data_6wjo_residue ############################ # Computer software used # ############################ 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 6wjo _Structure_validation_residue.Date_analyzed 2020-04-17 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 ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.324 0 CA-C-O 121.011 0.228 . . . . 39.46 112.926 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 51.5 m -78.6 -43.61 25.99 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.851 -0.739 . . . . 40.56 111.528 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -36.31 75.96 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.418 -0.513 . . . . 42.98 111.33 177.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -69.72 -43.05 73.16 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.083 -0.647 . . . . 47.16 111.19 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 67.0 tttt -70.06 -34.01 72.66 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.598 -0.841 . . . . 42.45 111.502 177.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 26.9 tp -61.67 -43.1 99.49 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.638 -0.825 . . . . 23.1 110.661 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -62.98 -48.52 78.5 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.553 -0.459 . . . . 41.35 110.804 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -69.78 -39.27 76.73 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.036 -0.666 . . . . 36.53 111.684 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmm -55.77 -49.91 71.86 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 119.561 -0.855 . . . . 24.43 110.573 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 93.7 mt -66.64 -40.98 88.96 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 112.026 0.38 . . . . 23.46 112.026 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -55.29 -41.44 72.29 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.951 0.405 . . . . 28.85 111.073 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -94.34 -20.93 19.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.305 1.224 . . . . 29.6 114.305 -171.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 80.0 mt -113.57 -19.71 11.52 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 114.553 1.316 . . . . 24.49 114.553 -173.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 10.9 tp -89.88 94.65 9.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.593 -0.891 . . . . 24.63 108.593 -174.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.7 t -66.84 -45.48 87.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.555 -0.748 . . . . 24.73 110.343 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 83.4 p -157.43 162.43 38.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.574 0.702 . . . . 22.0 110.092 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 25.6 t -120.99 140.95 43.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 108.047 -1.094 . . . . 18.67 108.047 174.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -145.51 -173.78 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.188 -1.412 . . . . 24.12 107.188 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -170.33 152.91 4.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.549 0.69 . . . . 19.86 110.49 -169.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -158.77 127.22 5.28 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 106.272 -1.751 . . . . 21.14 106.272 167.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.36 -132.3 50.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 118.962 -1.589 . . . . 17.54 110.482 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -87.93 11.42 15.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.76 1.022 . . . . 25.4 113.76 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 57.4 mt -114.53 124.53 71.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 119.256 0.935 . . . . 14.69 109.818 -176.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -93.53 131.59 38.63 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 109.048 -0.723 . . . . 14.69 109.048 165.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.83 122.2 60.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 108.412 -0.958 . . . . 15.36 108.412 -176.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 30.9 mt -106.61 128.38 54.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.983 -0.747 . . . . 15.51 108.983 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 -103.93 131.03 51.57 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.406 -0.59 . . . . 37.82 109.406 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 30.0 p -119.49 174.78 2.58 Favored Pre-proline 0 N--CA 1.471 0.594 0 O-C-N 123.4 0.437 . . . . 16.48 111.189 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -70.23 176.78 6.67 Favored 'Trans proline' 0 C--O 1.244 0.794 0 N-CA-C 109.712 -0.919 . . . . 19.21 109.712 165.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.09 133.09 39.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 CA-C-N 119.283 0.78 . . . . 16.76 111.748 -175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.28 -1.34 76.43 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.703 -1.054 . . . . 15.58 114.516 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -85.73 -18.05 60.66 Favored Glycine 0 C--N 1.338 0.686 0 CA-C-N 117.89 0.845 . . . . 14.43 114.573 -168.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.44 -50.53 86.81 Favored Pre-proline 0 C--O 1.243 0.751 0 CA-C-O 117.905 -1.045 . . . . 13.58 113.267 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -62.11 -36.95 67.1 Favored 'Trans proline' 0 C--O 1.237 0.441 0 CA-C-N 121.651 1.626 . . . . 12.03 112.817 177.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.06 -49.02 79.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.87 0.367 . . . . 17.65 110.899 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.5 tp -70.81 -48.18 55.49 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.805 -0.358 . . . . 21.17 111.222 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.14 -39.08 89.57 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.452 -0.499 . . . . 13.87 112.133 -173.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.1 t -55.87 -46.05 78.37 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 118.379 0.536 . . . . 19.37 111.491 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -62.55 -43.89 97.7 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.343 -0.543 . . . . 21.71 111.615 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 20.1 mt -58.31 -46.47 89.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.008 0.432 . . . . 20.0 110.222 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -47.09 -50.85 19.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.486 0.66 . . . . 17.79 110.517 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -77.89 -14.7 59.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.529 0.937 . . . . 30.02 113.529 -166.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 35.7 m -82.42 -8.74 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.273 0 CA-C-N 119.187 0.903 . . . . 20.84 112.69 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.44 51.41 5.63 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 115.266 0.866 . . . . 22.12 115.266 163.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 91.4 mtp -78.15 113.94 16.57 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.709 -0.478 . . . . 20.83 109.709 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -59.05 -40.27 84.61 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.308 -0.86 . . . . 34.13 111.632 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 144' ' ' ARG . 8.5 pt-20 -67.34 -9.09 37.76 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 118.399 -0.81 . . . . 21.43 112.757 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.1 t -101.95 112.73 36.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 N-CA-C 108.57 -0.9 . . . . 16.21 108.57 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.0 t -69.84 -41.2 79.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.469 0.652 . . . . 17.6 109.683 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -178.84 179.63 48.79 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 109.062 -1.615 . . . . 18.74 109.062 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 25.2 p -139.94 150.47 44.56 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.372 -0.973 . . . . 13.58 108.372 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.8 pt -132.23 135.66 57.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.072 -0.714 . . . . 15.01 109.072 165.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -110.96 138.9 46.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.817 -0.629 . . . . 14.39 109.353 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -98.59 -114.28 3.41 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 107.67 -2.172 . . . . 12.33 107.67 165.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -104.81 -53.07 2.75 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 122.289 -0.536 . . . . 13.42 112.285 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -126.04 18.15 7.81 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 122.757 0.423 . . . . 16.9 110.732 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -141.95 140.31 32.72 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.898 -0.778 . . . . 11.84 108.898 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 41.6 t -123.59 132.74 70.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 107.771 -1.196 . . . . 15.69 107.771 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -100.37 119.12 37.95 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.187 -1.042 . . . . 13.48 108.187 168.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 16.6 t -104.49 119.52 53.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.35 -1.352 . . . . 16.44 107.35 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.88 119.22 26.86 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.544 0.527 . . . . 