data_2lir_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 2lir _Structure_validation_residue.Date_analyzed 2016-10-07 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 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.273 0.558 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.565 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.55 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.55 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.51 ' ND1' ' CD2' ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.751 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.417 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.751 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.51 ' CD2' ' ND1' ' A' ' 18' ' ' HIS . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.426 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.45 ' O ' ' CD1' ' A' ' 53' ' ' ILE . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.45 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.569 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.593 ' C ' ' H ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.472 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.252 0.549 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.404 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.62 ' ND1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.62 ' H ' ' ND1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.575 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.575 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.455 ' CD2' ' ND2' ' A' ' 52' ' ' ASN . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.585 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.585 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.455 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 44.8 t-20 -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.457 ' O ' ' OG ' ' A' ' 65' ' ' SER . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.459 ' HG ' ' N ' ' A' ' 66' ' ' GLU . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.459 ' N ' ' HG ' ' A' ' 65' ' ' SER . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.58 ' C ' ' H ' ' A' ' 72' ' ' ALA . 35.8 t30 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.58 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.525 ' CB ' ' HZ1' ' A' ' 5' ' ' LYS . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.529 ' CE ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.525 ' HZ1' ' CB ' ' A' ' 2' ' ' SER . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.44 ' O ' ' OG1' ' A' ' 12' ' ' THR . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 8' ' ' THR . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.559 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.527 ' O ' ' CG1' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.559 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.686 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.686 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.555 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.596 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.678 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.555 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.437 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.496 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.421 ' N ' HD21 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.576 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.576 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.418 ' O ' ' CG2' ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.48 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 9' ' ' LEU . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.487 ' O ' ' O ' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.487 ' O ' ' O ' ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.597 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' ' HB3' ' A' ' 18' ' ' HIS . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.586 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.418 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.597 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.449 HG23 HD13 ' A' ' 53' ' ' ILE . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.578 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.587 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.429 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.522 ' HH ' ' CD2' ' A' ' 71' ' ' HIS . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.647 ' HG1' HH11 ' A' ' 91' ' ' ARG . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.522 ' CD2' ' HH ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.647 HH11 ' HG1' ' A' ' 69' ' ' THR . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.41 ' O ' ' OG1' ' A' ' 96' ' ' THR . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.587 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.461 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.434 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.413 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.666 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.666 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.557 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 17.2 m80 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.416 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.561 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.463 ' OH ' ' CD2' ' A' ' 32' ' ' LEU . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.481 ' O ' ' OG1' ' A' ' 69' ' ' THR . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.589 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.482 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.404 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.494 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.494 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.247 0.546 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.574 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.719 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.499 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.563 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.517 ' CG1' ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.517 ' N ' ' CG1' ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.719 ' ND2' ' H ' ' A' ' 19' ' ' THR . 19.5 m120 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.623 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.468 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.406 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.563 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.447 ' O ' ' CD1' ' A' ' 53' ' ' ILE . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.447 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.445 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.568 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.463 ' O ' ' OG ' ' A' ' 65' ' ' SER . 24.4 m120 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 21.8 t30 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.545 ' O ' ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.417 ' HB2' HD21 ' A' ' 70' ' ' ASN . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.45 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.568 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.515 ' C ' ' HG ' ' A' ' 2' ' ' SER . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.515 ' HG ' ' C ' ' A' ' 1' ' ' GLY . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.723 ' H ' ' NZ ' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.421 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.668 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.668 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.753 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.753 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.585 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.685 ' NE2' ' NE ' ' A' ' 38' ' ' ARG . 22.8 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.589 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.592 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.491 ' CD2' ' ND2' ' A' ' 52' ' ' ASN . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.491 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 48.5 t-20 -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.488 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.499 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.49 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.597 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.486 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.4 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.597 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.591 ' CE2' ' CG1' ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.591 ' CG1' ' CE2' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CB ' ' CE1' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.534 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.474 ' N ' ' O ' ' A' ' 14' ' ' CYS . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.687 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.687 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.62 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.561 ' C ' ' H ' ' A' ' 37' ' ' GLY . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.561 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.41 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.64 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.436 ' HG1' ' CE ' ' A' ' 79' ' ' LYS . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.413 ' CE3' ' HG2' ' A' ' 64' ' ' MET . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.458 ' O ' ' OG1' ' A' ' 69' ' ' THR . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.743 HD21 ' H ' ' A' ' 73' ' ' LYS . 23.5 t30 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.523 ' H ' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.583 ' H ' HD21 ' A' ' 70' ' ' ASN . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.743 ' H ' HD21 ' A' ' 70' ' ' ASN . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.436 ' CE ' ' HG1' ' A' ' 49' ' ' THR . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.43 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.436 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.459 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.469 ' CE1' ' CG1' ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.404 HG21 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.404 ' H ' HG21 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.715 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.715 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.508 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.616 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.616 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.654 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.508 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.426 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.578 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.466 ' C ' HD21 ' A' ' 56' ' ' ASN . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.414 ' HG ' ' CD1' ' A' ' 95' ' ' ILE . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.509 ' C ' ' H ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.509 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.426 ' CE ' ' OG1' ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.459 ' O ' ' CB ' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 84' ' ' GLY . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 92' ' ' ASN . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.508 ' O ' ' OG1' ' A' ' 96' ' ' THR . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.414 ' CD1' ' HG ' ' A' ' 65' ' ' SER . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.459 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.261 0.553 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.46 ' HG1' ' N ' ' A' ' 9' ' ' LEU . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.46 ' N ' ' HG1' ' A' ' 8' ' ' THR . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.602 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.626 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.626 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.602 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 38.6 t60 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 24.7 m80 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.47 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.426 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.665 ' CD1' ' N ' ' A' ' 47' ' ' SER . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.443 ' CG2' ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.65 ' CG ' ' N ' ' A' ' 83' ' ' GLY . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.443 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.177 0.513 . . . . 0.0 109.661 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.585 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.439 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.585 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.439 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.576 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.468 ' O ' ' CE2' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.43 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.534 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.422 ' HB2' HD21 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.552 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.612 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' NZ ' ' CG2' ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' CG1' ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.533 ' N ' ' CG1' ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.608 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.632 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.612 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.589 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 55' ' ' LYS . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.488 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.454 ' CG1' ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.656 ' O ' ' ND1' ' A' ' 71' ' ' HIS . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.51 ' CB ' ' O ' ' A' ' 71' ' ' HIS . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.454 ' OH ' ' CG1' ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' ' CE1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.292 0.568 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HZ1' ' HZ3' ' A' ' 89' ' ' LYS . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.416 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.433 ' H ' ' HA ' ' A' ' 31' ' ' ASN . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.417 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.433 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.518 ' O ' ' O ' ' A' ' 59' ' ' TRP . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 16.5 m80 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.406 ' HA3' ' NE2' ' A' ' 26' ' ' HIS . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.467 ' CD2' ' N ' ' A' ' 41' ' ' GLY . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.593 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.47 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 9.7 m80 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.477 ' CB ' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.477 ' OG1' ' CB ' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.406 ' HZ3' ' HZ1' ' A' ' 5' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.476 ' O ' ' OG1' ' A' ' 96' ' ' THR . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.476 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.51 ' CE1' ' CG1' ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.502 ' ND1' ' CD2' ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.51 ' CG1' ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.472 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.576 ' C ' ' HD1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.559 ' CD2' ' H ' ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.407 ' OH ' ' CD1' ' A' ' 32' ' ' LEU . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 55' ' ' LYS . 41.0 t-20 -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.552 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 61' ' ' GLU . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.629 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.629 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.49 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.453 ' O ' ' OG1' ' A' ' 96' ' ' THR . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.404 ' H ' ' HE2' ' A' ' 4' ' ' LYS . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.601 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.446 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.413 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.576 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.575 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.576 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.575 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.439 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 41.5 t-20 -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.563 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.485 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.491 ' HG ' ' CD1' ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.52 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.626 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.436 ' CD2' ' HH ' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.626 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.524 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 65' ' ' SER . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.462 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.687 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.549 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.409 ' CD2' ' OH ' ' A' ' 48' ' ' TYR . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.687 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.409 ' OH ' ' CD2' ' A' ' 32' ' ' LEU . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.656 ' HG1' ' CE ' ' A' ' 79' ' ' LYS . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.492 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.41 ' H ' ' HB2' ' A' ' 40' ' ' SER . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.591 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.558 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.558 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.409 ' OH ' ' CG1' ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.404 ' HB ' ' HG1' ' A' ' 78' ' ' THR . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.536 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.656 ' CE ' ' HG1' ' A' ' 49' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.523 ' O ' ' CB ' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.523 ' CB ' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.449 ' O ' ' OG1' ' A' ' 96' ' ' THR . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.591 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' -2' ' ' LYS . 40.9 p90 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.243 0.545 . . . . 0.0 109.562 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.591 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.679 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.602 ' H ' ' ND1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.433 ' CG ' ' H ' ' A' ' 33' ' ' HIS . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.433 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.428 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.679 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.403 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 62.6 t-20 -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.428 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.414 ' O ' ' OG ' ' A' ' 65' ' ' SER . 26.3 m120 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.499 ' O ' ' O ' ' A' ' 70' ' ' ASN . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.5 ' CG2' ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 10.6 m80 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.458 ' CB ' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.458 ' OG1' ' CB ' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.466 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.5 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.234 0.54 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.537 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.451 ' HB2' HD21 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.565 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.488 ' O ' ' CG1' ' A' ' 20' ' ' VAL . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.659 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.659 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.487 ' HD1' ' CG1' ' A' ' 20' ' ' VAL . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.415 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.587 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.427 ' HD1' ' HB1' ' A' ' 72' ' ' ALA . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB1' ' HD1' ' A' ' 71' ' ' HIS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' A' ' 70' ' ' ASN . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . 0.504 ' O ' ' OD1' ' A' ' 93' ' ' ASP . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.642 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.258 0.552 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.592 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.408 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.571 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.586 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.586 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.559 ' O ' ' CB ' ' A' ' 33' ' ' HIS . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.429 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.471 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.588 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 53' ' ' ILE . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.579 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.429 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.487 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 67' ' ' TYR . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.687 HD21 ' H ' ' A' ' 73' ' ' LYS . 29.4 t30 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.46 ' O ' ' OH ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.522 ' H ' ' ND2' ' A' ' 70' ' ' ASN . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.687 ' H ' HD21 ' A' ' 70' ' ' ASN . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.509 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.509 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.407 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.421 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.49 ' OG1' ' OD1' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.63 ' HE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.561 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.411 ' CD2' ' CE1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.606 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.63 ' N ' ' HE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.521 ' CD2' ' ND2' ' A' ' 52' ' ' ASN . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 53' ' ' ILE . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.497 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.406 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.504 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.49 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.449 ' O ' ' OG ' ' A' ' 65' ' ' SER . 2.9 m120 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.721 HD21 ' N ' ' A' ' 73' ' ' LYS . 12.2 t30 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.721 ' N ' HD21 ' A' ' 70' ' ' ASN . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.424 ' H ' ' C ' ' A' ' 84' ' ' GLY . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.405 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -101.37 139.36 37.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 109.421 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -101.04 129.87 46.96 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.237 -0.914 . . . . 0.0 109.672 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.565 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.55 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.55 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.51 ' ND1' ' CD2' ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.751 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.417 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.751 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.51 ' CD2' ' ND1' ' A' ' 18' ' ' HIS . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.426 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.45 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.569 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.593 ' C ' ' H ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.472 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.596 ' O1A' ' CZ ' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -109.06 155.4 20.99 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.363 -0.836 . . . . 0.0 109.521 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -134.25 160.58 37.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.588 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.405 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.404 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.62 ' ND1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.62 ' H ' ' ND1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.575 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.575 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.489 ' OH ' ' O1A' ' A' ' 104' ' ' HEC . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.585 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.585 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.664 HD21 ' CGD' ' A' ' 104' ' ' HEC . 44.8 t-20 -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.457 ' O ' ' OG ' ' A' ' 65' ' ' SER . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.459 ' HG ' ' N ' ' A' ' 66' ' ' GLU . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.459 ' N ' ' HG ' ' A' ' 65' ' ' SER . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.58 ' C ' ' H ' ' A' ' 72' ' ' ALA . 35.8 t30 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.58 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.664 ' CGD' HD21 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.21 152.55 24.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.325 -0.859 . . . . 0.0 109.531 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -136.53 162.55 32.8 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.437 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.525 ' CB ' ' HZ1' ' A' ' 5' ' ' LYS . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.529 ' CE ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.525 ' HZ1' ' CB ' ' A' ' 2' ' ' SER . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.44 ' O ' ' OG1' ' A' ' 12' ' ' THR . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 8' ' ' THR . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.559 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.527 ' O ' ' CG1' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.559 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.686 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.686 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.555 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.596 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.678 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.555 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.485 ' OG1' ' O2D' ' A' ' 104' ' ' HEC . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.496 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.421 ' N ' HD21 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.576 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.576 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.485 ' O2D' ' OG1' ' A' ' 49' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.34 0.59 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.59 -33.54 74.07 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.174 -0.954 . . . . 0.0 109.468 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -136.3 162.6 32.56 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.313 -0.867 . . . . 0.0 109.449 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.418 ' O ' ' CG2' ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.48 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 9' ' ' LEU . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.487 ' O ' ' O ' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' O ' ' O ' ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.597 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' ' HB3' ' A' ' 18' ' ' HIS . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.586 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.418 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.597 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.607 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.449 HG23 HD13 ' A' ' 53' ' ' ILE . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.578 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.587 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.429 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.522 ' HH ' ' CD2' ' A' ' 71' ' ' HIS . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.647 ' HG1' HH11 ' A' ' 91' ' ' ARG . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.522 ' CD2' ' HH ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.647 HH11 ' HG1' ' A' ' 69' ' ' THR . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.41 ' O ' ' OG1' ' A' ' 96' ' ' THR . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.587 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.461 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.607 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -111.32 153.26 26.22 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.408 -0.808 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -135.31 162.25 33.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.315 -0.866 . . . . 0.0 109.329 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.434 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.413 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.666 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.666 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.557 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 17.2 m80 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.416 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.561 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.584 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.481 ' O ' ' OG1' ' A' ' 69' ' ' THR . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.603 ' HH ' ' CHA' ' A' ' 104' ' ' HEC . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.589 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.482 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.404 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.494 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.494 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.603 ' CHA' ' HH ' ' A' ' 67' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' A' ' -5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.32 0.581 . . . . 0.0 109.477 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.84 -33.05 73.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.232 -0.917 . . . . 0.0 109.462 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.18 161.09 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.544 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.574 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.719 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.499 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.563 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.517 ' CG1' ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.517 ' N ' ' CG1' ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.719 ' ND2' ' H ' ' A' ' 19' ' ' THR . 19.5 m120 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.623 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.468 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.406 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.563 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.581 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.447 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.445 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.568 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.463 ' O ' ' OG ' ' A' ' 65' ' ' SER . 24.4 m120 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.567 ' HH ' ' CHA' ' A' ' 104' ' ' HEC . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 21.8 t30 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.545 ' O ' ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.417 ' HB2' HD21 ' A' ' 70' ' ' ASN . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.544 ' CB ' ' CHD' ' A' ' 104' ' ' HEC . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.45 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.568 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.581 ' O1A' ' CZ ' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.418 ' H1 ' HD22 ' A' ' 62' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -58.13 143.32 44.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.214 -0.929 . . . . 0.0 109.563 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -137.29 161.75 35.38 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.292 -0.88 . . . . 0.0 109.322 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.515 ' C ' ' HG ' ' A' ' 2' ' ' SER . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.515 ' HG ' ' C ' ' A' ' 1' ' ' GLY . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.723 ' H ' ' NZ ' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.421 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.668 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.668 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.753 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.753 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.585 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.685 ' NE2' ' NE ' ' A' ' 38' ' ' ARG . 22.8 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.589 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.592 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.606 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.491 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 48.5 t-20 -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.499 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.418 HD22 ' H1 ' ' A' ' -5' ' ' THR . 85.7 m-20 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.579 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.597 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.486 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.4 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.597 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.591 ' CE2' ' CG1' ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.591 ' CG1' ' CE2' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CB ' ' CE1' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.606 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.59 143.94 44.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 109.486 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -136.12 164.37 28.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.297 -0.877 . . . . 0.0 109.293 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.534 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.474 ' N ' ' O ' ' A' ' 14' ' ' CYS . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.687 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.489 ' CG ' ' O2D' ' A' ' 104' ' ' HEC . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.687 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.62 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.561 ' C ' ' H ' ' A' ' 37' ' ' GLY . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.561 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.482 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.64 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.597 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.436 ' HG1' ' CE ' ' A' ' 79' ' ' LYS . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.413 ' CE3' ' HG2' ' A' ' 64' ' ' MET . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.458 ' O ' ' OG1' ' A' ' 69' ' ' THR . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.743 HD21 ' H ' ' A' ' 73' ' ' LYS . 23.5 t30 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.523 ' H ' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.583 ' H ' HD21 ' A' ' 70' ' ' ASN . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.743 ' H ' HD21 ' A' ' 70' ' ' ASN . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.436 ' CE ' ' HG1' ' A' ' 49' ' ' THR . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.43 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.597 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.17 137.63 41.07 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.872 . . . . 0.0 109.536 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 -139.83 165.51 27.11 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.302 -0.874 . . . . 0.0 109.302 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.436 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.469 ' CE1' ' CG1' ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.404 HG21 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.404 ' H ' HG21 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.715 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.715 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.508 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.616 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.616 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.654 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.597 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.426 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.578 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.466 ' C ' HD21 ' A' ' 56' ' ' ASN . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.414 ' HG ' ' CD1' ' A' ' 95' ' ' ILE . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.509 ' C ' ' H ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.509 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.426 ' CE ' ' OG1' ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.459 ' O ' ' CB ' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 84' ' ' GLY . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 92' ' ' ASN . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.508 ' O ' ' OG1' ' A' ' 96' ' ' THR . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.414 ' CD1' ' HG ' ' A' ' 65' ' ' SER . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.459 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.597 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.497 ' H2 ' ' HG1' ' A' ' -5' ' ' THR . 7.8 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -57.71 -33.39 68.35 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.218 -0.926 . . . . 0.0 109.364 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -97.28 128.36 44.06 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.31 -0.869 . . . . 0.0 109.738 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.46 ' HG1' ' N ' ' A' ' 9' ' ' LEU . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.46 ' N ' ' HG1' ' A' ' 8' ' ' THR . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.602 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.626 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.626 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.602 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 38.6 t60 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 24.7 m80 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.485 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.426 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.665 ' CD1' ' N ' ' A' ' 47' ' ' SER . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.573 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.443 ' CG2' ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.65 ' CG ' ' N ' ' A' ' 83' ' ' GLY . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.443 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.573 ' C2A' ' CE2' ' A' ' 67' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 18.0 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -107.84 152.22 24.7 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.342 -0.849 . . . . 0.0 109.536 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 -73.53 -5.74 42.07 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.309 -0.869 . . . . 0.0 109.661 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.585 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.49 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.585 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.589 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.439 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.576 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.468 ' O ' ' CE2' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.43 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.589 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.58 ' N ' ' ND2' ' A' ' 62' ' ' ASN . 95.3 m . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -108.68 151.48 26.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 109.529 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -137.51 162.28 34.13 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 0.0 109.471 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.44 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.422 ' HB2' HD21 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.552 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.612 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' NZ ' ' CG2' ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' CG1' ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.533 ' N ' ' CG1' ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.608 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.632 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.612 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.589 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.46 ' CB ' ' O1D' ' A' ' 104' ' ' HEC . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.488 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.454 ' CG1' ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' -5' ' ' THR . 49.4 t30 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.656 ' O ' ' ND1' ' A' ' 71' ' ' HIS . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.51 ' CB ' ' O ' ' A' ' 71' ' ' HIS . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.454 ' OH ' ' CG1' ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' ' CE1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.5 ' O2A' ' NE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.04 143.63 42.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.928 . . . . 0.0 109.468 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -100.58 130.02 46.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.261 -0.899 . . . . 0.0 109.832 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HZ1' ' HZ3' ' A' ' 89' ' ' LYS . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.433 ' H ' ' HA ' ' A' ' 31' ' ' ASN . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.417 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.433 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.518 ' O ' ' O ' ' A' ' 59' ' ' TRP . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 16.5 m80 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.482 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.406 ' HA3' ' NE2' ' A' ' 26' ' ' HIS . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.586 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.669 HD21 ' CGD' ' A' ' 104' ' ' HEC . 56.2 t-20 -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.593 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.47 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.539 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 9.7 m80 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.477 ' CB ' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.477 ' OG1' ' CB ' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.406 ' HZ3' ' HZ1' ' A' ' 5' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.476 ' O ' ' OG1' ' A' ' 96' ' ' THR . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.476 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.669 ' CGD' HD21 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -61.63 -32.82 72.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.417 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -135.46 161.45 35.43 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.377 -0.827 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.51 ' CE1' ' CG1' ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.502 ' ND1' ' CD2' ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.51 ' CG1' ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.472 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.576 ' C ' ' HD1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.559 ' CD2' ' H ' ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 55' ' ' LYS . 41.0 t-20 -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.552 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 61' ' ' GLU . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.629 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.629 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.49 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.453 ' O ' ' OG1' ' A' ' 96' ' ' THR . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.613 ' O1A' ' CZ ' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.05 144.3 40.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.263 -0.898 . . . . 0.0 109.461 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -135.69 164.69 27.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.306 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.404 ' H ' ' HE2' ' A' ' 4' ' ' LYS . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.601 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.446 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.412 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.413 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.576 ' HE2' ' C ' ' A' ' 45' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.575 ' CD1' ' HH ' ' A' ' 48' ' ' TYR . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.576 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.575 ' HH ' ' CD1' ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.627 ' ND2' ' CGD' ' A' ' 104' ' ' HEC . 41.5 t-20 -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.563 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.485 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.491 ' HG ' ' CD1' ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.599 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.626 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.436 ' CD2' ' HH ' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.626 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.524 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.488 ' NZ ' ' CMD' ' A' ' 104' ' ' HEC . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 65' ' ' SER . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.627 ' CGD' ' ND2' ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.618 ' HG1' ' H ' ' A' ' -4' ' ' GLU . 33.7 p . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . 0.618 ' H ' ' HG1' ' A' ' -5' ' ' THR . 78.2 mm-40 -106.91 150.37 26.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.332 -0.855 . . . . 0.0 109.458 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -138.22 161.2 37.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.264 -0.897 . . . . 0.0 109.578 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.462 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.424 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.687 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.549 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.409 ' CD2' ' OH ' ' A' ' 48' ' ' TYR . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.687 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.592 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.656 ' HG1' ' CE ' ' A' ' 79' ' ' LYS . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.492 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.41 ' H ' ' HB2' ' A' ' 40' ' ' SER . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.591 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.558 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.558 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.409 ' OH ' ' CG1' ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.404 ' HB ' ' HG1' ' A' ' 78' ' ' THR . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.536 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.656 ' CE ' ' HG1' ' A' ' 49' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.523 ' O ' ' CB ' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.523 ' CB ' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.449 ' O ' ' OG1' ' A' ' 96' ' ' THR . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.591 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.592 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.66 -33.89 74.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' -2' ' ' LYS . 40.9 p90 -73.66 -7.95 54.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.591 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.414 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.679 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.602 ' H ' ' ND1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.433 ' CG ' ' H ' ' A' ' 33' ' ' HIS . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.433 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.476 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.679 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.447 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.513 HD21 ' CGD' ' A' ' 104' ' ' HEC . 62.6 t-20 -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.428 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.414 ' O ' ' OG ' ' A' ' 65' ' ' SER . 26.3 m120 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.5 ' CG2' ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 10.6 m80 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.458 ' CB ' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.458 ' OG1' ' CB ' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.466 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.5 ' NH2' ' CG2' ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.589 ' C2A' ' CE1' ' A' ' 67' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' -4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' -5' ' ' THR . 96.1 mt-10 42.4 -166.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.851 . . . . 0.0 109.546 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -137.18 162.31 33.8 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.201 -0.937 . . . . 0.0 109.553 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.537 ' CD2' ' SG ' ' A' ' 14' ' ' CYS . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.512 ' SG ' ' CMC' ' A' ' 104' ' ' HEC . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.451 ' HB2' HD21 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.565 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.488 ' O ' ' CG1' ' A' ' 20' ' ' VAL . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.659 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.659 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.487 ' HD1' ' CG1' ' A' ' 20' ' ' VAL . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.415 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.587 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.427 ' HD1' ' HB1' ' A' ' 72' ' ' ALA . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB1' ' HD1' ' A' ' 71' ' ' HIS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' A' ' 70' ' ' ASN . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.489 ' HG1' ' CGD' ' A' ' 104' ' ' HEC . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . 0.504 ' O ' ' OD1' ' A' ' 93' ' ' ASP . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.642 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.512 ' CMC' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -58.32 144.67 40.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.837 . . . . 0.0 109.501 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -98.06 130.2 44.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.264 -0.898 . . . . 0.0 109.753 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.592 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.408 ' CB ' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.571 ' CD1' ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HE ' ' CD1' ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.586 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.586 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.559 ' O ' ' CB ' ' A' ' 33' ' ' HIS . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.429 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.471 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.588 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.605 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 53' ' ' ILE . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.579 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.429 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.487 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 67' ' ' TYR . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.687 HD21 ' H ' ' A' ' 73' ' ' LYS . 29.4 t30 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.46 ' O ' ' OH ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.522 ' H ' ' ND2' ' A' ' 70' ' ' ASN . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.687 ' H ' HD21 ' A' ' 70' ' ' ASN . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.509 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.509 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.407 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.605 ' O1A' ' CE2' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -61.66 -33.45 73.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.275 -0.89 . . . . 0.0 109.434 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -136.64 160.76 37.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.916 . . . . 0.0 109.506 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.421 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.49 ' OG1' ' OD1' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.63 ' HE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.561 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.411 ' CD2' ' CE1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.606 ' C ' ' HE2' ' A' ' 26' ' ' HIS . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.63 ' N ' ' HE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.652 ' HH ' ' CGA' ' A' ' 104' ' ' HEC . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 53' ' ' ILE . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.497 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.406 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.591 ' CE2' ' O2A' ' A' ' 104' ' ' HEC . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.49 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.449 ' O ' ' OG ' ' A' ' 65' ' ' SER . 2.9 m120 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.721 HD21 ' N ' ' A' ' 73' ' ' LYS . 12.2 t30 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.721 ' N ' HD21 ' A' ' 70' ' ' ASN . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.424 ' H ' ' C ' ' A' ' 84' ' ' GLY . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.405 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 92' ' ' ASN . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' HEC . . . . . 0.652 ' CGA' ' HH ' ' A' ' 48' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.273 0.558 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.629 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.77 HD11 ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.77 ' HE ' HD11 ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.639 ' CE1' HD21 ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.803 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.803 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.757 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.431 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.596 ' O ' HD11 ' A' ' 53' ' ' ILE . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.596 HD11 ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.569 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.748 HD12 HD23 ' A' ' 85' ' ' LEU . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.415 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.748 HD23 HD12 ' A' ' 68' ' ' LEU . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.401 ' HB3' HD11 ' A' ' 85' ' ' LEU . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.4 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.761 HG22 ' HB2' ' A' ' 3' ' ' ALA . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.252 0.549 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.459 ' H ' ' HE3' ' A' ' 4' ' ' LYS . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.555 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.608 ' CE1' HG13 ' A' ' 20' ' ' VAL . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.555 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.554 ' O ' HG21 ' A' ' 28' ' ' VAL . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.621 HG22 ' H ' ' A' ' 21' ' ' GLU . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' H ' HG22 ' A' ' 19' ' ' THR . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.642 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.642 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.775 HD13 HD13 ' A' ' 35' ' ' ILE . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 32' ' ' LEU . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.575 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.612 ' OH ' HD22 ' A' ' 32' ' ' LEU . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.42 ' C ' HD21 ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.453 ' H ' ' HB2' ' A' ' 40' ' ' SER . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.424 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 72' ' ' ALA . 10.6 t-20 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HB2' HG22 ' A' ' 78' ' ' THR . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.472 HD12 ' HE1' ' A' ' 67' ' ' TYR . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.78 HG22 ' HB2' ' A' ' 72' ' ' ALA . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.493 ' N ' HG23 ' A' ' 78' ' ' THR . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.587 ' H ' ' CE ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.697 HG12 ' O ' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.742 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.742 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 35' ' ' ILE . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.523 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.436 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.712 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.437 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.637 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.673 HG11 ' OH ' ' A' ' 74' ' ' TYR . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.532 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.532 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.673 ' OH ' HG11 ' A' ' 57' ' ' VAL . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 65' ' ' SER . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.642 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.593 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.478 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 14' ' ' CYS . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.869 HG23 ' O ' ' A' ' 8' ' ' THR . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 82' ' ' PHE . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.594 HG23 ' HG2' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HG2' HG23 ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.468 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.505 HG12 ' N ' ' A' ' 29' ' ' GLY . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.505 ' N ' HG12 ' A' ' 28' ' ' VAL . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.569 HD11 HD13 ' A' ' 35' ' ' ILE . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.586 ' CG ' ' O ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.569 HD13 HD11 ' A' ' 32' ' ' LEU . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.818 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.818 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 51' ' ' ALA . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' H ' HG22 ' A' ' 49' ' ' THR . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.474 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.578 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.747 HG11 ' CE1' ' A' ' 74' ' ' TYR . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.577 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HD13 ' A' ' 68' ' ' LEU . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 70' ' ' ASN . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 64' ' ' MET . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.402 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.747 ' CE1' HG11 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.418 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.5 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.416 ' CB ' HH21 ' A' ' 91' ' ' ARG . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.416 HH21 ' CB ' ' A' ' 88' ' ' GLU . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.593 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.577 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.728 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.511 HD11 ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.511 ' HE ' HD11 ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 21' ' ' GLU . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.453 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.718 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD23 ' A' ' 32' ' ' LEU . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.928 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.715 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.422 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.928 ' OH ' HD22 ' A' ' 32' ' ' LEU . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.408 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.639 HD13 HD23 ' A' ' 94' ' ' LEU . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.89 HG22 ' NH2' ' A' ' 91' ' ' ARG . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.61 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 71' ' ' HIS . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' CE1' ' A' ' 82' ' ' PHE . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.89 ' NH2' HG22 ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.639 HD23 HD13 ' A' ' 68' ' ' LEU . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.728 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.247 0.546 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.779 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' HG23 ' A' ' 12' ' ' THR . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.657 HD23 ' HG ' ' A' ' 94' ' ' LEU . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.721 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 8' ' ' THR . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 19' ' ' THR . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 HD12 ' A' ' 15' ' ' LEU . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.742 ' C ' HD22 ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.519 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.598 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.742 HD22 ' C ' ' A' ' 25' ' ' PRO . 87.9 m-20 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.648 ' HB2' HG21 ' A' ' 102' ' ' THR . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.646 ' O ' HD11 ' A' ' 53' ' ' ILE . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.646 HD11 ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.609 HG11 ' OH ' ' A' ' 74' ' ' TYR . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.452 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 9.6 t-20 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 0.7 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.74 ' HB3' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.609 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.425 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.505 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.423 HD11 HD12 ' A' ' 94' ' ' LEU . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 85' ' ' LEU . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 65' ' ' SER . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.779 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.488 HD11 HD22 ' A' ' 94' ' ' LEU . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.648 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.654 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.833 ' HZ3' ' N ' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.494 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CE1' HG13 ' A' ' 20' ' ' VAL . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 12' ' ' THR . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.497 HG13 ' CE1' ' A' ' 10' ' ' PHE . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 19' ' ' THR . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.698 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.698 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.703 HD11 ' OH ' ' A' ' 48' ' ' TYR . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 34' ' ' GLY . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 33' ' ' HIS . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.814 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.814 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.57 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.535 ' OE1' ' NE ' ' A' ' 38' ' ' ARG . 72.2 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.493 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.79 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.703 ' OH ' HD11 ' A' ' 32' ' ' LEU . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.597 HD11 ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.499 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.402 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.49 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 HD23 ' A' ' 94' ' ' LEU . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.564 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.613 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 0.3 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.716 ' CZ ' HD11 ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.716 HD11 ' CZ ' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.613 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.527 HD23 HD13 ' A' ' 68' ' ' LEU . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' 65' ' ' SER . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.654 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.721 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.744 HD11 ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CE1' HG23 ' A' ' 20' ' ' VAL . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.744 ' HE ' HD11 ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.541 ' ND1' HD23 ' A' ' 32' ' ' LEU . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' CE1' ' A' ' 10' ' ' PHE . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.666 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.634 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.475 ' ND1' HG13 ' A' ' 20' ' ' VAL . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.564 ' N ' HD13 ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.465 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.666 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.465 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' TYR . 7.9 t-20 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.467 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD21 HD12 ' A' ' 94' ' ' LEU . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 85' ' ' LEU . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.798 HD12 HD21 ' A' ' 85' ' ' LEU . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.721 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 94' ' ' LEU . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.52 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CG ' ' N ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 12' ' ' THR . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.564 ' CE1' HG13 ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 8' ' ' THR . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.776 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.776 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.567 HD12 ' OH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.57 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.57 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.473 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.749 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.534 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.68 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.749 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.461 HG21 ' HE2' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.494 HD11 ' O ' ' A' ' 48' ' ' TYR . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.473 ' H ' ' HB2' ' A' ' 40' ' ' SER . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.51 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.645 HD13 HD23 ' A' ' 94' ' ' LEU . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 82' ' ' PHE . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.444 ' HG2' HH21 ' A' ' 91' ' ' ARG . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 88' ' ' GLU . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.645 HD23 HD13 ' A' ' 68' ' ' LEU . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.52 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.689 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.261 0.553 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' -2' ' ' LYS . . . . . 0.401 ' HB2' ' ND2' ' A' ' 92' ' ' ASN . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.406 ' N ' ' HB3' ' A' ' 93' ' ' ASP . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' HG23 ' A' ' 12' ' ' THR . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 8' ' ' THR . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' A' ' 28' ' ' VAL . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' A' ' 17' ' ' CYS . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.59 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.59 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.918 HD11 HD13 ' A' ' 35' ' ' ILE . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 8.4 t-80 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.918 HD13 HD11 ' A' ' 32' ' ' LEU . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.435 ' HB2' HG21 ' A' ' 102' ' ' THR . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 15.4 m-70 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.503 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.804 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.47 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.804 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.622 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.59 ' HA ' HD11 ' A' ' 95' ' ' ILE . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.947 HG23 ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 72' ' ' ALA . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.65 ' CG ' ' N ' ' A' ' 83' ' ' GLY . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.51 HD21 ' CZ ' ' A' ' 82' ' ' PHE . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.401 ' ND2' ' HB2' ' A' ' -2' ' ' LYS . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.406 ' HB3' ' N ' ' A' ' 6' ' ' GLY . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 ' HA ' ' A' ' 65' ' ' SER . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 36' ' ' PHE . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.177 0.513 . . . . 0.0 109.661 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.811 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.642 HD23 ' HG ' ' A' ' 94' ' ' LEU . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.508 ' NE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HA ' ' HD1' ' A' ' 26' ' ' HIS . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.952 HD11 HD13 ' A' ' 35' ' ' ILE . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.952 HD13 HD11 ' A' ' 32' ' ' LEU . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.497 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.667 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.508 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.667 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.479 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.539 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.675 ' O ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.675 HG21 ' O ' ' A' ' 71' ' ' HIS . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.434 ' HB2' ' CD2' ' A' ' 71' ' ' HIS . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.642 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 65' ' ' SER . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.811 HG22 ' HB2' ' A' ' 3' ' ' ALA . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.589 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.825 ' O ' HG23 ' A' ' 12' ' ' THR . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.549 HD23 ' HG ' ' A' ' 94' ' ' LEU . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.605 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.825 HG23 ' O ' ' A' ' 8' ' ' THR . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.492 HD12 HG22 ' A' ' 19' ' ' THR . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB2' HD22 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.559 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.605 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.662 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' NZ ' HG21 ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.59 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.872 ' N ' HD23 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.452 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.631 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.654 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.421 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 55' ' ' LYS . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.903 HG11 ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HB3' ' H ' ' A' ' 73' ' ' LYS . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.732 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 1.092 ' HB1' HG21 ' A' ' 78' ' ' THR . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' H ' ' HB3' ' A' ' 70' ' ' ASN . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.903 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . 1.092 HG21 ' HB1' ' A' ' 72' ' ' ALA . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' ' CE1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.432 ' O ' ' N ' ' A' ' 86' ' ' LYS . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 84' ' ' GLY . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.549 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.292 0.568 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.685 ' O ' HG22 ' A' ' 12' ' ' THR . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CE1' HG13 ' A' ' 20' ' ' VAL . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.685 HG22 ' O ' ' A' ' 8' ' ' THR . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.604 ' HG3' HG23 ' A' ' 12' ' ' THR . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.436 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.488 HD22 ' OH ' ' A' ' 48' ' ' TYR . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 102' ' ' THR . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.416 ' OD1' HD13 ' A' ' 75' ' ' ILE . 56.2 t-20 -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.593 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.683 HG11 ' OH ' ' A' ' 74' ' ' TYR . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.42 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.461 ' O ' HD13 ' A' ' 68' ' ' LEU . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' CD2' HD23 ' A' ' 94' ' ' LEU . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.607 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 3.9 m-70 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.623 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.683 ' OH ' HG11 ' A' ' 57' ' ' VAL . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.607 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 89' ' ' LYS . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 87' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.524 HD23 ' CD2' ' A' ' 68' ' ' LEU . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 68' ' ' LEU . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.662 HG22 ' HB2' ' A' ' 3' ' ' ALA . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.532 HG21 ' HB2' ' A' ' 36' ' ' PHE . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.73 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.453 ' H ' ' HE3' ' A' ' 4' ' ' LYS . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.684 ' CE1' HG13 ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.402 ' O ' HG22 ' A' ' 12' ' ' THR . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.516 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.404 ' SG ' HG11 ' A' ' 28' ' ' VAL . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.68 ' CE1' HD21 ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.527 HG22 ' H ' ' A' ' 21' ' ' GLU . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.684 HG13 ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.527 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.404 HG11 ' SG ' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.442 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.896 HD22 ' H ' ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.85 HD13 HD12 ' A' ' 32' ' ' LEU . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.462 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.459 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.422 ' CD2' ' HG3' ' A' ' 30' ' ' PRO . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.514 HD21 ' C ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.422 ' HB2' ' H ' ' A' ' 60' ' ' ASP . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.72 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.627 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.589 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.627 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.589 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.464 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 HD13 ' A' ' 68' ' ' LEU . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 3' ' ' ALA . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.718 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.688 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.532 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.493 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.506 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.657 HD13 ' HG ' ' A' ' 32' ' ' LEU . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.581 ' OH ' HD11 ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.417 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.47 ' HA ' HD11 ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.52 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.521 HD12 HD11 ' A' ' 95' ' ' ILE . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.592 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.554 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 0.3 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.592 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.524 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.554 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 68' ' ' LEU . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.521 HD11 HD12 ' A' ' 68' ' ' LEU . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.718 HG22 ' HB2' ' A' ' 3' ' ' ALA . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.624 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.674 ' HA2' HD12 ' A' ' 9' ' ' LEU . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.674 HD12 ' HA2' ' A' ' 6' ' ' GLY . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.628 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.628 HG13 ' CE1' ' A' ' 10' ' ' PHE . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.603 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.603 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.71 HD13 HD13 ' A' ' 35' ' ' ILE . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.71 HD13 HD13 ' A' ' 32' ' ' LEU . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.578 ' HB2' HG21 ' A' ' 102' ' ' THR . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.48 ' O ' HD11 ' A' ' 58' ' ' LEU . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.409 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.518 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.569 ' OH ' HD22 ' A' ' 32' ' ' LEU . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.944 HG11 ' OH ' ' A' ' 74' ' ' TYR . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 37' ' ' GLY . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.49 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.519 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.519 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.944 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.539 ' N ' HG22 ' A' ' 78' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.711 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.403 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.674 HD21 HD12 ' A' ' 94' ' ' LEU . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.674 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 65' ' ' SER . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.624 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.578 HG21 ' HB2' ' A' ' 36' ' ' PHE . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' -3' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' -2' ' ' LYS . 40.9 p90 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.243 0.545 . . . . 0.0 109.562 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.634 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.602 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.423 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.602 HG13 ' CE1' ' A' ' 10' ' ' PHE . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.629 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.629 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.692 HD11 HD13 ' A' ' 35' ' ' ILE . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.407 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.692 HD13 HD11 ' A' ' 32' ' ' LEU . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.485 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.538 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.586 ' OH ' HD12 ' A' ' 32' ' ' LEU . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.442 HG11 ' HE2' ' A' ' 74' ' ' TYR . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.485 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 68' ' ' LEU . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.499 ' O ' ' O ' ' A' ' 70' ' ' ASN . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 65' ' ' SER . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . 1.023 HG23 ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.488 ' CD2' ' HB3' ' A' ' 82' ' ' PHE . 4.9 m-70 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.579 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.442 ' HE2' HG11 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.579 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.488 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 1.023 ' NH2' HG23 ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.234 0.54 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.535 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.618 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.565 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.554 ' CZ ' HG23 ' A' ' 20' ' ' VAL . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.565 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.571 HD12 HG22 ' A' ' 19' ' ' THR . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HB2' HD22 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.571 HG22 HD12 ' A' ' 15' ' ' LEU . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' CZ ' ' A' ' 10' ' ' PHE . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.705 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.458 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.811 ' OH ' HD22 ' A' ' 32' ' ' LEU . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.521 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.638 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.638 ' ND2' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 40' ' ' SER . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.554 HD13 HD23 ' A' ' 94' ' ' LEU . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.438 ' C ' ' O ' ' A' ' 67' ' ' TYR . 2.0 t-20 -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 79' ' ' LYS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 78' ' ' THR . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.521 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 75' ' ' ILE . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.534 ' O ' ' HB1' ' A' ' 72' ' ' ALA . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 90' ' ' ASP . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.504 ' HB3' HD11 ' A' ' 85' ' ' LEU . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.642 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.418 HD11 HD12 ' A' ' 68' ' ' LEU . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.535 HG22 ' HB2' ' A' ' 3' ' ' ALA . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.258 0.552 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.459 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.657 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.762 HD11 ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.762 ' HE ' HD11 ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.543 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.063 HD11 HD13 ' A' ' 35' ' ' ILE . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 1.063 HD13 HD11 ' A' ' 32' ' ' LEU . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.421 ' HB2' ' NE2' ' A' ' 42' ' ' GLN . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.521 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.421 ' NE2' ' HB2' ' A' ' 39' ' ' HIS . 83.0 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.726 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.511 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.708 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.726 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.579 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.509 HG11 ' OH ' ' A' ' 74' ' ' TYR . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.521 ' HZ2' ' HG ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.528 ' CD1' HD23 ' A' ' 94' ' ' LEU . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 8.9 t-20 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.509 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.424 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD23 ' CD1' ' A' ' 68' ' ' LEU . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.502 HD11 ' HG ' ' A' ' 68' ' ' LEU . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.867 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 12' ' ' THR . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.481 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.62 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 8' ' ' THR . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HG3' HG23 ' A' ' 12' ' ' THR . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.62 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.614 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.595 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD22 ' ND1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.412 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.614 ' N ' ' NE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.521 ' CD2' ' ND2' ' A' ' 52' ' ' ASN . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.497 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.412 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.504 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.516 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 42.5 m-20 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.545 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 85' ' ' LEU . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' TYR . 5.0 t-20 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.748 HD21 HD12 ' A' ' 94' ' ' LEU . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.484 ' HB3' HD11 ' A' ' 85' ' ' LEU . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.472 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.748 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.545 HD11 ' HA ' ' A' ' 65' ' ' SER . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.867 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -101.37 139.36 37.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 109.421 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -101.04 129.87 46.96 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.237 -0.914 . . . . 0.0 109.672 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.629 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.77 HD11 ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.77 ' HE ' HD11 ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.639 ' CE1' HD21 ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.803 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.803 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.757 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.431 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.596 HD11 ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.569 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.748 HD12 HD23 ' A' ' 85' ' ' LEU . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.415 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.748 HD23 HD12 ' A' ' 68' ' ' LEU . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.401 ' HB3' HD11 ' A' ' 85' ' ' LEU . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.4 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.604 HD21 ' CMB' ' A' ' 104' ' ' HEC . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.761 HG22 ' HB2' ' A' ' 3' ' ' ALA . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.682 ' CBD' HMD1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -109.06 155.4 20.99 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.363 -0.836 . . . . 0.0 109.521 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -134.25 160.58 37.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.588 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.459 ' H ' ' HE3' ' A' ' 4' ' ' LYS . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.555 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.608 ' CE1' HG13 ' A' ' 20' ' ' VAL . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.555 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.554 ' O ' HG21 ' A' ' 28' ' ' VAL . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.621 HG22 ' H ' ' A' ' 21' ' ' GLU . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' H ' HG22 ' A' ' 19' ' ' THR . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.642 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.642 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.775 HD13 HD13 ' A' ' 35' ' ' ILE . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 32' ' ' LEU . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.575 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.612 ' OH ' HD22 ' A' ' 32' ' ' LEU . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.453 ' OD1' ' CGD' ' A' ' 104' ' ' HEC . 0.7 OUTLIER -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.453 ' H ' ' HB2' ' A' ' 40' ' ' SER . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.424 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 72' ' ' ALA . 10.6 t-20 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HB2' HG22 ' A' ' 78' ' ' THR . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.472 HD12 ' HE1' ' A' ' 67' ' ' TYR . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.78 HG22 ' HB2' ' A' ' 72' ' ' ALA . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.493 ' N ' HG23 ' A' ' 78' ' ' THR . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.644 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.668 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.21 152.55 24.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.325 -0.859 . . . . 0.0 109.531 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -136.53 162.55 32.8 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.437 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.587 ' H ' ' CE ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.697 HG12 ' O ' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.742 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.742 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 35' ' ' ILE . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.523 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.436 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.712 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.437 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.637 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.673 HG11 ' OH ' ' A' ' 74' ' ' TYR . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.532 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.532 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.673 ' OH ' HG11 ' A' ' 57' ' ' VAL . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.454 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 65' ' ' SER . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.642 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.706 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.34 0.59 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.59 -33.54 74.07 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.174 -0.954 . . . . 0.0 109.468 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -136.3 162.6 32.56 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.313 -0.867 . . . . 0.0 109.449 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.593 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.478 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 14' ' ' CYS . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.869 HG23 ' O ' ' A' ' 8' ' ' THR . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 82' ' ' PHE . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.438 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.594 HG23 ' HG2' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HG2' HG23 ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.468 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.505 HG12 ' N ' ' A' ' 29' ' ' GLY . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.505 ' N ' HG12 ' A' ' 28' ' ' VAL . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD11 HD13 ' A' ' 35' ' ' ILE . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.586 ' CG ' ' O ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.569 HD13 HD11 ' A' ' 32' ' ' LEU . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.818 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.818 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 51' ' ' ALA . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' H ' HG22 ' A' ' 49' ' ' THR . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.474 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.578 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.747 HG11 ' CE1' ' A' ' 74' ' ' TYR . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.577 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HD13 ' A' ' 68' ' ' LEU . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 70' ' ' ASN . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 64' ' ' MET . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.402 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.747 ' CE1' HG11 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.418 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.5 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.416 ' CB ' HH21 ' A' ' 91' ' ' ARG . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.416 HH21 ' CB ' ' A' ' 88' ' ' GLU . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.687 HD21 HBB3 ' A' ' 104' ' ' HEC . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.593 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.577 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.882 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -111.32 153.26 26.22 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.408 -0.808 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -135.31 162.25 33.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.315 -0.866 . . . . 0.0 109.329 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.728 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.511 HD11 ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.511 ' HE ' HD11 ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 21' ' ' GLU . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.453 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.718 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD23 ' A' ' 32' ' ' LEU . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.928 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.715 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.422 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.928 ' OH ' HD22 ' A' ' 32' ' ' LEU . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.408 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.639 HD13 HD23 ' A' ' 94' ' ' LEU . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.89 HG22 ' NH2' ' A' ' 91' ' ' ARG . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.589 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 71' ' ' HIS . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.559 ' HB1' HBC2 ' A' ' 104' ' ' HEC . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' CE1' ' A' ' 82' ' ' PHE . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.89 ' NH2' HG22 ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.639 HD23 HD13 ' A' ' 68' ' ' LEU . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.728 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.615 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.32 0.581 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.84 -33.05 73.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.232 -0.917 . . . . 0.0 109.462 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.18 161.09 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.544 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.779 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' HG23 ' A' ' 12' ' ' THR . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.657 HD23 ' HG ' ' A' ' 94' ' ' LEU . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.721 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 8' ' ' THR . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 19' ' ' THR . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 HD12 ' A' ' 15' ' ' LEU . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.742 ' C ' HD22 ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.598 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.742 HD22 ' C ' ' A' ' 25' ' ' PRO . 