data_3svm_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 3svm _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 ' 56' ' ' GLU . . . . . 0.665 ' O ' ' N ' ' A' ' 58' ' ' VAL . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.864 0.32 . . . . 78.890000000000001 111.864 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.9 t0 51.07 -55.15 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.644 1.178 . . . . 75.829999999999998 113.979 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . 0.665 ' N ' ' O ' ' A' ' 56' ' ' GLU . 25.5 t 81.26 133.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 C-N-CA 125.294 1.437 . . . . 68.319999999999993 108.604 -178.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -134.03 159.99 39.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.584 0.957 . . . . 59.729999999999997 113.584 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -75.61 126.39 30.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.389 -0.823 . . . . 72.959999999999994 109.529 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.4 t -91.9 132.54 36.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.931 0.893 . . . . 50.530000000000001 110.598 -179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -93.24 -49.33 6.02 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.585 -0.524 . . . . 64.719999999999999 109.585 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -173.07 165.41 4.96 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.45 0.907 . . . . 50.509999999999998 113.45 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.94 130.85 42.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 105.526 -2.027 . . . . 41.759999999999998 105.526 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.39 -37.44 13.98 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 112.624 0.601 . . . . 40.920000000000002 112.624 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -165.89 177.32 7.21 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.684 -0.487 . . . . 42.57 109.684 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.5 ptm -139.64 166.36 24.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.981 0.419 . . . . 59.950000000000003 110.05 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -165.63 170.06 14.61 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.406 -0.961 . . . . 41.920000000000002 108.406 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 48.3 p -124.94 136.93 54.21 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 106.179 -1.786 . . . . 48.75 106.179 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -116.64 91.77 3.68 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 103.454 -2.795 . . . . 61.68 103.454 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.73 -99.21 2.5 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 106.452 -2.659 . . . . 66.920000000000002 106.452 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -132.08 4.11 5.28 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 110.179 -1.168 . . . . 65.0 110.179 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -96.45 142.85 28.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.265 -0.468 . . . . 67.0 111.642 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.5 t -93.37 134.29 31.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 53.090000000000003 112.25 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 mp -129.8 148.36 51.67 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.156 -0.474 . . . . 45.240000000000002 110.577 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -125.92 134.04 51.68 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.097 -0.501 . . . . 49.5 112.277 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -86.12 124.71 32.83 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 104.395 -2.446 . . . . 47.490000000000002 104.395 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.8 t -111.18 136.09 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 N-CA-C 115.779 1.77 . . . . 35.600000000000001 115.779 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -101.55 115.51 30.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 102.392 -3.188 . . . . 41.890000000000001 102.392 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -85.92 133.54 33.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.651 0.594 . . . . 40.670000000000002 111.052 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.79 128.86 39.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.963 -0.695 . . . . 58.82 111.131 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 -3.24 85.18 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.735 -0.745 . . . . 48.219999999999999 113.935 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -114.57 156.88 23.85 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.819 -0.437 . . . . 46.030000000000001 109.819 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 34.2 p -86.97 174.12 8.9 Favored 'General case' 0 C--O 1.227 -0.107 0 N-CA-C 108.171 -1.048 . . . . 45.149999999999999 108.171 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 85.0 p -65.05 -13.33 57.66 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.945 1.091 . . . . 44.600000000000001 113.945 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -72.02 -6.21 40.57 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.662 -0.496 . . . . 52.590000000000003 109.662 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.36 12.97 15.44 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 113.325 0.861 . . . . 52.270000000000003 113.325 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -70.59 138.15 50.62 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.07 -1.456 . . . . 41.600000000000001 107.07 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 46.7 p -133.39 151.17 51.81 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.866 0.691 . . . . 37.270000000000003 112.866 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -87.89 125.82 34.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 105.557 -2.016 . . . . 38.719999999999999 105.557 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -120.76 146.98 44.83 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-N 115.719 -0.673 . . . . 48.740000000000002 112.69 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.12 143.9 55.57 Favored 'Trans proline' 0 C--N 1.343 0.258 0 N-CA-C 108.171 -1.511 . . . . 