19.67 110.582 178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -78.38 136.71 37.73 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.173 -0.467 . . . . 17.23 110.532 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ARG . . . . . 0.404 ' N ' ' O ' ' A' ' 128' ' ' GLU . 51.4 ttm-85 -72.0 129.43 38.52 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.462 -0.79 . . . . 29.22 109.884 172.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -58.54 138.01 85.85 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 109.596 -0.52 . . . . 38.37 109.596 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -94.73 4.1 50.56 Favored 'Cis proline' 0 C--N 1.345 0.343 0 N-CA-C 115.246 1.21 . . . . 31.85 115.246 7.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 42.0 mtp -65.11 148.61 51.35 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.584 -0.846 . . . . 43.98 110.656 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 81.5 p -98.49 167.48 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.455 -0.793 . . . . 27.13 110.695 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -60.25 -44.8 97.09 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.0 -1.095 . . . . 19.59 111.767 172.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -56.21 -53.49 56.58 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 122.353 -0.498 . . . . 33.41 111.29 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -60.36 -38.56 84.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.899 0.38 . . . . 32.11 110.753 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.78 -46.6 87.23 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 120.868 -0.333 . . . . 20.81 110.501 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -62.72 -36.7 93.67 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 119.683 -1.246 . . . . 19.09 112.98 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -66.33 -42.98 87.41 Favored 'General case' 0 C--O 1.239 0.518 0 O-C-N 122.194 -0.591 . . . . 34.92 111.745 177.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -48.16 -54.16 14.32 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 111.892 0.33 . . . . 20.03 111.892 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 65.5 mt -64.62 -39.11 93.14 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.313 -0.242 . . . . 24.33 111.651 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' SER . . . . . . . . . . . . . 11.2 m -60.74 -37.81 83.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.639 -0.424 . . . . 33.03 111.311 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -69.64 -23.44 63.49 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.568 -0.853 . . . . 36.15 112.03 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.1 mmp_? -68.32 -25.77 65.28 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 111.806 0.298 . . . . 21.91 111.806 173.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 . . . . . 0 N--CA 1.464 0.245 0 CA-C-N 117.972 0.351 . . . . 28.64 111.285 175.248 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.681 0.277 . . . . 55.67 111.519 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.12 -33.0 73.69 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.247 -0.581 . . . . 55.6 111.186 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.2 tttp -74.97 -39.48 61.26 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.597 -0.441 . . . . 42.9 111.362 179.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.79 -34.53 76.06 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.722 -0.791 . . . . 38.53 111.161 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.34 -44.18 88.53 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.637 -0.425 . . . . 47.55 111.015 -177.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 26.0 mttt -65.96 -38.93 89.85 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.695 -0.402 . . . . 42.76 111.001 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' MET . . . . . 0.447 ' SD ' ' CD1' ' B' ' 94' ' ' LEU . 6.1 tpp -57.98 -43.38 86.51 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 120.781 0.324 . . . . 39.46 111.386 177.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 94.4 mt -72.16 -39.74 68.49 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.634 -0.826 . . . . 32.01 111.385 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.89 -39.92 79.05 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.195 -0.602 . . . . 44.93 111.295 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -86.16 -19.92 29.38 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.766 1.024 . . . . 43.06 113.766 -175.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LEU . . . . . 0.447 ' CD1' ' SD ' ' B' ' 90' ' ' MET . 1.7 mt -121.29 -22.45 6.02 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 114.424 1.268 . . . . 35.26 114.424 -171.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 8.3 tp -83.24 101.0 10.95 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.597 -0.89 . . . . 26.14 108.597 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.5 t -78.52 -40.0 24.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 116.136 -0.484 . . . . 25.1 110.351 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 97.1 p -161.13 160.17 29.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.354 0.597 . . . . 23.09 109.511 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 75.8 t -127.84 135.47 62.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 108.345 -0.983 . . . . 21.55 108.345 173.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -133.97 -172.3 2.95 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.948 -0.76 . . . . 20.53 108.948 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -165.17 157.81 15.92 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.06 -0.718 . . . . 20.03 109.06 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.9 t -161.31 130.79 4.73 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 106.795 -1.557 . . . . 19.86 106.795 162.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 57.48 -128.25 46.99 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 110.212 -1.155 . . . . 19.81 110.212 -177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -96.08 21.79 8.35 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.849 0.685 . . . . 29.04 112.849 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 34.3 mt -121.42 128.5 75.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.546 -0.909 . . . . 24.0 108.546 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -97.27 134.22 40.85 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.55 -0.907 . . . . 17.43 108.55 163.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 99.7 t -108.71 127.79 64.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.325 -0.852 . . . . 15.06 109.139 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 5.9 mt -107.82 130.91 54.95 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.693 0.797 . . . . 14.7 109.294 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 45.0 mmm-85 -107.62 136.5 47.28 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.988 -0.745 . . . . 32.7 108.988 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -124.16 173.05 4.99 Favored Pre-proline 0 C--O 1.235 0.305 0 C-N-CA 123.694 0.797 . . . . 19.11 111.041 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -64.7 170.7 9.53 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 N-CA-C 108.886 -1.236 . . . . 14.82 108.886 166.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -60.2 139.75 88.75 Favored 'Trans proline' 0 C--O 1.241 0.637 0 CA-C-O 122.377 0.907 . . . . 17.91 112.583 -175.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . 0.661 ' O ' ' O ' ' B' ' 301' ' ' HOH . . . 69.84 -1.34 16.68 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 114.679 -1.146 . . . . 20.42 115.539 -178.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.34 -15.08 81.74 Favored Glycine 0 C--N 1.333 0.393 0 N-CA-C 116.351 1.301 . . . . 17.59 116.351 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.05 -54.29 47.51 Favored Pre-proline 0 C--O 1.243 0.761 0 CA-C-N 118.832 1.316 . . . . 12.98 112.932 -168.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -65.25 -25.22 57.48 Favored 'Trans proline' 0 C--N 1.344 0.303 0 CA-C-N 121.798 1.678 . . . . 12.89 113.981 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -63.69 -52.84 58.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.189 0.904 . . . . 18.77 110.367 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.17 -49.05 77.35 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 122.173 -0.33 . . . . 23.07 111.593 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.08 -40.67 87.05 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 112.189 0.44 . . . . 14.0 112.189 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 77.4 p -61.64 -39.02 89.83 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.902 -0.719 . . . . 21.42 110.881 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -63.45 -39.91 95.74 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.174 -1.01 . . . . 27.35 111.349 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 44.2 mt -61.7 -45.94 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.707 -0.797 . . . . 19.39 110.185 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASP . . . . . 0.48 ' OD2' ' N ' ' B' ' 201' ' ' TYR . 87.7 m-20 -50.87 -46.28 60.3 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.2 0.524 . . . . 18.08 111.118 174.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -40.51 84.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.046 -0.525 . . . . 31.67 111.115 -176.669 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 65.3 t -54.16 -49.47 61.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-O 121.294 0.569 . . . . 26.2 109.968 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 76.48 56.61 4.19 Favored Glycine 0 N--CA 1.45 -0.407 0 O-C-N 121.988 -0.445 . . . . 27.21 113.74 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' MET . . . . . . . . . . . . . 28.8 mtt -76.48 140.69 41.33 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 119.819 -0.752 . . . . 28.07 109.467 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -63.67 -35.31 80.12 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.893 -0.594 . . . . 