120.245 -0.582 . . . . 22.23 110.392 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 66.9 p -92.8 177.71 6.01 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 121.231 0.539 . . . . 24.11 111.284 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.0 -36.39 93.4 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.214 -0.994 . . . . 24.44 113.201 172.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -59.3 -40.95 87.81 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 122.375 -0.486 . . . . 46.3 111.796 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . 0.555 ' O ' HG13 ' B' ' 79' ' ' ILE . . . -71.55 -28.32 63.77 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.802 1.038 . . . . 22.25 113.802 177.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLN . . . . . 0.571 ' HA ' ' OE1' ' B' ' 76' ' ' GLN . 0.0 OUTLIER -65.13 -42.61 93.72 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.039 -0.413 . . . . 64.36 110.688 175.738 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -55.12 -57.01 13.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.349 1.06 . . . . 34.1 113.57 171.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ILE . . . . . . . . . . . . . 62.9 mt -51.31 -43.62 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.968 -0.56 . . . . 23.26 111.449 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . 0.555 HG13 ' O ' ' B' ' 75' ' ' ALA . 13.7 mt -74.2 -31.13 28.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 113.381 0.882 . . . . 27.54 113.381 -176.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.6 p -74.18 -39.25 63.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.322 -0.551 . . . . 36.49 110.889 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -58.96 -41.93 88.68 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.633 0.605 . . . . 41.07 112.633 172.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.85 -46.65 88.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.841 0.682 . . . . 25.06 112.841 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -43.58 98.52 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 116.025 -0.534 . . . . 24.21 111.34 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 83.1 m -62.1 -46.91 86.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.844 1.053 . . . . 29.87 113.844 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 16.9 mt -54.1 -50.06 67.7 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.163 0.506 . . . . 25.35 111.022 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' TYR . . . . . 0.489 ' CE2' HD21 ' B' ' 94' ' ' LEU . 83.3 t80 -61.95 -40.34 95.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.701 -0.681 . . . . 37.25 111.022 -177.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.61 -43.98 75.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 25.04 110.218 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -59.43 -28.37 66.88 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 113.282 0.845 . . . . 25.81 113.282 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.82 -26.32 22.88 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 114.532 1.308 . . . . 30.54 114.532 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -131.48 36.81 3.74 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.819 1.044 . . . . 33.97 113.819 -177.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.24 -58.39 8.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 116.708 2.114 . . . . 29.46 116.708 -167.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.02 -20.07 34.07 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 117.603 -1.131 . . . . 31.5 113.833 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -27.31 60.32 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.787 0.662 . . . . 52.92 112.787 175.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LEU . . . . . 0.489 HD21 ' CE2' ' B' ' 86' ' ' TYR . 7.4 mt -70.27 -39.05 75.16 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.695 0.998 . . . . 32.56 113.695 173.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LEU . . . . . 0.851 HD13 HD11 ' A' ' 7' ' ' ILE . 91.1 mt -83.82 -6.85 59.52 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.373 0.879 . . . . 26.94 113.373 -171.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LYS . . . . . 0.455 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.765 -1.112 . . . . 44.45 111.407 -172.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . 0.674 ' O ' ' HB ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' A' ' 29' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . 0.469 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . 0.406 ' O ' ' HA ' ' B' ' 15' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 121.076 0.465 . . . . 31.03 111.563 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 58.09 4.65 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.778 1.029 . . . . 26.47 113.778 -164.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -69.44 -22.77 25.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 114.703 1.372 . . . . 28.43 114.703 -167.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 m -63.69 -40.17 96.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.09 0.471 . . . . 31.49 111.854 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -64.01 -39.66 94.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.914 -0.585 . . . . 32.01 111.576 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.851 HD11 HD13 ' B' ' 95' ' ' LEU . 37.8 mm -66.23 -51.6 57.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.692 -0.403 . . . . 34.02 111.227 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -55.02 -32.33 26.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 28.07 110.546 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' HD2' HD11 ' A' ' 85' ' ' LEU . 10.5 tmtt? -71.1 -57.83 4.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.648 -0.705 . . . . 53.45 112.299 179.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 134' ' ' HOH . . . -58.8 -20.36 49.42 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.604 0.594 . . . . 38.08 112.604 177.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 14' ' ' VAL . 