47.700000000000003 108.171 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -43.57 -47.16 7.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.526 2.047 . . . . 63.469999999999999 116.526 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.0 pt -51.84 -23.56 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 114.87 1.433 . . . . 59.189999999999998 114.87 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -73.04 -14.16 61.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 114.635 1.346 . . . . 63.469999999999999 114.635 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.24 -4.67 9.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 115.709 1.744 . . . . 66.700000000000003 115.709 -178.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -49.47 -28.57 5.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.91 1.818 . . . . 83.170000000000002 115.91 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -95.6 11.03 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.186 -0.605 . . . . 70.189999999999998 112.534 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 87.5 m -110.44 62.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 106.382 -1.711 . . . . 66.790000000000006 106.382 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -64.4 -29.11 70.18 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 117.173 2.286 . . . . 75.189999999999998 117.173 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.71 -43.18 97.33 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 106.547 -1.649 . . . . 80.159999999999997 106.547 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 91.7 t -68.58 -44.11 83.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 114.84 -1.073 . . . . 57.119999999999997 112.682 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.45 -37.55 87.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.142 0.496 . . . . 51.43 111.062 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.31 -43.67 77.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.116 -0.493 . . . . 61.689999999999998 111.398 -179.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -64.55 -26.54 68.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.225 -0.443 . . . . 69.959999999999994 111.992 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -79.93 -36.95 35.57 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.566 -0.531 . . . . 50.549999999999997 109.566 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -62.81 -39.32 93.92 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.238 0.542 . . . . 78.879999999999995 109.767 179.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -67.04 -55.05 16.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.734 -0.666 . . . . 68.260000000000005 110.277 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -49.33 -33.07 12.47 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.645 0.609 . . . . 67.150000000000006 112.645 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 tt -85.94 -28.61 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 119.813 -0.755 . . . . 71.400000000000006 111.9 -178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.83 -41.55 71.38 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.723 -0.391 . . . . 73.230000000000004 110.26 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.82 1.65 16.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.182 0.808 . . . . 80.959999999999994 113.182 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -113.71 -17.65 12.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 85.790000000000006 111.123 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.63 103.83 0.07 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.772 0.656 . . . . 94.920000000000002 112.772 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.052 -0.975 . . . . 93.060000000000002 110.699 179.867 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 39' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 110.659 -0.126 . . . . 86.900000000000006 110.659 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 40' ' ' GLU . . . . . . . . . . . . . . . -110.13 157.82 36.86 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.048 0.388 . . . . 85.019999999999996 112.048 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 41' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -52.46 168.93 0.36 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.256 3.304 . . . . 81.560000000000002 113.789 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 42' ' ' SER . . . . . 0.427 ' O ' ' CG2' ' P' ' 43' ' ' THR . 24.9 p -55.22 -47.21 75.66 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 114.647 1.351 . . . . 77.730000000000004 114.647 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' P' P ' 43' ' ' THR . . . . . 0.427 ' CG2' ' O ' ' P' ' 42' ' ' SER . 0.7 OUTLIER 72.35 -12.11 0.74 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.242 0.83 . . . . 70.530000000000001 113.242 179.592 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' P' P ' 44' ' ' THR . . . . . . . . . . . . . 66.7 p -120.96 161.98 20.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.964 0.412 . . . . 63.119999999999997 110.134 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 45' ' ' ALA . . . . . . . . . . . . . . . -156.11 153.85 29.98 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.747 -1.205 . . . . 62.159999999999997 107.747 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 46' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -80.52 153.85 27.88 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.699 -1.222 . . . . 76.640000000000001 107.699 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 47' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 CA-C-N 115.44 -0.8 . . . . 61.780000000000001 110.7 -178.966 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 48' ' ' VAL . . . . . . . . . . . . . 10.6 p -91.02 -25.35 5.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.96 -0.756 . . . . 67.420000000000002 108.96 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 49' ' ' GLY . . . . . . . . . . . . . . . -62.37 -31.34 79.07 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.342 -0.845 . . . . 78.609999999999999 112.167 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.851 -1.071 . . . . 83.090000000000003 113.848 179.574 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.665 ' O ' ' N ' ' A' ' 58' ' ' VAL . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.864 0.32 . . . . 