27.82 111.268 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -78.52 -7.19 57.23 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 113.386 0.884 . . . . 19.23 113.386 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 71.2 t -92.58 105.65 16.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.828 -1.175 . . . . 18.41 107.828 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 99.1 t -65.59 -39.78 86.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.535 0.683 . . . . 15.94 109.788 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 179.56 168.08 37.88 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 109.312 -1.515 . . . . 15.36 109.312 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' THR . . . . . . . . . . . . . 25.4 p -129.67 145.37 51.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.917 1.287 . . . . 14.81 108.249 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 38.1 mm -124.05 132.5 71.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.26 -1.385 . . . . 17.43 107.26 166.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -105.34 134.06 49.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.355 -0.384 . . . . 14.66 110.011 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -95.09 -123.24 3.98 Favored Glycine 0 C--N 1.333 0.392 0 N-CA-C 109.215 -1.554 . . . . 16.1 109.215 164.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -97.77 -49.07 4.96 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 118.315 1.057 . . . . 14.26 111.944 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -132.85 14.14 4.35 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 121.812 -0.555 . . . . 18.6 111.074 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' THR . . . . . . . . . . . . . 87.5 m -135.79 139.09 43.25 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.483 -1.303 . . . . 12.97 107.483 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 64.9 t -123.95 128.2 74.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.101 -1.074 . . . . 15.3 108.101 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -96.28 122.58 39.3 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 106.957 -1.497 . . . . 17.25 106.957 170.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 18.7 t -115.61 116.02 51.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 107.843 -1.169 . . . . 14.52 107.843 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' LEU . . . . . . . . . . . . . 41.6 tp -87.73 120.68 29.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 17.36 110.169 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -84.78 141.9 30.18 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.2 -0.6 . . . . 15.1 109.756 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 57.0 ttm-85 -79.1 125.6 29.63 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.45 -0.341 . . . . 24.11 110.112 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.28 138.51 57.9 Favored Pre-proline 0 C--O 1.237 0.405 0 CA-C-N 115.946 -0.57 . . . . 30.82 109.695 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -92.18 19.0 38.29 Favored 'Cis proline' 0 CA--C 1.534 0.514 0 N-CA-C 115.242 1.208 . . . . 25.05 115.242 3.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' MET . . . . . . . . . . . . . 54.6 ttm -75.31 143.45 42.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.296 0.953 . . . . 23.9 110.417 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.3 p -94.01 159.88 14.97 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.687 0.756 . . . . 21.37 110.871 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.43 77.56 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-N 115.131 -0.941 . . . . 21.03 112.943 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' GLN . . . . . 0.487 ' N ' ' O ' ' B' ' 305' ' ' HOH . 1.3 tm0? -62.83 -45.62 91.73 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.196 0.498 . . . . 30.36 110.897 173.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -63.87 -41.63 97.7 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.356 -0.215 . . . . 26.49 111.502 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 7.0 tp -68.27 -36.08 78.85 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.134 -1.026 . . . . 20.43 110.722 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -68.12 -33.63 79.14 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.343 -0.932 . . . . 25.73 112.945 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.5 -38.91 88.27 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.53 0.665 . . . . 36.36 111.275 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -65.27 -43.21 91.97 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.437 -0.505 . . . . 27.25 110.749 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.48 -41.31 93.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.215 -0.194 . . . . 34.5 111.461 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 9.6 m -64.07 -34.83 78.92 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.918 -0.713 . . . . 39.41 110.854 177.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -57.74 -54.94 41.26 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.87 0.367 . . . . 44.65 111.308 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.85 0.357 . . . . 48.35 110.944 177.239 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' TYR . . . . . . . . . . . . . 17.2 p90 . . . . . 0 C--O 1.245 0.847 0 N-CA-C 111.591 0.219 . . . . 15.83 111.591 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' TYR . . . . . 0.48 ' N ' ' OD2' ' B' ' 122' ' ' ASP . 13.5 p90 . . . . . 0 C--O 1.234 0.275 0 N-CA-C 113.305 0.854 . . . . 16.62 113.305 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.661 ' O ' ' O ' ' B' ' 112' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . 0.487 ' O ' ' N ' ' B' ' 150' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.324 0 CA-C-O 121.011 0.228 . . . . 39.460000000000001 112.926 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 51.5 m -78.6 -43.61 25.99 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.851 -0.739 . . . . 40.560000000000002 111.528 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.52 ' NH1' ' HE ' ' A' ' 159' ' ' ARG . 0.1 OUTLIER -59.57 -36.31 75.96 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.418 -0.513 . . . . 42.979999999999997 111.33 177.502 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -69.72 -43.05 73.16 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.083 -0.647 . . . . 47.159999999999997 111.19 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 67.0 tttt -70.06 -34.01 72.66 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.598 -0.841 . . . . 42.450000000000003 111.502 177.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 26.9 tp -61.67 -43.1 99.49 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.638 -0.825 . . . . 23.100000000000001 110.661 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 22.8 ttp-105 -62.98 -48.52 78.5 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.553 -0.459 . . . . 41.350000000000001 110.804 178.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . 0.466 ' HE2' ' OD2' ' A' ' 93' ' ' ASP . 14.3 tttt -69.78 -39.27 76.73 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.036 -0.666 . . . . 36.530000000000001 111.684 179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmm -55.77 -49.91 71.86 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 119.561 -0.855 . . . . 24.43 110.573 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . 0.501 HD22 HD22 ' A' ' 95' ' ' LEU . 93.7 mt -66.64 -40.98 88.96 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 112.026 0.38 . . . . 23.460000000000001 112.026 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -55.29 -41.44 72.29 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.951 0.405 . . . . 28.850000000000001 111.073 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.466 ' OD2' ' HE2' ' A' ' 89' ' ' LYS . 83.9 m-20 -94.34 -20.93 19.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.305 1.224 . . . . 29.600000000000001 114.305 -171.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD11 ' CD2' ' A' ' 116' ' ' PHE . 80.0 mt -113.57 -19.71 11.52 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 114.553 1.316 . . . . 24.489999999999998 114.553 -173.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 107' ' ' LEU . 10.9 tp -89.88 94.65 9.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.593 -0.891 . . . . 24.629999999999999 108.593 -174.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.7 t -66.84 -45.48 87.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.555 -0.748 . . . . 24.73 110.343 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 83.4 p -157.43 162.43 38.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.574 0.702 . . . . 22.0 110.092 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 25.6 t -120.99 140.95 43.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 108.047 -1.094 . . . . 18.670000000000002 108.047 174.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -145.51 -173.78 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.188 -1.412 . . . . 24.120000000000001 107.188 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -170.33 152.91 4.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.549 0.69 . . . . 19.859999999999999 110.49 -169.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -158.77 127.22 5.28 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 106.272 -1.751 . . . . 21.140000000000001 106.272 167.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.36 -132.3 50.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 118.962 -1.589 . . . . 17.539999999999999 110.482 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . 0.415 ' ND2' HD11 ' A' ' 142' ' ' LEU . 39.4 p-10 -87.93 11.42 15.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.76 1.022 . . . . 25.399999999999999 113.76 -179.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 57.4 mt -114.53 124.53 71.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 119.256 0.935 . . . . 14.69 109.818 -176.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -93.53 131.59 38.63 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 109.048 -0.723 . . . . 