1.1 p -87.7 6.7 33.61 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.041 0.756 . . . . 43.26 113.041 179.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 49.84 34.93 8.35 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.899 0.703 . . . . 56.62 112.899 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 66.75 28.23 9.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.701 1.371 . . . . 51.66 114.701 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 11' ' ' SER . 30.9 m -80.79 -28.61 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 N-CA-C 109.153 -0.684 . . . . 40.71 109.153 167.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.402 ' HB3' HG23 ' A' ' 19' ' ' THR . 38.0 mt -94.22 139.79 30.58 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.443 -0.798 . . . . 40.98 112.702 -178.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.451 ' H ' HG22 ' A' ' 19' ' ' THR . 32.3 p30 -100.57 -172.55 2.22 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.846 -0.742 . . . . 39.0 111.715 168.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 3.5 mp0 -65.84 -20.99 66.44 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.141 0.496 . . . . 54.72 110.782 -172.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -91.07 -46.81 7.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.46 -0.791 . . . . 39.86 111.876 -173.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 116' ' ' HOH . 12.6 t -68.46 -25.49 65.02 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.647 0.737 . . . . 40.45 111.668 177.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 24' ' ' ILE . . . -73.27 -45.07 57.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.985 -1.007 . . . . 26.83 112.888 176.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.1 t -69.32 -34.56 74.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.48 0.548 . . . . 23.41 112.48 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.0 mt -68.83 -36.39 73.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.316 -0.553 . . . . 25.36 111.025 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.5 tp -58.72 -40.62 84.27 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.826 1.417 . . . . 31.75 114.826 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.602 HD11 HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER -65.44 -43.34 94.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.107 -0.637 . . . . 33.4 110.9 -179.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . 0.469 ' OG1' ' HE1' ' A' ' 41' ' ' HIS . 24.9 m -57.53 -44.17 84.91 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.571 . . . . 22.67 112.149 -178.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.558 HG22 HG23 ' A' ' 71' ' ' ILE . 26.7 mt -69.76 -36.78 71.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.683 -0.69 . . . . 25.73 111.563 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.55 71.27 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.548 0.689 . . . . 25.35 111.609 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HD2' ' HG3' ' B' ' 96' ' ' LYS . 0.0 OUTLIER -83.6 -21.85 32.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.42 -1.264 . . . . 36.73 112.851 -171.021 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' A' ' 130' ' ' HOH . 6.2 tttt -143.68 105.32 4.31 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.25 -0.58 . . . . 39.41 109.594 -177.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -58.52 134.96 57.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.22 -0.9 . . . . 35.69 112.288 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 69.46 17.13 8.11 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.611 0.597 . . . . 38.2 112.611 176.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.01 152.09 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 120.574 -0.45 . . . . 28.21 109.991 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.6 p -101.38 166.86 10.52 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.962 -1.086 . . . . 24.71 111.862 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.99 -35.63 79.09 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.47 0.308 . . . . 24.59 110.609 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.99 -33.38 75.46 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.306 0.484 . . . . 20.6 112.306 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -80.5 -31.88 37.08 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.617 1.34 . . . . 38.16 114.617 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.5 t -58.83 -37.72 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 119.937 -0.705 . . . . 25.03 111.202 169.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 88.9 mtm-85 -67.87 -35.92 79.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.156 0.428 . . . . 28.5 112.156 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.56 -27.85 56.05 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.642 0.978 . . . . 42.62 113.642 -173.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 18.5 m -88.19 2.54 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 113.202 0.816 . . . . 26.67 113.202 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.469 ' HE1' ' OG1' ' A' ' 25' ' ' THR . 57.7 m80 -127.12 66.01 66.38 Favored Pre-proline 0 C--O 1.221 -0.422 0 O-C-N 121.999 -0.438 . . . . 24.51 110.288 171.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.26 -34.43 93.63 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 120.86 1.04 . . . . 36.46 111.081 177.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -28.46 3.57 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.223 -0.899 . . . . 56.37 113.423 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.7 mt -109.04 153.42 23.66 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.576 0.954 . . . . 45.74 113.576 -171.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.45 145.48 49.58 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.263 -0.97 . . . . 45.18 112.857 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -62.52 -37.62 86.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.95 -0.7 . . . . 