data_1cnr_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1cnr _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . 0.317 60.0 m . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 105.275 -2.12 . . . . 7.95 105.275 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.449 79.0 p -103.88 142.47 34.35 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 126.334 2.271 . . . . 5.56 109.017 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.8 m -132.17 139.51 48.4 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 125.737 1.898 . . . . 5.47 107.862 178.574 -49.397 -73.186 -80.884 102.213 2.036 102.182 -69.828 -64.76 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.2 m -125.09 148.04 59.01 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-O 122.013 0.911 . . . . 3.3 111.665 -177.708 -67.095 -80.457 105.661 103.648 2.047 105.639 -113.488 -58.152 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.5 -19.11 15.11 Favored 'Trans proline' 0 CA--C 1.491 -1.671 0 C-N-CA 120.919 1.079 . . . . 3.71 114.891 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 71.6 p -157.66 166.16 33.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.779 -0.823 . . . . 3.26 108.779 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -61.31 -46.7 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 125.594 1.809 . . . . 11.93 110.446 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . 1.498 ' CB ' ' CA ' ' A' ' 8' ' ' VAL 0.486 24.9 t -65.48 -34.62 71.7 Favored 'Isoleucine or valine' 0 C--O 1.252 1.195 0 C-N-CA 115.035 -2.666 . . . . 11.68 111.697 -176.916 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.81 -44.36 94.03 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 118.441 -1.304 . . . . 3.35 110.387 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -61.6 -41.6 97.67 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 118.917 -1.113 . . . . 4.82 113.166 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.0 m -63.16 -41.3 99.23 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 119.456 -0.897 . . . . 3.51 110.63 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . 0.375 95.3 m-20 -67.74 -35.96 79.7 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.02 -0.991 . . . . 7.66 110.997 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -59.87 -47.16 86.88 Favored 'General case' 0 C--O 1.243 0.761 0 O-C-N 125.132 1.52 . . . . 6.68 111.87 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -65.49 -34.67 78.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.184 -1.371 . . . . 11.47 112.089 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.57 -44.8 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 117.421 -1.712 . . . . 5.94 112.02 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.18 -36.93 53.17 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.491 -0.777 . . . . 8.52 111.621 175.909 177.954 -92.477 -85.631 103.248 2.058 103.485 -57.124 -65.06 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -76.31 -19.67 58.03 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 115.566 1.691 . . . . 5.38 115.566 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.1 mt -53.8 -44.91 98.85 Favored Pre-proline 0 C--O 1.258 1.539 0 CA-C-O 117.401 -1.285 . . . . 5.58 112.345 -174.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -75.5 -6.16 17.4 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 CA-C-N 120.657 1.27 . . . . 5.76 115.327 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.68 7.23 42.5 Favored Glycine 0 CA--C 1.54 1.641 0 O-C-N 124.416 1.073 . . . . 2.76 115.69 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.7 m -47.94 134.74 11.43 Favored Pre-proline 0 C--O 1.252 1.186 0 CA-C-O 117.16 -1.4 . . . . 2.83 111.955 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.51 142.86 29.47 Favored 'Trans proline' 0 C--O 1.264 1.788 0 CA-C-N 121.557 1.592 . . . . 6.39 113.334 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . 0.401 ' HB3' HD13 ' A' ' 34' ' ' ILE . 93.6 mt-10 -55.87 -37.37 68.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 117.345 -1.312 . . . . 10.03 113.592 175.969 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.28 -37.37 82.9 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 126.199 2.187 . . . . 2.92 112.098 -177.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 mt -73.59 -38.57 65.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.261 -0.427 . . . . 5.65 111.9 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.7 m -64.83 -31.27 72.43 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 116.49 -2.084 . . . . 2.38 111.33 175.536 -65.06 -57.124 -85.631 103.485 2.058 103.248 -92.477 177.954 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.0 -54.65 35.06 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 124.446 1.091 . . . . 