14.69 109.048 165.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.83 122.2 60.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 108.412 -0.958 . . . . 15.359999999999999 108.412 -176.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 95' ' ' LEU . 30.9 mt -106.61 128.38 54.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.983 -0.747 . . . . 15.51 108.983 178.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 -103.93 131.03 51.57 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.406 -0.59 . . . . 37.82 109.406 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 30.0 p -119.49 174.78 2.58 Favored Pre-proline 0 N--CA 1.471 0.594 0 O-C-N 123.4 0.437 . . . . 16.48 111.189 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -70.23 176.78 6.67 Favored 'Trans proline' 0 C--O 1.244 0.794 0 N-CA-C 109.712 -0.919 . . . . 19.210000000000001 109.712 165.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.09 133.09 39.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 CA-C-N 119.283 0.78 . . . . 16.760000000000002 111.748 -175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.28 -1.34 76.43 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.703 -1.054 . . . . 15.58 114.516 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -85.73 -18.05 60.66 Favored Glycine 0 C--N 1.338 0.686 0 CA-C-N 117.89 0.845 . . . . 14.43 114.573 -168.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.44 -50.53 86.81 Favored Pre-proline 0 C--O 1.243 0.751 0 CA-C-O 117.905 -1.045 . . . . 13.58 113.267 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -62.11 -36.95 67.1 Favored 'Trans proline' 0 C--O 1.237 0.441 0 CA-C-N 121.651 1.626 . . . . 12.029999999999999 112.817 177.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' PHE . . . . . 0.528 ' CD2' HD11 ' A' ' 94' ' ' LEU . 18.3 t80 -59.06 -49.02 79.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.87 0.367 . . . . 17.649999999999999 110.899 177.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . 0.51 ' HB2' HD13 ' A' ' 94' ' ' LEU . 15.5 tp -70.81 -48.18 55.49 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.805 -0.358 . . . . 21.170000000000002 111.222 -178.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.14 -39.08 89.57 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.452 -0.499 . . . . 13.869999999999999 112.133 -173.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.1 t -55.87 -46.05 78.37 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 118.379 0.536 . . . . 19.370000000000001 111.491 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -62.55 -43.89 97.7 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.343 -0.543 . . . . 21.710000000000001 111.615 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ILE . . . . . 0.405 ' O ' HG22 ' A' ' 124' ' ' VAL . 20.1 mt -58.31 -46.47 89.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.008 0.432 . . . . 20.0 110.222 178.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -47.09 -50.85 19.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.486 0.66 . . . . 17.789999999999999 110.517 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -77.89 -14.7 59.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.529 0.937 . . . . 30.02 113.529 -166.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 121' ' ' ILE . 35.7 m -82.42 -8.74 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.273 0 CA-C-N 119.187 0.903 . . . . 20.84 112.69 174.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.44 51.41 5.63 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 115.266 0.866 . . . . 22.120000000000001 115.266 163.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 91.4 mtp -78.15 113.94 16.57 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.709 -0.478 . . . . 20.829999999999998 109.709 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -59.05 -40.27 84.61 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.308 -0.86 . . . . 34.130000000000003 111.632 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLU . . . . . 0.598 ' HG3' HD13 ' A' ' 152' ' ' LEU . 8.5 pt-20 -67.34 -9.09 37.76 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 118.399 -0.81 . . . . 21.43 112.757 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.1 t -101.95 112.73 36.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 N-CA-C 108.57 -0.9 . . . . 16.210000000000001 108.57 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.0 t -69.84 -41.2 79.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.469 0.652 . . . . 17.600000000000001 109.683 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -178.84 179.63 48.79 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 109.062 -1.615 . . . . 18.739999999999998 109.062 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 25.2 p -139.94 150.47 44.56 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.372 -0.973 . . . . 13.58 108.372 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.8 pt -132.23 135.66 57.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.072 -0.714 . . . . 15.01 109.072 165.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -110.96 138.9 46.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.817 -0.629 . . . . 14.390000000000001 109.353 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -98.59 -114.28 3.41 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 107.67 -2.172 . . . . 12.33 107.67 165.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -104.81 -53.07 2.75 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 122.289 -0.536 . . . . 13.42 112.285 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -126.04 18.15 7.81 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 122.757 0.423 . . . . 16.899999999999999 110.732 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -141.95 140.31 32.72 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.898 -0.778 . . . . 11.84 108.898 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . 0.411 ' HB ' ' HB2' ' A' ' 107' ' ' LEU . 41.6 t -123.59 132.74 70.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 107.771 -1.196 . . . . 15.69 107.771 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -100.37 119.12 37.95 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.187 -1.042 . . . . 13.48 108.187 168.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . 0.454 HG12 HD21 ' A' ' 152' ' ' LEU . 16.6 t -104.49 119.52 53.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.35 -1.352 . . . . 16.440000000000001 107.35 176.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LEU . . . . . 0.415 HD11 ' ND2' ' A' ' 103' ' ' ASN . 16.3 tp -86.88 119.22 26.86 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.544 0.527 . . . . 19.670000000000002 110.582 178.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -78.38 136.71 37.73 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.173 -0.467 . . . . 17.23 110.532 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -72.0 129.43 38.52 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.462 -0.79 . . . . 29.219999999999999 109.884 172.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -58.54 138.01 85.85 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 109.596 -0.52 . . . . 38.369999999999997 109.596 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -94.73 4.1 50.56 Favored 'Cis proline' 0 C--N 1.345 0.343 0 N-CA-C 115.246 1.21 . . . . 31.850000000000001 115.246 7.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 42.0 mtp -65.11 148.61 51.35 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.584 -0.846 . . . . 43.979999999999997 110.656 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 81.5 p -98.49 167.48 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.455 -0.793 . . . . 27.129999999999999 110.695 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -60.25 -44.8 97.09 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.0 -1.095 . . . . 19.59 111.767 172.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -56.21 -53.49 56.58 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 122.353 -0.498 . . . . 33.409999999999997 111.29 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -60.36 -38.56 84.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.899 0.38 . . . . 32.109999999999999 110.753 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' LEU . . . . . 0.598 HD13 ' HG3' ' A' ' 128' ' ' GLU . 10.4 tp -62.78 -46.6 87.23 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 120.868 -0.333 . . . . 20.809999999999999 110.501 174.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -62.72 -36.7 93.67 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 119.683 -1.246 . . . . 19.09 112.98 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 158' ' ' GLN . 43.5 mt-10 -66.33 -42.98 87.41 Favored 'General case' 0 C--O 1.239 0.518 0 O-C-N 122.194 -0.591 . . . . 34.920000000000002 111.745 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -48.16 -54.16 14.32 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 111.892 0.33 . . . . 20.030000000000001 111.892 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 65.5 mt -64.62 -39.11 93.14 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.313 -0.242 . . . . 24.329999999999998 111.651 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 11.2 m -60.74 -37.81 83.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.639 -0.424 . . . . 33.030000000000001 111.311 177.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 154' ' ' GLU . 62.7 mt-30 -69.64 -23.44 63.49 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.568 -0.853 . . . . 36.149999999999999 112.03 -179.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ARG . . . . . 0.52 ' HE ' ' NH1' ' A' ' 84' ' ' ARG . 13.1 mmp_? -68.32 -25.77 65.28 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 111.806 0.298 . . . . 21.91 111.806 173.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 157' ' ' SER . 21.5 mtm180 . . . . . 0 N--CA 1.464 0.245 0 CA-C-N 117.972 0.351 . . . . 28.640000000000001 111.285 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.681 0.277 . . . . 55.670000000000002 111.519 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.12 -33.0 73.69 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.247 -0.581 . . . . 