55.97 111.443 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.06 -18.77 45.53 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.759 0.79 . . . . 46.73 112.029 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.5 -46.46 83.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 119.444 -0.902 . . . . 42.38 111.083 170.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 53' ' ' ILE . 46.8 t -59.4 -44.03 91.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 112.023 0.379 . . . . 37.25 112.023 177.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.45 -42.92 99.51 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.594 0.961 . . . . 40.02 113.594 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.2 m -58.43 -51.21 70.79 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.404 0.621 . . . . 44.13 111.181 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -73.63 -24.7 60.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.713 -0.676 . . . . 42.7 112.544 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 49' ' ' VAL . 42.9 mt -65.32 -40.58 88.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 109.602 -0.518 . . . . 30.53 109.602 167.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -66.91 -38.16 92.69 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 121.131 -0.557 . . . . 36.49 112.863 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.43 -27.79 43.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 111.947 0.351 . . . . 35.11 111.947 173.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.38 -28.39 34.4 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 112.962 0.727 . . . . 37.67 112.962 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 62' ' ' VAL . 15.5 mt -76.77 -32.51 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.978 0.732 . . . . 45.8 112.978 173.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -75.95 -4.34 40.49 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.185 0.809 . . . . 61.14 113.185 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -109.06 -12.85 14.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.087 1.143 . . . . 62.96 114.087 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 91.26 25.86 22.8 Favored Glycine 0 CA--C 1.501 -0.783 0 N-CA-C 109.149 -1.58 . . . . 48.18 109.149 173.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 78.1 mt -103.8 -36.48 7.82 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-O 121.68 0.752 . . . . 46.14 110.766 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 57' ' ' ILE . 58.4 t -125.31 149.78 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 114.031 -1.44 . . . . 48.37 111.539 172.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -134.94 151.96 51.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.005 -1.109 . . . . 53.86 108.005 171.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -87.66 132.5 34.08 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.795 0.665 . . . . 60.17 112.795 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.1 t -110.62 97.89 7.21 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.041 -0.527 . . . . 49.63 110.335 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.74 -103.33 0.49 Allowed Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 116.019 -0.537 . . . . 41.37 112.09 -170.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -102.71 -12.17 17.86 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.119 0.485 . . . . 51.32 111.754 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -103.22 163.34 15.81 Favored Glycine 0 C--O 1.236 0.245 0 C-N-CA 121.022 -0.608 . . . . 38.97 113.682 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.9 mt -114.13 137.23 52.01 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.094 0.473 . . . . 30.57 111.12 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.36 145.47 19.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.784 -0.644 . . . . 36.64 109.346 -174.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.558 HG23 HG22 ' A' ' 26' ' ' ILE . 18.4 pt -90.74 145.06 7.88 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.408 0.623 . . . . 32.07 111.703 -172.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.5 p -79.18 168.62 19.35 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.919 -1.037 . . . . 40.12 109.325 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.82 -43.03 94.84 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 120.529 -0.843 . . . . 37.18 113.378 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.87 -54.05 13.77 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 117.713 0.756 . . . . 58.49 111.317 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.52 -39.93 74.18 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.663 1.357 . . . . 38.08 114.663 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -75.3 -13.53 60.43 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.35 0.87 . . . . 50.48 113.35 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -75.31 -43.95 48.15 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.316 -0.553 . . . . 52.3 110.539 171.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 73.3 mt -58.99 -44.12 90.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.679 -0.691 . . . . 35.18 111.666 174.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mm -63.04 -43.79 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.156 0.582 . . . . 32.04 112.429 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 t -76.06 -38.43 57.1 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.195 0.521 . . . . 33.23 111.395 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -55.51 -57.33 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 34.52 110.061 168.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.455 ' CB ' HD13 ' A' ' 7' ' ' ILE . . . -51.38 -46.92 62.96 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.735 1.383 . . . . 23.89 114.735 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.29 62.96 Favored 'General case' 0 C--O 1.243 0.749 0 O-C-N 121.966 -0.458 . . . . 22.01 112.183 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 93.6 m -72.38 -44.1 63.02 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.216 -0.447 . . . . 