5.94 111.955 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.9 p -66.26 -26.74 67.49 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 117.441 -1.704 . . . . 7.31 112.782 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -68.96 -31.27 70.01 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 124.898 1.374 . . . . 6.19 112.874 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.9 p -111.85 -17.64 12.88 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 118.701 2.852 . . . . 6.21 118.701 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 89.04 -4.61 84.75 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 119.441 -1.361 . . . . 3.59 114.457 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.3 m -66.77 168.01 10.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.801 0.81 . . . . 6.54 109.117 169.042 -58.152 -113.488 105.661 105.639 2.047 103.648 -80.457 -67.095 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.2 pt -136.49 156.35 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 114.299 -1.319 . . . . 8.05 109.269 -175.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . 0.416 HD11 HG22 ' A' ' 34' ' ' ILE 0.448 87.3 mt -107.52 126.82 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.618 0 CA-C-N 113.793 -1.549 . . . . 7.64 107.167 171.292 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 45.9 pt -121.17 153.84 58.22 Favored Pre-proline 0 N--CA 1.473 0.705 0 O-C-N 124.277 0.986 . . . . 7.01 108.722 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -74.89 -26.13 11.44 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 O-C-N 122.187 0.572 . . . . 10.33 113.398 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -85.65 -164.86 39.68 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 126.92 2.638 . . . . 11.52 110.454 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -122.66 3.28 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 113.825 1.046 . . . . 8.66 113.825 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.505 39.4 m -111.26 97.97 7.16 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.567 1.792 . . . . 6.18 109.115 -172.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 89.4 m -72.02 139.56 82.59 Favored Pre-proline 0 C--O 1.247 0.958 0 CA-C-N 114.954 -1.021 . . . . 5.16 110.162 179.269 -64.76 -69.828 -80.884 102.182 2.036 102.213 -73.186 -49.397 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.95 165.14 33.61 Favored 'Trans proline' 0 C--O 1.259 1.532 0 C-N-CA 124.174 3.25 . . . . 10.71 111.2 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.76 -24.32 68.04 Favored Glycine 0 CA--C 1.539 1.541 0 CA-C-O 118.22 -1.322 . . . . 7.7 115.332 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -90.72 1.16 57.1 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 127.328 2.428 . . . . 8.83 114.635 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.98 58.89 1.69 Allowed 'General case' 0 CA--C 1.547 0.853 0 O-C-N 125.096 1.498 . . . . 7.68 107.294 171.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.57 -7.24 58.53 Favored 'General case' 0 C--O 1.242 0.693 0 O-C-N 127.187 2.804 . . . . 10.33 116.062 -167.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.9 m120 . . . . . 0 C--O 1.263 1.767 0 O-C-N 125.862 1.976 . . . . 9.55 111.228 -172.794 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . 0.317 60.0 m . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 105.275 -2.12 . . . . 12.71 105.275 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.449 79.0 p -103.88 142.47 34.35 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 126.334 2.271 . . . . 5.99 109.017 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.8 m -132.17 139.51 48.4 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 125.737 1.898 . . . . 3.48 107.862 178.574 -49.397 -73.186 -80.884 102.213 2.036 102.182 -69.828 -64.76 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.2 m -125.09 148.04 59.01 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-O 122.013 0.911 . . . . 2.53 111.665 -177.708 -67.095 -80.457 105.661 103.648 2.047 105.639 -113.488 -58.152 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.5 -19.11 15.11 Favored 'Trans proline' 0 CA--C 1.491 -1.671 0 C-N-CA 120.919 1.079 . . . . 3.71 114.891 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 71.6 p -157.66 166.16 33.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.779 -0.823 . . . . 3.26 108.779 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -61.31 -46.7 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 125.594 1.809 . . . . 11.93 110.446 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . 1.498 ' CB ' ' CA ' ' A' ' 8' ' ' VAL 0.486 24.9 t -65.48 -34.62 71.7 Favored 'Isoleucine or valine' 0 C--O 1.252 1.195 0 C-N-CA 115.035 -2.666 . . . . 