55.600000000000001 111.186 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LYS . . . . . 0.53 ' HE3' ' HE1' ' B' ' 120' ' ' PHE . 23.2 tttp -74.97 -39.48 61.26 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.597 -0.441 . . . . 42.899999999999999 111.362 179.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.79 -34.53 76.06 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.722 -0.791 . . . . 38.530000000000001 111.161 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.34 -44.18 88.53 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.637 -0.425 . . . . 47.549999999999997 111.015 -177.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 26.0 mttt -65.96 -38.93 89.85 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.695 -0.402 . . . . 42.759999999999998 111.001 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' MET . . . . . 0.447 ' SD ' ' CD1' ' B' ' 94' ' ' LEU . 6.1 tpp -57.98 -43.38 86.51 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 120.781 0.324 . . . . 39.460000000000001 111.386 177.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 94.4 mt -72.16 -39.74 68.49 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.634 -0.826 . . . . 32.009999999999998 111.385 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.89 -39.92 79.05 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.195 -0.602 . . . . 44.93 111.295 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -86.16 -19.92 29.38 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.766 1.024 . . . . 43.060000000000002 113.766 -175.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LEU . . . . . 0.447 ' CD1' ' SD ' ' B' ' 90' ' ' MET . 1.7 mt -121.29 -22.45 6.02 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 114.424 1.268 . . . . 35.259999999999998 114.424 -171.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 8.3 tp -83.24 101.0 10.95 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.597 -0.89 . . . . 26.140000000000001 108.597 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.5 t -78.52 -40.0 24.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 116.136 -0.484 . . . . 25.100000000000001 110.351 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 97.1 p -161.13 160.17 29.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.354 0.597 . . . . 23.09 109.511 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 75.8 t -127.84 135.47 62.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 108.345 -0.983 . . . . 21.550000000000001 108.345 173.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -133.97 -172.3 2.95 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.948 -0.76 . . . . 20.530000000000001 108.948 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -165.17 157.81 15.92 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.06 -0.718 . . . . 20.030000000000001 109.06 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.9 t -161.31 130.79 4.73 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 106.795 -1.557 . . . . 19.859999999999999 106.795 162.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 57.48 -128.25 46.99 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 110.212 -1.155 . . . . 19.809999999999999 110.212 -177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -96.08 21.79 8.35 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.849 0.685 . . . . 29.039999999999999 112.849 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 34.3 mt -121.42 128.5 75.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.546 -0.909 . . . . 24.0 108.546 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -97.27 134.22 40.85 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.55 -0.907 . . . . 17.43 108.55 163.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 99.7 t -108.71 127.79 64.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.325 -0.852 . . . . 15.06 109.139 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 5.9 mt -107.82 130.91 54.95 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.693 0.797 . . . . 14.699999999999999 109.294 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 45.0 mmm-85 -107.62 136.5 47.28 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.988 -0.745 . . . . 32.700000000000003 108.988 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -124.16 173.05 4.99 Favored Pre-proline 0 C--O 1.235 0.305 0 C-N-CA 123.694 0.797 . . . . 19.109999999999999 111.041 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -64.7 170.7 9.53 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 N-CA-C 108.886 -1.236 . . . . 14.82 108.886 166.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -60.2 139.75 88.75 Favored 'Trans proline' 0 C--O 1.241 0.637 0 CA-C-O 122.377 0.907 . . . . 17.91 112.583 -175.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . 0.661 ' O ' ' O ' ' B' ' 301' ' ' HOH . . . 69.84 -1.34 16.68 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 114.679 -1.146 . . . . 20.420000000000002 115.539 -178.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.34 -15.08 81.74 Favored Glycine 0 C--N 1.333 0.393 0 N-CA-C 116.351 1.301 . . . . 17.59 116.351 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . 0.466 ' HB3' ' HD3' ' B' ' 115' ' ' PRO . . . -63.05 -54.29 47.51 Favored Pre-proline 0 C--O 1.243 0.761 0 CA-C-N 118.832 1.316 . . . . 12.98 112.932 -168.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' B' ' 114' ' ' ALA . 15.0 Cg_exo -65.25 -25.22 57.48 Favored 'Trans proline' 0 C--N 1.344 0.303 0 CA-C-N 121.798 1.678 . . . . 12.890000000000001 113.981 178.36 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' PHE . . . . . 0.44 ' CD2' HD11 ' B' ' 94' ' ' LEU . 24.0 t80 -63.69 -52.84 58.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.189 0.904 . . . . 18.77 110.367 173.747 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.17 -49.05 77.35 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 122.173 -0.33 . . . . 23.07 111.593 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.08 -40.67 87.05 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 112.189 0.44 . . . . 14.0 112.189 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 77.4 p -61.64 -39.02 89.83 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.902 -0.719 . . . . 21.420000000000002 110.881 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' PHE . . . . . 0.53 ' HE1' ' HE3' ' B' ' 86' ' ' LYS . 31.9 t80 -63.45 -39.91 95.74 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.174 -1.01 . . . . 27.350000000000001 111.349 175.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 44.2 mt -61.7 -45.94 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.707 -0.797 . . . . 19.390000000000001 110.185 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASP . . . . . 0.48 ' OD2' ' N ' ' B' ' 201' ' ' TYR . 87.7 m-20 -50.87 -46.28 60.3 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.2 0.524 . . . . 18.079999999999998 111.118 174.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -40.51 84.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.046 -0.525 . . . . 31.670000000000002 111.115 -176.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 65.3 t -54.16 -49.47 61.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-O 121.294 0.569 . . . . 26.199999999999999 109.968 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 76.48 56.61 4.19 Favored Glycine 0 N--CA 1.45 -0.407 0 O-C-N 121.988 -0.445 . . . . 27.210000000000001 113.74 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' MET . . . . . . . . . . . . . 28.8 mtt -76.48 140.69 41.33 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 119.819 -0.752 . . . . 28.07 109.467 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -63.67 -35.31 80.12 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.893 -0.594 . . . . 27.82 111.268 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -78.52 -7.19 57.23 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 113.386 0.884 . . . . 19.23 113.386 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' VAL . . . . . 0.449 HG22 HD21 ' B' ' 152' ' ' LEU . 71.2 t -92.58 105.65 16.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.828 -1.175 . . . . 18.41 107.828 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 99.1 t -65.59 -39.78 86.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.535 0.683 . . . . 15.94 109.788 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 179.56 168.08 37.88 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 109.312 -1.515 . . . . 15.359999999999999 109.312 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' THR . . . . . . . . . . . . . 25.4 p -129.67 145.37 51.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.917 1.287 . . . . 14.81 108.249 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 38.1 mm -124.05 132.5 71.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.26 -1.385 . . . . 17.43 107.26 166.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -105.34 134.06 49.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.355 -0.384 . . . . 14.66 110.011 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -95.09 -123.24 3.98 Favored Glycine 0 C--N 1.333 0.392 0 N-CA-C 109.215 -1.554 . . . . 16.100000000000001 109.215 164.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -97.77 -49.07 4.96 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 118.315 1.057 . . . . 14.26 111.944 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -132.85 14.14 4.35 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 121.812 -0.555 . . . . 18.600000000000001 111.074 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' THR . . . . . . . . . . . . . 87.5 m -135.79 139.09 43.25 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.483 -1.303 . . . . 12.970000000000001 107.483 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 64.9 t -123.95 128.2 74.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.101 -1.074 . . . . 15.300000000000001 108.101 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -96.28 122.58 39.3 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 106.957 -1.497 . . . . 17.25 106.957 170.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 18.7 t -115.61 116.02 51.