78.890000000000001 111.864 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . 0.508 ' O ' ' HB ' ' A' ' 58' ' ' VAL . 47.9 t0 51.07 -55.15 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.644 1.178 . . . . 75.829999999999998 113.979 178.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . 0.665 ' N ' ' O ' ' A' ' 56' ' ' GLU . 25.5 t 81.26 133.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 C-N-CA 125.294 1.437 . . . . 68.319999999999993 108.604 -178.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -134.03 159.99 39.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.584 0.957 . . . . 59.729999999999997 113.584 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -75.61 126.39 30.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.389 -0.823 . . . . 72.959999999999994 109.529 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.4 t -91.9 132.54 36.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.931 0.893 . . . . 50.530000000000001 110.598 -179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -93.24 -49.33 6.02 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.585 -0.524 . . . . 64.719999999999999 109.585 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -173.07 165.41 4.96 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.45 0.907 . . . . 50.509999999999998 113.45 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.94 130.85 42.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 105.526 -2.027 . . . . 41.759999999999998 105.526 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.39 -37.44 13.98 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 112.624 0.601 . . . . 40.920000000000002 112.624 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -165.89 177.32 7.21 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.684 -0.487 . . . . 42.57 109.684 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.5 ptm -139.64 166.36 24.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.981 0.419 . . . . 59.950000000000003 110.05 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -165.63 170.06 14.61 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.406 -0.961 . . . . 41.920000000000002 108.406 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 48.3 p -124.94 136.93 54.21 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 106.179 -1.786 . . . . 48.75 106.179 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . 0.469 ' HG3' HD13 ' A' ' 75' ' ' LEU . 5.1 mt-10 -116.64 91.77 3.68 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 103.454 -2.795 . . . . 61.68 103.454 177.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.73 -99.21 2.5 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 106.452 -2.659 . . . . 66.920000000000002 106.452 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -132.08 4.11 5.28 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 110.179 -1.168 . . . . 65.0 110.179 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -96.45 142.85 28.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.265 -0.468 . . . . 67.0 111.642 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.5 t -93.37 134.29 31.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 53.090000000000003 112.25 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.469 HD13 ' HG3' ' A' ' 70' ' ' GLU . 4.6 mp -129.8 148.36 51.67 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.156 -0.474 . . . . 45.240000000000002 110.577 178.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -125.92 134.04 51.68 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.097 -0.501 . . . . 49.5 112.277 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -86.12 124.71 32.83 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 104.395 -2.446 . . . . 47.490000000000002 104.395 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.8 t -111.18 136.09 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 N-CA-C 115.779 1.77 . . . . 35.600000000000001 115.779 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -101.55 115.51 30.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 102.392 -3.188 . . . . 41.890000000000001 102.392 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -85.92 133.54 33.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.651 0.594 . . . . 40.670000000000002 111.052 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.79 128.86 39.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.963 -0.695 . . . . 58.82 111.131 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 -3.24 85.18 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.735 -0.745 . . . . 48.219999999999999 113.935 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -114.57 156.88 23.85 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.819 -0.437 . . . . 46.030000000000001 109.819 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 34.2 p -86.97 174.12 8.9 Favored 'General case' 0 C--O 1.227 -0.107 0 N-CA-C 108.171 -1.048 . . . . 45.149999999999999 108.171 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 85.0 p -65.05 -13.33 57.66 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.945 1.091 . . . . 44.600000000000001 113.945 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -72.02 -6.21 40.57 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.662 -0.496 . . . . 52.590000000000003 109.662 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.36 12.97 15.44 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 113.325 0.861 . . . . 52.270000000000003 113.325 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -70.59 138.15 50.62 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.07 -1.456 . . . . 41.600000000000001 107.07 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 46.7 p -133.39 151.17 51.81 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.866 0.691 . . . . 37.270000000000003 112.866 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -87.89 125.82 34.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 105.557 -2.016 . . . . 38.719999999999999 105.557 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -120.76 146.98 44.83 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-N 115.719 -0.673 . . . . 48.740000000000002 112.69 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.12 143.9 55.57 Favored 'Trans proline' 0 C--N 1.343 0.258 0 N-CA-C 108.171 -1.511 . . . . 47.700000000000003 108.171 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -43.57 -47.16 7.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.526 2.047 . . . . 