4.98 111.697 -176.916 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.81 -44.36 94.03 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 118.441 -1.304 . . . . 2.9 110.387 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -61.6 -41.6 97.67 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 118.917 -1.113 . . . . 7.7 113.166 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.0 m -63.16 -41.3 99.23 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 119.456 -0.897 . . . . 3.01 110.63 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . 0.375 95.3 m-20 -67.74 -35.96 79.7 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.02 -0.991 . . . . 4.16 110.997 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -59.87 -47.16 86.88 Favored 'General case' 0 C--O 1.243 0.761 0 O-C-N 125.132 1.52 . . . . 4.99 111.87 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -65.49 -34.67 78.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.184 -1.371 . . . . 3.52 112.089 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.57 -44.8 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 117.421 -1.712 . . . . 2.75 112.02 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.18 -36.93 53.17 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.491 -0.777 . . . . 2.28 111.621 175.909 177.954 -92.477 -85.631 103.248 2.058 103.485 -57.124 -65.06 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -76.31 -19.67 58.03 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 115.566 1.691 . . . . 3.36 115.566 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.1 mt -53.8 -44.91 98.85 Favored Pre-proline 0 C--O 1.258 1.539 0 CA-C-O 117.401 -1.285 . . . . 3.53 112.345 -174.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -75.5 -6.16 17.4 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 CA-C-N 120.657 1.27 . . . . 4.45 115.327 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.68 7.23 42.5 Favored Glycine 0 CA--C 1.54 1.641 0 O-C-N 124.416 1.073 . . . . 2.76 115.69 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.7 m -47.94 134.74 11.43 Favored Pre-proline 0 C--O 1.252 1.186 0 CA-C-O 117.16 -1.4 . . . . 2.78 111.955 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.51 142.86 29.47 Favored 'Trans proline' 0 C--O 1.264 1.788 0 CA-C-N 121.557 1.592 . . . . 5.63 113.334 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -55.87 -37.37 68.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 117.345 -1.312 . . . . 6.85 113.592 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.28 -37.37 82.9 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 126.199 2.187 . . . . 2.92 112.098 -177.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 mt -73.59 -38.57 65.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.261 -0.427 . . . . 3.37 111.9 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.7 m -64.83 -31.27 72.43 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 116.49 -2.084 . . . . 2.38 111.33 175.536 -65.06 -57.124 -85.631 103.485 2.058 103.248 -92.477 177.954 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.0 -54.65 35.06 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 124.446 1.091 . . . . 2.3 111.955 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.9 p -66.26 -26.74 67.49 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 117.441 -1.704 . . . . 3.57 112.782 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -68.96 -31.27 70.01 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 124.898 1.374 . . . . 5.35 112.874 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.9 p -111.85 -17.64 12.88 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 118.701 2.852 . . . . 3.39 118.701 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 89.04 -4.61 84.75 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 119.441 -1.361 . . . . 3.59 114.457 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.3 m -66.77 168.01 10.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.801 0.81 . . . . 2.79 109.117 169.042 -58.152 -113.488 105.661 105.639 2.047 103.648 -80.457 -67.095 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.2 pt -136.49 156.35 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 114.299 -1.319 . . . . 4.84 109.269 -175.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . 0.448 87.3 mt -107.52 126.82 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.618 0 CA-C-N 113.793 -1.549 . . . . 8.51 107.167 171.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 45.9 pt -121.17 153.84 58.22 Favored Pre-proline 0 N--CA 1.473 0.705 0 O-C-N 124.277 0.986 . . . . 7.01 108.722 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -74.89 -26.13 11.44 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 O-C-N 122.187 0.572 . . . . 