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 107.843 -1.169 . . . . 14.52 107.843 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' LEU . . . . . . . . . . . . . 41.6 tp -87.73 120.68 29.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 17.359999999999999 110.169 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -84.78 141.9 30.18 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.2 -0.6 . . . . 15.1 109.756 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 57.0 ttm-85 -79.1 125.6 29.63 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.45 -0.341 . . . . 24.109999999999999 110.112 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.28 138.51 57.9 Favored Pre-proline 0 C--O 1.237 0.405 0 CA-C-N 115.946 -0.57 . . . . 30.82 109.695 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -92.18 19.0 38.29 Favored 'Cis proline' 0 CA--C 1.534 0.514 0 N-CA-C 115.242 1.208 . . . . 25.050000000000001 115.242 3.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' MET . . . . . . . . . . . . . 54.6 ttm -75.31 143.45 42.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.296 0.953 . . . . 23.899999999999999 110.417 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.3 p -94.01 159.88 14.97 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.687 0.756 . . . . 21.370000000000001 110.871 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.43 77.56 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-N 115.131 -0.941 . . . . 21.030000000000001 112.943 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.83 -45.62 91.73 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.196 0.498 . . . . 30.359999999999999 110.897 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -63.87 -41.63 97.7 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.356 -0.215 . . . . 26.489999999999998 111.502 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' LEU . . . . . 0.449 HD21 HG22 ' B' ' 129' ' ' VAL . 7.0 tp -68.27 -36.08 78.85 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.134 -1.026 . . . . 20.43 110.722 -179.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -68.12 -33.63 79.14 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.343 -0.932 . . . . 25.73 112.945 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.5 -38.91 88.27 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.53 0.665 . . . . 36.359999999999999 111.275 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -65.27 -43.21 91.97 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.437 -0.505 . . . . 27.25 110.749 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.48 -41.31 93.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.215 -0.194 . . . . 34.5 111.461 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 9.6 m -64.07 -34.83 78.92 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.918 -0.713 . . . . 39.409999999999997 110.854 177.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -57.74 -54.94 41.26 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.87 0.367 . . . . 44.649999999999999 111.308 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.85 0.357 . . . . 48.350000000000001 110.944 177.239 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' TYR . . . . . . . . . . . . . 17.2 p90 . . . . . 0 C--O 1.245 0.847 0 N-CA-C 111.591 0.219 . . . . 15.83 111.591 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' TYR . . . . . 0.48 ' N ' ' OD2' ' B' ' 122' ' ' ASP . 13.5 p90 . . . . . 0 C--O 1.234 0.275 0 N-CA-C 113.305 0.854 . . . . 16.620000000000001 113.305 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.661 ' O ' ' O ' ' B' ' 112' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.324 0 CA-C-O 121.011 0.228 . . . . 39.46 112.926 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 51.5 m -78.6 -43.61 25.99 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.851 -0.739 . . . . 40.56 111.528 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.52 ' NH1' ' HE ' ' A' ' 159' ' ' ARG . 0.1 OUTLIER -59.57 -36.31 75.96 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.418 -0.513 . . . . 42.98 111.33 177.502 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -69.72 -43.05 73.16 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.083 -0.647 . . . . 47.16 111.19 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 67.0 tttt -70.06 -34.01 72.66 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.598 -0.841 . . . . 42.45 111.502 177.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 26.9 tp -61.67 -43.1 99.49 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.638 -0.825 . . . . 23.1 110.661 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 22.8 ttp-105 -62.98 -48.52 78.5 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.553 -0.459 . . . . 41.35 110.804 178.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.466 ' HE2' ' OD2' ' A' ' 93' ' ' ASP . 14.3 tttt -69.78 -39.27 76.73 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.036 -0.666 . . . . 36.53 111.684 179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmm -55.77 -49.91 71.86 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 119.561 -0.855 . . . . 24.43 110.573 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.501 HD22 HD22 ' A' ' 95' ' ' LEU . 93.7 mt -66.64 -40.98 88.96 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 112.026 0.38 . . . . 23.46 112.026 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -55.29 -41.44 72.29 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.951 0.405 . . . . 28.85 111.073 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.466 ' OD2' ' HE2' ' A' ' 89' ' ' LYS . 83.9 m-20 -94.34 -20.93 19.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.305 1.224 . . . . 29.6 114.305 -171.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD11 ' CD2' ' A' ' 116' ' ' PHE . 80.0 mt -113.57 -19.71 11.52 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 114.553 1.316 . . . . 24.49 114.553 -173.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 107' ' ' LEU . 10.9 tp -89.88 94.65 9.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.593 -0.891 . . . . 24.63 108.593 -174.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.7 t -66.84 -45.48 87.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.555 -0.748 . . . . 24.73 110.343 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 83.4 p -157.43 162.43 38.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.574 0.702 . . . . 22.0 110.092 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 25.6 t -120.99 140.95 43.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 108.047 -1.094 . . . . 18.67 108.047 174.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -145.51 -173.78 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.188 -1.412 . . . . 24.12 107.188 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -170.33 152.91 4.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.549 0.69 . . . . 19.86 110.49 -169.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -158.77 127.22 5.28 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 106.272 -1.751 . . . . 21.14 106.272 167.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.36 -132.3 50.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 118.962 -1.589 . . . . 17.54 110.482 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.415 ' ND2' HD11 ' A' ' 142' ' ' LEU . 39.4 p-10 -87.93 11.42 15.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.76 1.022 . . . . 25.4 113.76 -179.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 57.4 mt -114.53 124.53 71.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 119.256 0.935 . . . . 14.69 109.818 -176.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -93.53 131.59 38.63 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 109.048 -0.723 . . . . 14.69 109.048 165.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.83 122.2 60.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 108.412 -0.958 . . . . 15.36 108.412 -176.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 95' ' ' LEU . 30.9 mt -106.61 128.38 54.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.983 -0.747 . . . . 15.51 108.983 178.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 -103.93 131.03 51.57 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.406 -0.59 . . . . 37.82 109.406 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 30.0 p -119.49 174.78 2.58 Favored Pre-proline 0 N--CA 1.471 0.594 0 O-C-N 123.4 0.437 . . . . 16.48 111.189 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -70.23 176.78 6.67 Favored 'Trans proline' 0 C--O 1.244 0.794 0 N-CA-C 109.712 -0.919 . . . . 19.21 109.712 165.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.09 133.09 39.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 CA-C-N 119.283 0.78 . . . . 16.76 111.748 -175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.28 -1.34 76.43 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.703 -1.054 . . . . 15.58 114.516 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -85.73 -18.05 60.66 Favored Glycine 0 C--N 1.338 0.686 0 CA-C-N 117.89 0.845 . . . . 14.43 114.573 -168.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.44 -50.53 86.81 Favored Pre-proline 0 C--O 1.243 0.751 0 CA-C-O 117.905 -1.045 . . . . 13.58 113.267 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -62.11 -36.95 67.1 Favored 'Trans proline' 0 C--O 1.237 0.441 0 CA-C-N 121.651 1.626 . . . . 12.03 112.817 177.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.528 ' CD2' HD11 ' A' ' 94' ' ' LEU . 18.3 t80 -59.06 -49.02 79.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.87 0.367 . . . . 17.65 110.899 177.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.51 ' HB2' HD13 ' A' ' 94' ' ' LEU . 15.5 tp -70.81 -48.18 55.49 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.805 -0.358 . . . . 21.17 111.222 -178.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.14 -39.08 89.57 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.452 -0.499 . . . . 13.87 112.133 -173.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.1 t -55.87 -46.05 78.37 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 118.379 0.536 . . . . 