63.469999999999999 116.526 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . 0.481 ' HA ' ' HG3' ' A' ' 97' ' ' GLU . 42.0 pt -51.84 -23.56 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 114.87 1.433 . . . . 59.189999999999998 114.87 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -73.04 -14.16 61.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 114.635 1.346 . . . . 63.469999999999999 114.635 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 96' ' ' LEU . 5.2 mp -120.24 -4.67 9.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 115.709 1.744 . . . . 66.700000000000003 115.709 -178.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 94' ' ' ILE . 38.9 mt-10 -49.47 -28.57 5.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.91 1.818 . . . . 83.170000000000002 115.91 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -95.6 11.03 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.186 -0.605 . . . . 70.189999999999998 112.534 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' P' ' 8' ' ' HOH . 87.5 m -110.44 62.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 106.382 -1.711 . . . . 66.790000000000006 106.382 178.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -64.4 -29.11 70.18 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 117.173 2.286 . . . . 75.189999999999998 117.173 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . 0.782 ' HG3' ' HG2' ' P' ' 41' ' ' PRO . 40.5 mt-10 -63.71 -43.18 97.33 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 106.547 -1.649 . . . . 80.159999999999997 106.547 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 91.7 t -68.58 -44.11 83.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 114.84 -1.073 . . . . 57.119999999999997 112.682 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.45 -37.55 87.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.142 0.496 . . . . 51.43 111.062 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . 0.731 ' HG ' ' HE3' ' A' ' 108' ' ' LYS . 41.3 tp -68.31 -43.67 77.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.116 -0.493 . . . . 61.689999999999998 111.398 -179.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -64.55 -26.54 68.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.225 -0.443 . . . . 69.959999999999994 111.992 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -79.93 -36.95 35.57 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.566 -0.531 . . . . 50.549999999999997 109.566 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.46 ' O ' HG22 ' A' ' 110' ' ' ILE . 51.4 ttp85 -62.81 -39.32 93.92 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.238 0.542 . . . . 78.879999999999995 109.767 179.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.731 ' HE3' ' HG ' ' A' ' 104' ' ' LEU . 95.9 mttt -67.04 -55.05 16.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.734 -0.666 . . . . 68.260000000000005 110.277 179.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -49.33 -33.07 12.47 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.645 0.609 . . . . 67.150000000000006 112.645 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 107' ' ' ARG . 15.0 tt -85.94 -28.61 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 119.813 -0.755 . . . . 71.400000000000006 111.9 -178.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.83 -41.55 71.38 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.723 -0.391 . . . . 73.230000000000004 110.26 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.82 1.65 16.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.182 0.808 . . . . 80.959999999999994 113.182 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -113.71 -17.65 12.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 85.790000000000006 111.123 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.63 103.83 0.07 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.772 0.656 . . . . 94.920000000000002 112.772 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.052 -0.975 . . . . 93.060000000000002 110.699 179.867 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 39' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 110.659 -0.126 . . . . 86.900000000000006 110.659 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 40' ' ' GLU . . . . . . . . . . . . . . . -110.13 157.82 36.86 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.048 0.388 . . . . 85.019999999999996 112.048 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 41' ' ' PRO . . . . . 0.782 ' HG2' ' HG3' ' A' ' 101' ' ' GLU . 46.7 Cg_exo -52.46 168.93 0.36 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.256 3.304 . . . . 81.560000000000002 113.789 179.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 42' ' ' SER . . . . . 0.751 ' O ' HG22 ' P' ' 43' ' ' THR . 24.9 p -55.22 -47.21 75.66 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 114.647 1.351 . . . . 77.730000000000004 114.647 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 43' ' ' THR . . . . . 0.751 HG22 ' O ' ' P' ' 42' ' ' SER . 0.7 OUTLIER 72.35 -12.11 0.74 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.242 0.83 . . . . 70.530000000000001 113.242 179.592 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' P' P ' 44' ' ' THR . . . . . . . . . . . . . 66.7 p -120.96 161.98 20.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.964 0.412 . . . . 63.119999999999997 110.134 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 45' ' ' ALA . . . . . . . . . . . . . . . -156.11 153.85 29.98 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.747 -1.205 . . . . 62.159999999999997 107.747 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 46' ' ' ARG . . . . . 0.843 ' HG2' ' O ' ' P' ' 6' ' ' HOH . 11.0 ptt180 -80.52 153.85 27.88 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.699 -1.222 . . . . 76.640000000000001 107.699 179.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 47' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 CA-C-N 115.44 -0.8 . . . . 61.780000000000001 110.7 -178.966 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 48' ' ' VAL . . . . . . . . . . . . . 10.6 p -91.02 -25.35 5.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.96 -0.756 . . . . 67.420000000000002 108.96 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 49' ' ' GLY . . . . . . . . . . . . . . . -62.37 -31.34 79.07 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.342 -0.845 . . . . 