26.12 111.465 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.649 HD11 ' HD2' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -47.9 -62.2 1.58 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.34 1.056 . . . . 34.12 111.736 167.629 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -53.71 -53.37 53.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.579 -0.737 . . . . 39.8 110.74 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.97 -36.66 65.6 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.43 0.9 . . . . 29.2 113.43 -174.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -74.69 -30.18 61.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.748 0.647 . . . . 36.64 112.748 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -79.57 -15.81 57.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 112.88 0.696 . . . . 28.68 112.88 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.11 13.96 10.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.157 0.799 . . . . 38.59 113.157 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.56 -47.46 89.43 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 115.44 1.645 . . . . 30.84 115.44 -165.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -70.29 -21.64 30.75 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 117.994 -0.87 . . . . 39.84 112.943 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -35.27 42.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.527 -0.761 . . . . 65.03 112.009 177.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.0 -34.44 59.72 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 112.76 0.652 . . . . 41.3 112.76 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -4.49 59.18 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.856 2.169 . . . . 38.79 116.856 -165.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 2' ' ' SER . 17.4 mttt . . . . . 0 C--O 1.256 1.439 0 N-CA-C 113.253 0.835 . . . . 58.96 113.253 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' SER . . . . . 0.46 ' OG ' ' HB ' ' B' ' 4' ' ' VAL . 2.0 t . . . . . 0 N--CA 1.501 2.084 0 N-CA-C 116.018 1.859 . . . . 63.8 116.018 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.36 32.44 5.93 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 122.568 1.175 . . . . 55.85 109.456 162.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.46 ' HB ' ' OG ' ' B' ' 2' ' ' SER . 1.1 t -71.08 -27.7 30.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 113.572 -1.649 . . . . 36.58 112.4 -170.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' THR . . . . . 0.503 ' HA ' HD12 ' B' ' 8' ' ' ILE . 20.8 p -61.91 -19.98 63.29 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 121.513 -0.742 . . . . 37.97 112.997 -179.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TYR . . . . . 0.405 ' CE2' ' HD1' ' B' ' 86' ' ' TYR . 65.2 m-85 -68.83 -30.78 69.4 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.835 -0.346 . . . . 31.12 111.809 173.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 6.5 mt -69.17 -40.63 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.867 -0.79 . . . . 29.42 108.867 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' B' ' 5' ' ' THR . 79.7 mt -60.58 -45.74 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.469 -0.787 . . . . 29.18 112.462 176.24 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.45 -54.97 39.12 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 122.365 -0.209 . . . . 47.81 111.517 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.1 -34.4 60.13 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.122 -0.49 . . . . 23.09 111.621 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 51.9 p -81.0 10.71 4.76 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.185 0.809 . . . . 27.47 113.185 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 52.16 42.8 30.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.353 0.661 . . . . 34.81 111.893 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 62.5 17.03 9.21 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 116.16 1.911 . . . . 40.67 116.16 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 2.7 m -90.32 2.28 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.177 0.806 . . . . 38.26 113.177 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' B' ' 101' ' ' HOH . 36.1 mt -115.54 151.53 34.7 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.398 -0.593 . . . . 34.73 109.398 170.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.97 -171.57 1.91 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 112.853 0.686 . . . . 36.47 112.853 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.03 -29.68 70.45 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 118.754 -1.179 . . . . 61.95 112.353 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.415 ' HE2' ' HB2' ' B' ' 18' ' ' LYS . 3.6 mppt? -85.17 -51.48 6.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 116.966 2.21 . . . . 64.68 116.966 -173.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 8.1 p -57.89 -31.34 66.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.628 0.252 . . . . 33.34 111.642 172.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.68 -41.0 63.26 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.428 -0.351 . . . . 30.07 111.061 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -57.06 -50.23 73.4 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.439 -0.346 . . . . 31.3 111.226 170.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' B' ' 52' ' ' ASN . 5.4 mt -62.23 -38.73 81.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.096 -0.502 . . . . 23.72 111.282 -179.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -45.71 87.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 30.19 111.579 174.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' B' ' 24' ' ' ILE . 4.7 mm -60.32 -44.49 95.95 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.601 -0.272 . . . . 25.09 111.461 178.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 60.1 m -57.59 -39.44 76.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.725 -0.39 . . . . 