7.23 113.398 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -85.65 -164.86 39.68 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 126.92 2.638 . . . . 6.8 110.454 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -122.66 3.28 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 113.825 1.046 . . . . 8.06 113.825 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.505 39.4 m -111.26 97.97 7.16 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.567 1.792 . . . . 7.21 109.115 -172.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 89.4 m -72.02 139.56 82.59 Favored Pre-proline 0 C--O 1.247 0.958 0 CA-C-N 114.954 -1.021 . . . . 5.16 110.162 179.269 -64.76 -69.828 -80.884 102.182 2.036 102.213 -73.186 -49.397 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.95 165.14 33.61 Favored 'Trans proline' 0 C--O 1.259 1.532 0 C-N-CA 124.174 3.25 . . . . 7.12 111.2 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.76 -24.32 68.04 Favored Glycine 0 CA--C 1.539 1.541 0 CA-C-O 118.22 -1.322 . . . . 5.51 115.332 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -90.72 1.16 57.1 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 127.328 2.428 . . . . 7.82 114.635 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.98 58.89 1.69 Allowed 'General case' 0 CA--C 1.547 0.853 0 O-C-N 125.096 1.498 . . . . 3.68 107.294 171.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.57 -7.24 58.53 Favored 'General case' 0 C--O 1.242 0.693 0 O-C-N 127.187 2.804 . . . . 3.85 116.062 -167.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.9 m120 . . . . . 0 C--O 1.263 1.767 0 O-C-N 125.862 1.976 . . . . 7.62 111.228 -172.794 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . 0.317 60.0 m . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 105.275 -2.12 . . . . 12.71 105.275 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.449 79.0 p -103.88 142.47 34.35 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 126.334 2.271 . . . . 5.99 109.017 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.8 m -132.17 139.51 48.4 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 125.737 1.898 . . . . 3.48 107.862 178.574 -49.397 -73.186 -80.884 102.213 2.036 102.182 -69.828 -64.76 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.2 m -125.09 148.04 59.01 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-O 122.013 0.911 . . . . 2.53 111.665 -177.708 -67.095 -80.457 105.661 103.648 2.047 105.639 -113.488 -58.152 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.5 -19.11 15.11 Favored 'Trans proline' 0 CA--C 1.491 -1.671 0 C-N-CA 120.919 1.079 . . . . 3.71 114.891 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 71.6 p -157.66 166.16 33.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.779 -0.823 . . . . 3.26 108.779 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -61.31 -46.7 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 125.594 1.809 . . . . 11.93 110.446 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . 1.498 ' CB ' ' CA ' ' A' ' 8' ' ' VAL 0.486 24.9 t -65.48 -34.62 71.7 Favored 'Isoleucine or valine' 0 C--O 1.252 1.195 0 C-N-CA 115.035 -2.666 . . . . 4.98 111.697 -176.916 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.81 -44.36 94.03 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 118.441 -1.304 . . . . 2.9 110.387 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -61.6 -41.6 97.67 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 118.917 -1.113 . . . . 7.7 113.166 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.0 m -63.16 -41.3 99.23 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 119.456 -0.897 . . . . 3.01 110.63 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . 0.375 95.3 m-20 -67.74 -35.96 79.7 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.02 -0.991 . . . . 4.16 110.997 177.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -59.87 -47.16 86.88 Favored 'General case' 0 C--O 1.243 0.761 0 O-C-N 125.132 1.52 . . . . 4.99 111.87 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -65.49 -34.67 78.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.184 -1.371 . . . . 3.52 112.089 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.57 -44.8 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 117.421 -1.712 . . . . 2.75 112.02 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.18 -36.93 53.17 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.491 -0.777 . . . . 2.28 111.621 175.909 177.954 -92.477 -85.631 103.248 2.058 103.485 -57.124 -65.06 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -76.31 -19.67 58.03 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 115.566 1.691 . . . . 3.36 115.566 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.1 mt -53.8 -44.91 98.85 Favored Pre-proline 0 C--O 1.258 1.539 0 CA-C-O 117.401 -1.285 . . . . 