78.609999999999999 112.167 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.851 -1.071 . . . . 83.090000000000003 113.848 179.574 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 6' ' ' HOH . . . . . 0.843 ' O ' ' HG2' ' P' ' 46' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 8' ' ' HOH . . . . . 0.485 ' O ' ' HA ' ' A' ' 99' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.665 ' O ' ' N ' ' A' ' 58' ' ' VAL . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.864 0.32 . . . . 78.89 111.864 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.508 ' O ' ' HB ' ' A' ' 58' ' ' VAL . 47.9 t0 51.07 -55.15 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.644 1.178 . . . . 75.83 113.979 178.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.665 ' N ' ' O ' ' A' ' 56' ' ' GLU . 25.5 t 81.26 133.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 C-N-CA 125.294 1.437 . . . . 68.32 108.604 -178.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -134.03 159.99 39.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.584 0.957 . . . . 59.73 113.584 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -75.61 126.39 30.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.389 -0.823 . . . . 72.96 109.529 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.4 t -91.9 132.54 36.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.931 0.893 . . . . 50.53 110.598 -179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -93.24 -49.33 6.02 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.585 -0.524 . . . . 64.72 109.585 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -173.07 165.41 4.96 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.45 0.907 . . . . 50.51 113.45 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.94 130.85 42.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 105.526 -2.027 . . . . 41.76 105.526 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.39 -37.44 13.98 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 112.624 0.601 . . . . 40.92 112.624 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -165.89 177.32 7.21 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.684 -0.487 . . . . 42.57 109.684 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.5 ptm -139.64 166.36 24.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.981 0.419 . . . . 59.95 110.05 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -165.63 170.06 14.61 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.406 -0.961 . . . . 41.92 108.406 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 48.3 p -124.94 136.93 54.21 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 106.179 -1.786 . . . . 48.75 106.179 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.469 ' HG3' HD13 ' A' ' 75' ' ' LEU . 5.1 mt-10 -116.64 91.77 3.68 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 103.454 -2.795 . . . . 61.68 103.454 177.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.73 -99.21 2.5 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 106.452 -2.659 . . . . 66.92 106.452 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -132.08 4.11 5.28 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 110.179 -1.168 . . . . 65.0 110.179 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -96.45 142.85 28.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.265 -0.468 . . . . 67.0 111.642 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.5 t -93.37 134.29 31.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 53.09 112.25 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.469 HD13 ' HG3' ' A' ' 70' ' ' GLU . 4.6 mp -129.8 148.36 51.67 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.156 -0.474 . . . . 45.24 110.577 178.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -125.92 134.04 51.68 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.097 -0.501 . . . . 49.5 112.277 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -86.12 124.71 32.83 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 104.395 -2.446 . . . . 47.49 104.395 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.8 t -111.18 136.09 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 N-CA-C 115.779 1.77 . . . . 35.6 115.779 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -101.55 115.51 30.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 102.392 -3.188 . . . . 41.89 102.392 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -85.92 133.54 33.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.651 0.594 . . . . 40.67 111.052 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.79 128.86 39.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.963 -0.695 . . . . 58.82 111.131 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 -3.24 85.18 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.735 -0.745 . . . . 48.22 113.935 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -114.57 156.88 23.85 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.819 -0.437 . . . . 46.03 109.819 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 34.2 p -86.97 174.12 8.9 Favored 'General case' 0 C--O 1.227 -0.107 0 N-CA-C 108.171 -1.048 . . . . 45.15 108.171 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 85.0 p -65.05 -13.33 57.66 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.945 1.091 . . . . 44.6 113.945 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -72.02 -6.21 40.57 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.662 -0.496 . . . . 52.59 109.662 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.36 12.97 15.44 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 113.325 0.861 . . . . 52.27 113.325 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -70.59 138.15 50.62 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.07 -1.456 . . . . 41.6 107.07 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 46.7 p -133.39 151.17 51.81 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.866 0.691 . . . . 37.27 112.866 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -87.89 125.82 34.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 105.557 -2.016 . . . . 38.72 105.557 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -120.76 146.98 44.83 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-N 115.719 -0.673 . . . . 48.74 112.69 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.12 143.9 55.57 Favored 'Trans proline' 0 C--N 1.343 0.258 0 N-CA-C 108.171 -1.511 . . . . 47.7 108.171 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -43.57 -47.16 7.