22.09 111.127 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 42.9 mt -77.61 -34.66 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.082 0.468 . . . . 19.68 111.907 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.41 -27.64 68.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.956 -0.565 . . . . 20.27 111.363 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.416 ' HD3' ' NZ ' ' A' ' 96' ' ' LYS . 3.5 mtmt -73.37 -23.06 60.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.206 1.558 . . . . 45.9 115.206 176.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -142.73 101.51 3.87 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.505 -0.478 . . . . 36.86 111.742 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -53.93 130.58 37.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.842 -0.617 . . . . 26.85 111.912 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 73.8 12.6 4.4 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.988 0.736 . . . . 18.27 112.988 174.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 15.6 tt -56.94 141.06 14.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.457 0.646 . . . . 18.04 110.188 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' THR . . . . . 0.477 ' OG1' ' HG3' ' B' ' 36' ' ' GLU . 31.9 p -86.16 160.36 19.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.959 -0.696 . . . . 19.54 110.572 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.6 -34.85 73.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.498 -0.319 . . . . 21.15 111.05 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.08 77.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.009 0.744 . . . . 22.69 113.009 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' OG1' ' B' ' 33' ' ' THR . 40.5 mt-10 -69.21 -43.55 73.89 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.636 0.976 . . . . 40.64 113.636 174.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.28 -51.57 46.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.06 0.393 . . . . 23.18 112.06 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' B' ' 50' ' ' ASN . 83.4 mtm-85 -60.65 -31.46 70.68 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.773 0.321 . . . . 33.2 111.325 176.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.13 -45.73 83.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 56.14 111.159 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 m -81.78 3.16 2.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 114.38 1.252 . . . . 43.72 114.38 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -130.72 59.54 46.62 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 114.305 1.224 . . . . 35.33 114.305 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -66.78 -23.15 48.61 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.699 1.599 . . . . 34.57 113.919 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -73.45 -18.1 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.687 0.625 . . . . 42.54 112.687 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 58.0 mt -89.33 -40.07 13.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.055 0.761 . . . . 34.47 113.055 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.14 155.7 32.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 121.427 -0.416 . . . . 29.88 113.73 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -58.3 -52.21 66.54 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 117.127 0.464 . . . . 31.56 110.77 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.01 -48.5 64.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.951 -0.568 . . . . 23.5 112.489 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.1 t -72.24 -40.75 66.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.88 -0.328 . . . . 25.02 111.532 -175.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.429 HG11 ' HG2' ' B' ' 38' ' ' ARG . 53.5 t -61.89 -48.48 88.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.264 -0.574 . . . . 19.75 111.866 176.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.508 ' OD1' ' HD3' ' B' ' 38' ' ' ARG . 93.2 m-20 -59.55 -43.71 93.46 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.994 -0.548 . . . . 22.08 110.875 178.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 19.5 t -58.62 -47.98 82.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.352 -0.84 . . . . 19.03 112.238 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASN . . . . . 0.478 ' HB2' HD13 ' B' ' 22' ' ' ILE . 75.6 m-20 -71.84 -35.18 69.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.287 -0.87 . . . . 27.58 111.485 -175.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 57.7 mt -57.44 -43.92 83.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.303 . . . . 18.52 110.502 169.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.61 -38.73 95.48 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.802 -0.635 . . . . 19.04 113.492 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.9 t -62.9 -46.07 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.183 0.593 . . . . 19.09 111.015 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.88 -40.2 95.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.455 -0.339 . . . . 21.77 111.701 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 39.2 mt -61.8 -49.19 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.622 -0.263 . . . . 19.68 111.067 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -24.33 67.24 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.94 0.718 . . . . 41.67 112.94 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -86.01 -9.02 57.53 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.467 0.914 . . . . 48.07 113.467 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . 77.92 18.75 76.46 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.609 -0.805 . . . . 21.32 113.581 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 48.3 mt -88.29 -30.28 19.75 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.354 0.597 . . . . 21.17 111.134 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 71.7 t -129.11 155.18 40.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 107.539 -1.282 . . . . 