3.53 112.345 -174.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -75.5 -6.16 17.4 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 CA-C-N 120.657 1.27 . . . . 4.45 115.327 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.68 7.23 42.5 Favored Glycine 0 CA--C 1.54 1.641 0 O-C-N 124.416 1.073 . . . . 2.76 115.69 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.7 m -47.94 134.74 11.43 Favored Pre-proline 0 C--O 1.252 1.186 0 CA-C-O 117.16 -1.4 . . . . 2.78 111.955 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.51 142.86 29.47 Favored 'Trans proline' 0 C--O 1.264 1.788 0 CA-C-N 121.557 1.592 . . . . 5.63 113.334 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -55.87 -37.37 68.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 117.345 -1.312 . . . . 6.85 113.592 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.28 -37.37 82.9 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 126.199 2.187 . . . . 2.92 112.098 -177.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 mt -73.59 -38.57 65.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.261 -0.427 . . . . 3.37 111.9 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.7 m -64.83 -31.27 72.43 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 116.49 -2.084 . . . . 2.38 111.33 175.536 -65.06 -57.124 -85.631 103.485 2.058 103.248 -92.477 177.954 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.0 -54.65 35.06 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 124.446 1.091 . . . . 2.3 111.955 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.9 p -66.26 -26.74 67.49 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 117.441 -1.704 . . . . 3.57 112.782 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -68.96 -31.27 70.01 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 124.898 1.374 . . . . 5.35 112.874 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.9 p -111.85 -17.64 12.88 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 118.701 2.852 . . . . 3.39 118.701 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 89.04 -4.61 84.75 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 119.441 -1.361 . . . . 3.59 114.457 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.3 m -66.77 168.01 10.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.801 0.81 . . . . 2.79 109.117 169.042 -58.152 -113.488 105.661 105.639 2.047 103.648 -80.457 -67.095 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.2 pt -136.49 156.35 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 114.299 -1.319 . . . . 4.84 109.269 -175.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . 0.448 87.3 mt -107.52 126.82 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.618 0 CA-C-N 113.793 -1.549 . . . . 8.51 107.167 171.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 45.9 pt -121.17 153.84 58.22 Favored Pre-proline 0 N--CA 1.473 0.705 0 O-C-N 124.277 0.986 . . . . 7.01 108.722 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -74.89 -26.13 11.44 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 O-C-N 122.187 0.572 . . . . 7.23 113.398 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -85.65 -164.86 39.68 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 126.92 2.638 . . . . 6.8 110.454 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -122.66 3.28 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 113.825 1.046 . . . . 8.06 113.825 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.505 39.4 m -111.26 97.97 7.16 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.567 1.792 . . . . 7.21 109.115 -172.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 89.4 m -72.02 139.56 82.59 Favored Pre-proline 0 C--O 1.247 0.958 0 CA-C-N 114.954 -1.021 . . . . 5.16 110.162 179.269 -64.76 -69.828 -80.884 102.182 2.036 102.213 -73.186 -49.397 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.95 165.14 33.61 Favored 'Trans proline' 0 C--O 1.259 1.532 0 C-N-CA 124.174 3.25 . . . . 7.12 111.2 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.76 -24.32 68.04 Favored Glycine 0 CA--C 1.539 1.541 0 CA-C-O 118.22 -1.322 . . . . 5.51 115.332 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -90.72 1.16 57.1 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 127.328 2.428 . . . . 7.82 114.635 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.98 58.89 1.69 Allowed 'General case' 0 CA--C 1.547 0.853 0 O-C-N 125.096 1.498 . . . . 3.68 107.294 171.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.57 -7.24 58.53 Favored 'General case' 0 C--O 1.242 0.693 0 O-C-N 127.187 2.804 . . . . 3.85 116.062 -167.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.9 m120 . . . . . 0 C--O 1.263 1.767 0 O-C-N 125.862 1.976 . . . . 7.62 111.228 -172.794 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_