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.526 2.047 . . . . 63.47 116.526 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.481 ' HA ' ' HG3' ' A' ' 97' ' ' GLU . 42.0 pt -51.84 -23.56 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 114.87 1.433 . . . . 59.19 114.87 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -73.04 -14.16 61.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 114.635 1.346 . . . . 63.47 114.635 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 96' ' ' LEU . 5.2 mp -120.24 -4.67 9.96 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 115.709 1.744 . . . . 66.7 115.709 -178.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 94' ' ' ILE . 38.9 mt-10 -49.47 -28.57 5.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.91 1.818 . . . . 83.17 115.91 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -95.6 11.03 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.186 -0.605 . . . . 70.19 112.534 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' P' ' 8' ' ' HOH . 87.5 m -110.44 62.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 106.382 -1.711 . . . . 66.79 106.382 178.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -64.4 -29.11 70.18 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 117.173 2.286 . . . . 75.19 117.173 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.782 ' HG3' ' HG2' ' P' ' 41' ' ' PRO . 40.5 mt-10 -63.71 -43.18 97.33 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 106.547 -1.649 . . . . 80.16 106.547 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 91.7 t -68.58 -44.11 83.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 114.84 -1.073 . . . . 57.12 112.682 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.45 -37.55 87.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.142 0.496 . . . . 51.43 111.062 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.731 ' HG ' ' HE3' ' A' ' 108' ' ' LYS . 41.3 tp -68.31 -43.67 77.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.116 -0.493 . . . . 61.69 111.398 -179.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -64.55 -26.54 68.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.225 -0.443 . . . . 69.96 111.992 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -79.93 -36.95 35.57 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.566 -0.531 . . . . 50.55 109.566 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.46 ' O ' HG22 ' A' ' 110' ' ' ILE . 51.4 ttp85 -62.81 -39.32 93.92 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.238 0.542 . . . . 78.88 109.767 179.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.731 ' HE3' ' HG ' ' A' ' 104' ' ' LEU . 95.9 mttt -67.04 -55.05 16.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.734 -0.666 . . . . 68.26 110.277 179.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -49.33 -33.07 12.47 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.645 0.609 . . . . 67.15 112.645 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 107' ' ' ARG . 15.0 tt -85.94 -28.61 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 119.813 -0.755 . . . . 71.4 111.9 -178.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.83 -41.55 71.38 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.723 -0.391 . . . . 73.23 110.26 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.82 1.65 16.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.182 0.808 . . . . 80.96 113.182 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -113.71 -17.65 12.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 85.79 111.123 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.63 103.83 0.07 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.772 0.656 . . . . 94.92 112.772 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.052 -0.975 . . . . 93.06 110.699 179.867 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 39' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 110.659 -0.126 . . . . 86.9 110.659 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 40' ' ' GLU . . . . . . . . . . . . . . . -110.13 157.82 36.86 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.048 0.388 . . . . 85.02 112.048 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 41' ' ' PRO . . . . . 0.782 ' HG2' ' HG3' ' A' ' 101' ' ' GLU . 46.7 Cg_exo -52.46 168.93 0.36 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.256 3.304 . . . . 81.56 113.789 179.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 42' ' ' SER . . . . . 0.751 ' O ' HG22 ' P' ' 43' ' ' THR . 24.9 p -55.22 -47.21 75.66 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 114.647 1.351 . . . . 77.73 114.647 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 43' ' ' THR . . . . . 0.751 HG22 ' O ' ' P' ' 42' ' ' SER . 0.7 OUTLIER 72.35 -12.11 0.74 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.242 0.83 . . . . 70.53 113.242 179.592 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' P' P ' 44' ' ' THR . . . . . . . . . . . . . 66.7 p -120.96 161.98 20.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.964 0.412 . . . . 63.12 110.134 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 45' ' ' ALA . . . . . . . . . . . . . . . -156.11 153.85 29.98 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.747 -1.205 . . . . 62.16 107.747 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 46' ' ' ARG . . . . . 0.843 ' HG2' ' O ' ' P' ' 6' ' ' HOH . 11.0 ptt180 -80.52 153.85 27.88 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.699 -1.222 . . . . 76.64 107.699 179.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 47' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 CA-C-N 115.44 -0.8 . . . . 61.78 110.7 -178.966 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 48' ' ' VAL . . . . . . . . . . . . . 10.6 p -91.02 -25.35 5.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.96 -0.756 . . . . 67.42 108.96 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 49' ' ' GLY . . . . . . . . . . . . . . . -62.37 -31.34 79.07 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.342 -0.845 . . . . 78.61 112.167 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.851 -1.071 . . . . 83.09 113.848 179.574 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 6' ' ' HOH . . . . . 0.843 ' O ' ' HG2' ' P' ' 46' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 8' ' ' HOH . . . . . 0.485 ' O ' ' HA ' ' A' ' 99' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_