19.37 111.491 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -62.55 -43.89 97.7 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.343 -0.543 . . . . 21.71 111.615 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.405 ' O ' HG22 ' A' ' 124' ' ' VAL . 20.1 mt -58.31 -46.47 89.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.008 0.432 . . . . 20.0 110.222 178.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -47.09 -50.85 19.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.486 0.66 . . . . 17.79 110.517 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -77.89 -14.7 59.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.529 0.937 . . . . 30.02 113.529 -166.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 121' ' ' ILE . 35.7 m -82.42 -8.74 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.273 0 CA-C-N 119.187 0.903 . . . . 20.84 112.69 174.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.44 51.41 5.63 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 115.266 0.866 . . . . 22.12 115.266 163.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 91.4 mtp -78.15 113.94 16.57 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.709 -0.478 . . . . 20.83 109.709 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -59.05 -40.27 84.61 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.308 -0.86 . . . . 34.13 111.632 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.598 ' HG3' HD13 ' A' ' 152' ' ' LEU . 8.5 pt-20 -67.34 -9.09 37.76 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 118.399 -0.81 . . . . 21.43 112.757 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.1 t -101.95 112.73 36.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 N-CA-C 108.57 -0.9 . . . . 16.21 108.57 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.0 t -69.84 -41.2 79.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.469 0.652 . . . . 17.6 109.683 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -178.84 179.63 48.79 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 109.062 -1.615 . . . . 18.74 109.062 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 25.2 p -139.94 150.47 44.56 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.372 -0.973 . . . . 13.58 108.372 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.8 pt -132.23 135.66 57.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.072 -0.714 . . . . 15.01 109.072 165.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -110.96 138.9 46.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.817 -0.629 . . . . 14.39 109.353 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -98.59 -114.28 3.41 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 107.67 -2.172 . . . . 12.33 107.67 165.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -104.81 -53.07 2.75 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 122.289 -0.536 . . . . 13.42 112.285 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -126.04 18.15 7.81 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 122.757 0.423 . . . . 16.9 110.732 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -141.95 140.31 32.72 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.898 -0.778 . . . . 11.84 108.898 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . 0.411 ' HB ' ' HB2' ' A' ' 107' ' ' LEU . 41.6 t -123.59 132.74 70.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 107.771 -1.196 . . . . 15.69 107.771 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -100.37 119.12 37.95 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.187 -1.042 . . . . 13.48 108.187 168.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.454 HG12 HD21 ' A' ' 152' ' ' LEU . 16.6 t -104.49 119.52 53.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.35 -1.352 . . . . 16.44 107.35 176.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.415 HD11 ' ND2' ' A' ' 103' ' ' ASN . 16.3 tp -86.88 119.22 26.86 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.544 0.527 . . . . 19.67 110.582 178.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -78.38 136.71 37.73 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.173 -0.467 . . . . 17.23 110.532 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -72.0 129.43 38.52 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.462 -0.79 . . . . 29.22 109.884 172.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -58.54 138.01 85.85 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 109.596 -0.52 . . . . 38.37 109.596 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -94.73 4.1 50.56 Favored 'Cis proline' 0 C--N 1.345 0.343 0 N-CA-C 115.246 1.21 . . . . 31.85 115.246 7.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 42.0 mtp -65.11 148.61 51.35 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.584 -0.846 . . . . 43.98 110.656 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 81.5 p -98.49 167.48 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.455 -0.793 . . . . 27.13 110.695 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -60.25 -44.8 97.09 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.0 -1.095 . . . . 19.59 111.767 172.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -56.21 -53.49 56.58 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 122.353 -0.498 . . . . 33.41 111.29 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -60.36 -38.56 84.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.899 0.38 . . . . 32.11 110.753 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.598 HD13 ' HG3' ' A' ' 128' ' ' GLU . 10.4 tp -62.78 -46.6 87.23 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 120.868 -0.333 . . . . 20.81 110.501 174.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -62.72 -36.7 93.67 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 119.683 -1.246 . . . . 19.09 112.98 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 158' ' ' GLN . 43.5 mt-10 -66.33 -42.98 87.41 Favored 'General case' 0 C--O 1.239 0.518 0 O-C-N 122.194 -0.591 . . . . 34.92 111.745 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -48.16 -54.16 14.32 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 111.892 0.33 . . . . 20.03 111.892 170.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 65.5 mt -64.62 -39.11 93.14 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.313 -0.242 . . . . 24.33 111.651 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 11.2 m -60.74 -37.81 83.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.639 -0.424 . . . . 33.03 111.311 177.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 154' ' ' GLU . 62.7 mt-30 -69.64 -23.44 63.49 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.568 -0.853 . . . . 36.15 112.03 -179.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.52 ' HE ' ' NH1' ' A' ' 84' ' ' ARG . 13.1 mmp_? -68.32 -25.77 65.28 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 111.806 0.298 . . . . 21.91 111.806 173.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 157' ' ' SER . 21.5 mtm180 . . . . . 0 N--CA 1.464 0.245 0 CA-C-N 117.972 0.351 . . . . 28.64 111.285 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.681 0.277 . . . . 55.67 111.519 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.12 -33.0 73.69 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.247 -0.581 . . . . 55.6 111.186 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.53 ' HE3' ' HE1' ' B' ' 120' ' ' PHE . 23.2 tttp -74.97 -39.48 61.26 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.597 -0.441 . . . . 42.9 111.362 179.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.79 -34.53 76.06 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.722 -0.791 . . . . 38.53 111.161 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.34 -44.18 88.53 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.637 -0.425 . . . . 47.55 111.015 -177.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 26.0 mttt -65.96 -38.93 89.85 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.695 -0.402 . . . . 42.76 111.001 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' MET . . . . . 0.447 ' SD ' ' CD1' ' B' ' 94' ' ' LEU . 6.1 tpp -57.98 -43.38 86.51 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 120.781 0.324 . . . . 39.46 111.386 177.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 94.4 mt -72.16 -39.74 68.49 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.634 -0.826 . . . . 32.01 111.385 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.89 -39.92 79.05 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.195 -0.602 . . . . 44.93 111.295 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -86.16 -19.92 29.38 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.766 1.024 . . . . 43.06 113.766 -175.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LEU . . . . . 0.447 ' CD1' ' SD ' ' B' ' 90' ' ' MET . 1.7 mt -121.29 -22.45 6.02 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 114.424 1.268 . . . . 35.26 114.424 -171.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 8.3 tp -83.24 101.0 10.95 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.597 -0.89 . . . . 26.14 108.597 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.5 t -78.52 -40.0 24.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 116.136 -0.484 . . . . 25.1 110.351 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 97.1 p -161.13 160.17 29.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.354 0.597 . . . . 23.09 109.511 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 75.8 t -127.84 135.47 62.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 108.345 -0.983 . . . . 21.55 108.345 173.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -133.97 -172.3 2.95 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.948 -0.76 . . . . 20.53 108.948 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -165.17 157.81 15.92 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.06 -0.718 . . . . 20.03 109.06 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.9 t -161.31 130.79 4.73 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 106.795 -1.557 . . . . 19.86 106.795 162.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 57.48 -128.25 46.99 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 110.212 -1.155 . . . . 