20.16 107.539 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -133.43 128.94 36.57 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.682 -1.229 . . . . 49.06 107.682 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 64' ' ' LYS . 2.1 tppm? -66.05 127.68 33.07 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.673 -0.862 . . . . 41.17 108.673 167.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -136.29 97.12 3.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.752 -1.203 . . . . 21.81 107.752 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.17 -129.03 12.16 Favored Glycine 0 C--O 1.22 -0.756 0 C-N-CA 120.381 -0.914 . . . . 17.38 113.119 -172.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 39.5 p-10 -90.4 9.4 29.16 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.181 0.515 . . . . 30.23 111.823 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -136.86 -173.13 12.78 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 119.954 -1.117 . . . . 18.95 113.892 -169.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 23.7 mt -128.49 138.11 52.12 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.463 -0.569 . . . . 19.1 109.463 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 9.5 tt -137.83 142.16 36.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.15 -0.477 . . . . 29.1 110.981 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 4.4 pt -77.34 154.22 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 C-N-CA 120.245 -0.582 . . . . 22.23 110.392 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 66.9 p -92.8 177.71 6.01 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 121.231 0.539 . . . . 24.11 111.284 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.0 -36.39 93.4 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.214 -0.994 . . . . 24.44 113.201 172.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -59.3 -40.95 87.81 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 122.375 -0.486 . . . . 46.3 111.796 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.555 ' O ' HG13 ' B' ' 79' ' ' ILE . . . -71.55 -28.32 63.77 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.802 1.038 . . . . 22.25 113.802 177.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLN . . . . . 0.571 ' HA ' ' OE1' ' B' ' 76' ' ' GLN . 0.0 OUTLIER -65.13 -42.61 93.72 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.039 -0.413 . . . . 64.36 110.688 175.738 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -55.12 -57.01 13.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.349 1.06 . . . . 34.1 113.57 171.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ILE . . . . . . . . . . . . . 62.9 mt -51.31 -43.62 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.968 -0.56 . . . . 23.26 111.449 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.555 HG13 ' O ' ' B' ' 75' ' ' ALA . 13.7 mt -74.2 -31.13 28.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 113.381 0.882 . . . . 27.54 113.381 -176.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.6 p -74.18 -39.25 63.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.322 -0.551 . . . . 36.49 110.889 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -58.96 -41.93 88.68 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.633 0.605 . . . . 41.07 112.633 172.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.85 -46.65 88.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.841 0.682 . . . . 25.06 112.841 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -43.58 98.52 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 116.025 -0.534 . . . . 24.21 111.34 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 83.1 m -62.1 -46.91 86.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.844 1.053 . . . . 29.87 113.844 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 16.9 mt -54.1 -50.06 67.7 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.163 0.506 . . . . 25.35 111.022 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' TYR . . . . . 0.489 ' CE2' HD21 ' B' ' 94' ' ' LEU . 83.3 t80 -61.95 -40.34 95.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.701 -0.681 . . . . 37.25 111.022 -177.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.61 -43.98 75.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 25.04 110.218 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -59.43 -28.37 66.88 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 113.282 0.845 . . . . 25.81 113.282 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.82 -26.32 22.88 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 114.532 1.308 . . . . 30.54 114.532 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -131.48 36.81 3.74 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.819 1.044 . . . . 33.97 113.819 -177.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.24 -58.39 8.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 116.708 2.114 . . . . 29.46 116.708 -167.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.02 -20.07 34.07 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 117.603 -1.131 . . . . 31.5 113.833 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -27.31 60.32 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.787 0.662 . . . . 52.92 112.787 175.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LEU . . . . . 0.489 HD21 ' CE2' ' B' ' 86' ' ' TYR . 7.4 mt -70.27 -39.05 75.16 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.695 0.998 . . . . 32.56 113.695 173.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.851 HD13 HD11 ' A' ' 7' ' ' ILE . 91.1 mt -83.82 -6.85 59.52 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.373 0.879 . . . . 26.94 113.373 -171.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LYS . . . . . 0.455 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.765 -1.112 . . . . 44.45 111.407 -172.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . 0.674 ' O ' ' HB ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' A' ' 29' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . 0.469 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . 0.406 ' O ' ' HA ' ' B' ' 15' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_