19.81 110.212 -177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -96.08 21.79 8.35 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.849 0.685 . . . . 29.04 112.849 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 34.3 mt -121.42 128.5 75.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.546 -0.909 . . . . 24.0 108.546 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -97.27 134.22 40.85 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.55 -0.907 . . . . 17.43 108.55 163.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 99.7 t -108.71 127.79 64.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.325 -0.852 . . . . 15.06 109.139 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 5.9 mt -107.82 130.91 54.95 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.693 0.797 . . . . 14.7 109.294 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 45.0 mmm-85 -107.62 136.5 47.28 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.988 -0.745 . . . . 32.7 108.988 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -124.16 173.05 4.99 Favored Pre-proline 0 C--O 1.235 0.305 0 C-N-CA 123.694 0.797 . . . . 19.11 111.041 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -64.7 170.7 9.53 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 N-CA-C 108.886 -1.236 . . . . 14.82 108.886 166.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -60.2 139.75 88.75 Favored 'Trans proline' 0 C--O 1.241 0.637 0 CA-C-O 122.377 0.907 . . . . 17.91 112.583 -175.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . 0.661 ' O ' ' O ' ' B' ' 301' ' ' HOH . . . 69.84 -1.34 16.68 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 114.679 -1.146 . . . . 20.42 115.539 -178.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.34 -15.08 81.74 Favored Glycine 0 C--N 1.333 0.393 0 N-CA-C 116.351 1.301 . . . . 17.59 116.351 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.466 ' HB3' ' HD3' ' B' ' 115' ' ' PRO . . . -63.05 -54.29 47.51 Favored Pre-proline 0 C--O 1.243 0.761 0 CA-C-N 118.832 1.316 . . . . 12.98 112.932 -168.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' B' ' 114' ' ' ALA . 15.0 Cg_exo -65.25 -25.22 57.48 Favored 'Trans proline' 0 C--N 1.344 0.303 0 CA-C-N 121.798 1.678 . . . . 12.89 113.981 178.36 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' PHE . . . . . 0.44 ' CD2' HD11 ' B' ' 94' ' ' LEU . 24.0 t80 -63.69 -52.84 58.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.189 0.904 . . . . 18.77 110.367 173.747 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.17 -49.05 77.35 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 122.173 -0.33 . . . . 23.07 111.593 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.08 -40.67 87.05 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 112.189 0.44 . . . . 14.0 112.189 -169.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 77.4 p -61.64 -39.02 89.83 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.902 -0.719 . . . . 21.42 110.881 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' PHE . . . . . 0.53 ' HE1' ' HE3' ' B' ' 86' ' ' LYS . 31.9 t80 -63.45 -39.91 95.74 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.174 -1.01 . . . . 27.35 111.349 175.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 44.2 mt -61.7 -45.94 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.707 -0.797 . . . . 19.39 110.185 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.48 ' OD2' ' N ' ' B' ' 201' ' ' TYR . 87.7 m-20 -50.87 -46.28 60.3 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.2 0.524 . . . . 18.08 111.118 174.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -40.51 84.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.046 -0.525 . . . . 31.67 111.115 -176.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 65.3 t -54.16 -49.47 61.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-O 121.294 0.569 . . . . 26.2 109.968 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 76.48 56.61 4.19 Favored Glycine 0 N--CA 1.45 -0.407 0 O-C-N 121.988 -0.445 . . . . 27.21 113.74 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' MET . . . . . . . . . . . . . 28.8 mtt -76.48 140.69 41.33 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 119.819 -0.752 . . . . 28.07 109.467 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -63.67 -35.31 80.12 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.893 -0.594 . . . . 27.82 111.268 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -78.52 -7.19 57.23 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 113.386 0.884 . . . . 19.23 113.386 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' VAL . . . . . 0.449 HG22 HD21 ' B' ' 152' ' ' LEU . 71.2 t -92.58 105.65 16.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.828 -1.175 . . . . 18.41 107.828 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 99.1 t -65.59 -39.78 86.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.535 0.683 . . . . 15.94 109.788 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 179.56 168.08 37.88 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 109.312 -1.515 . . . . 15.36 109.312 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' THR . . . . . . . . . . . . . 25.4 p -129.67 145.37 51.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.917 1.287 . . . . 14.81 108.249 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 38.1 mm -124.05 132.5 71.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.26 -1.385 . . . . 17.43 107.26 166.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -105.34 134.06 49.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.355 -0.384 . . . . 14.66 110.011 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -95.09 -123.24 3.98 Favored Glycine 0 C--N 1.333 0.392 0 N-CA-C 109.215 -1.554 . . . . 16.1 109.215 164.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -97.77 -49.07 4.96 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 118.315 1.057 . . . . 14.26 111.944 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -132.85 14.14 4.35 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 121.812 -0.555 . . . . 18.6 111.074 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' THR . . . . . . . . . . . . . 87.5 m -135.79 139.09 43.25 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.483 -1.303 . . . . 12.97 107.483 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 64.9 t -123.95 128.2 74.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.101 -1.074 . . . . 15.3 108.101 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -96.28 122.58 39.3 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 106.957 -1.497 . . . . 17.25 106.957 170.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 18.7 t -115.61 116.02 51.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 107.843 -1.169 . . . . 14.52 107.843 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' LEU . . . . . . . . . . . . . 41.6 tp -87.73 120.68 29.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 17.36 110.169 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -84.78 141.9 30.18 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.2 -0.6 . . . . 15.1 109.756 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 57.0 ttm-85 -79.1 125.6 29.63 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.45 -0.341 . . . . 24.11 110.112 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.28 138.51 57.9 Favored Pre-proline 0 C--O 1.237 0.405 0 CA-C-N 115.946 -0.57 . . . . 30.82 109.695 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -92.18 19.0 38.29 Favored 'Cis proline' 0 CA--C 1.534 0.514 0 N-CA-C 115.242 1.208 . . . . 25.05 115.242 3.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' MET . . . . . . . . . . . . . 54.6 ttm -75.31 143.45 42.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.296 0.953 . . . . 23.9 110.417 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.3 p -94.01 159.88 14.97 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.687 0.756 . . . . 21.37 110.871 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.43 77.56 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-N 115.131 -0.941 . . . . 21.03 112.943 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.83 -45.62 91.73 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.196 0.498 . . . . 30.36 110.897 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -63.87 -41.63 97.7 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.356 -0.215 . . . . 26.49 111.502 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' LEU . . . . . 0.449 HD21 HG22 ' B' ' 129' ' ' VAL . 7.0 tp -68.27 -36.08 78.85 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.134 -1.026 . . . . 20.43 110.722 -179.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -68.12 -33.63 79.14 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.343 -0.932 . . . . 25.73 112.945 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.5 -38.91 88.27 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.53 0.665 . . . . 36.36 111.275 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -65.27 -43.21 91.97 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.437 -0.505 . . . . 27.25 110.749 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.48 -41.31 93.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.215 -0.194 . . . . 34.5 111.461 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 9.6 m -64.07 -34.83 78.92 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.918 -0.713 . . . . 39.41 110.854 177.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -57.74 -54.94 41.26 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.87 0.367 . . . . 44.65 111.308 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.85 0.357 . . . . 48.35 110.944 177.239 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' TYR . . . . . . . . . . . . . 17.2 p90 . . . . . 0 C--O 1.245 0.847 0 N-CA-C 111.591 0.219 . . . . 15.83 111.591 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' TYR . . . . . 0.48 ' N ' ' OD2' ' B' ' 122' ' ' ASP . 13.5 p90 . . . . . 0 C--O 1.234 0.275 0 N-CA-C 113.305 0.854 . . . . 16.62 113.305 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.661 ' O ' ' O ' ' B' ' 112' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_