87.9 m-20 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.648 ' HB2' HG21 ' A' ' 102' ' ' THR . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.646 ' O ' HD11 ' A' ' 53' ' ' ILE . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.646 HD11 ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.609 HG11 ' OH ' ' A' ' 74' ' ' TYR . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.452 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 9.6 t-20 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.74 ' HB3' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.609 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.628 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.505 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.423 HD11 HD12 ' A' ' 94' ' ' LEU . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 85' ' ' LEU . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 65' ' ' SER . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.779 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD11 HD22 ' A' ' 94' ' ' LEU . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.648 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.814 HMD1 HBD1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -58.13 143.32 44.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.214 -0.929 . . . . 0.0 109.563 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -137.29 161.75 35.38 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.292 -0.88 . . . . 0.0 109.322 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.654 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.833 ' HZ3' ' N ' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.494 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CE1' HG13 ' A' ' 20' ' ' VAL . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 12' ' ' THR . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.409 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.497 HG13 ' CE1' ' A' ' 10' ' ' PHE . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 19' ' ' THR . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.698 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.698 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.703 HD11 ' OH ' ' A' ' 48' ' ' TYR . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 34' ' ' GLY . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 33' ' ' HIS . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.814 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.814 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.57 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.535 ' OE1' ' NE ' ' A' ' 38' ' ' ARG . 72.2 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.493 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.79 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.703 ' OH ' HD11 ' A' ' 32' ' ' LEU . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.597 HD11 ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.499 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.402 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.579 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 HD23 ' A' ' 94' ' ' LEU . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.564 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.486 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.4 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.716 ' CZ ' HD11 ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.716 HD11 ' CZ ' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.918 ' HB1' HBC2 ' A' ' 104' ' ' HEC . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.414 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.648 HD21 ' CMB' ' A' ' 104' ' ' HEC . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' 65' ' ' SER . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.654 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.918 HBC2 ' HB1' ' A' ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -5' ' ' THR . . . . . 0.439 ' HB ' HD21 ' A' ' 62' ' ' ASN . 1.1 m . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.59 143.94 44.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 109.486 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -136.12 164.37 28.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.297 -0.877 . . . . 0.0 109.293 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.721 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.744 HD11 ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CE1' HG23 ' A' ' 20' ' ' VAL . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.744 ' HE ' HD11 ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.541 ' ND1' HD23 ' A' ' 32' ' ' LEU . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' CE1' ' A' ' 10' ' ' PHE . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.666 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.489 ' CG ' ' O2D' ' A' ' 104' ' ' HEC . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.634 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.475 ' ND1' HG13 ' A' ' 20' ' ' VAL . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.564 ' N ' HD13 ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.481 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.666 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.597 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.465 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.439 HD21 ' HB ' ' A' ' -5' ' ' THR . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' TYR . 7.9 t-20 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.467 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD21 HD12 ' A' ' 94' ' ' LEU . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 85' ' ' LEU . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.798 HD12 HD21 ' A' ' 85' ' ' LEU . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.721 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 94' ' ' LEU . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.667 ' CBD' HMD1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.17 137.63 41.07 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.872 . . . . 0.0 109.536 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 -139.83 165.51 27.11 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.302 -0.874 . . . . 0.0 109.302 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.52 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CG ' ' N ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 12' ' ' THR . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.564 ' CE1' HG13 ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 8' ' ' THR . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.455 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.776 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.776 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.567 HD12 ' OH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.57 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.57 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.473 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.749 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.534 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.68 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.749 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.461 HG21 ' HE2' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.494 HD11 ' O ' ' A' ' 48' ' ' TYR . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.473 ' H ' ' HB2' ' A' ' 40' ' ' SER . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.51 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.645 HD13 HD23 ' A' ' 94' ' ' LEU . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 82' ' ' PHE . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.444 ' HG2' HH21 ' A' ' 91' ' ' ARG . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 88' ' ' GLU . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.718 HD21 ' CMB' ' A' ' 104' ' ' HEC . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.52 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.689 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.739 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -57.71 -33.39 68.35 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.218 -0.926 . . . . 0.0 109.364 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -97.28 128.36 44.06 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.31 -0.869 . . . . 0.0 109.738 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' LYS . . . . . 0.401 ' HB2' ' ND2' ' A' ' 92' ' ' ASN . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.406 ' N ' ' HB3' ' A' ' 93' ' ' ASP . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' HG23 ' A' ' 12' ' ' THR . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 8' ' ' THR . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.494 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' A' ' 17' ' ' CYS . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.59 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.59 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.918 HD11 HD13 ' A' ' 35' ' ' ILE . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 8.4 t-80 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.918 HD13 HD11 ' A' ' 32' ' ' LEU . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.435 ' HB2' HG21 ' A' ' 102' ' ' THR . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 15.4 m-70 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.503 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.804 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.47 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.804 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.622 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.59 ' HA ' HD11 ' A' ' 95' ' ' ILE . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.573 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.947 HG23 ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 72' ' ' ALA . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.775 ' CE2' HBB2 ' A' ' 104' ' ' HEC . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.51 HD21 ' CZ ' ' A' ' 82' ' ' PHE . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.401 ' ND2' ' HB2' ' A' ' -2' ' ' LYS . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.406 ' HB3' ' N ' ' A' ' 6' ' ' GLY . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 ' HA ' ' A' ' 65' ' ' SER . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 36' ' ' PHE . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.775 HBB2 ' CE2' ' A' ' 82' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 18.0 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -107.84 152.22 24.7 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.342 -0.849 . . . . 0.0 109.536 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 -73.53 -5.74 42.07 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.309 -0.869 . . . . 0.0 109.661 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.811 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.642 HD23 ' HG ' ' A' ' 94' ' ' LEU . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.508 ' NE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HA ' ' HD1' ' A' ' 26' ' ' HIS . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.952 HD11 HD13 ' A' ' 35' ' ' ILE . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.952 HD13 HD11 ' A' ' 32' ' ' LEU . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.497 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.667 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.508 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.667 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.479 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.539 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.675 ' O ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.675 HG21 ' O ' ' A' ' 71' ' ' HIS . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.43 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.642 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 65' ' ' SER . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.811 HG22 ' HB2' ' A' ' 3' ' ' ALA . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.682 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -5' ' ' THR . . . . . 0.421 ' N ' ' OD1' ' A' ' 62' ' ' ASN . 95.3 m . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -108.68 151.48 26.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 109.529 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -137.51 162.28 34.13 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 0.0 109.471 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.589 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.825 ' O ' HG23 ' A' ' 12' ' ' THR . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.549 HD23 ' HG ' ' A' ' 94' ' ' LEU . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.605 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.825 HG23 ' O ' ' A' ' 8' ' ' THR . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.492 HD12 HG22 ' A' ' 19' ' ' THR . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB2' HD22 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.559 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.605 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.662 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' NZ ' HG21 ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.59 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.872 ' N ' HD23 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.452 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.631 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.654 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.421 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.46 ' CB ' ' O1D' ' A' ' 104' ' ' HEC . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.903 HG11 ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.421 ' OD1' ' N ' ' A' ' -5' ' ' THR . 1.1 t-20 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HB3' ' H ' ' A' ' 73' ' ' LYS . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.732 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 1.092 ' HB1' HG21 ' A' ' 78' ' ' THR . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' H ' ' HB3' ' A' ' 70' ' ' ASN . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.903 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . 1.092 HG21 ' HB1' ' A' ' 72' ' ' ALA . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.594 ' C ' ' HD1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' O ' ' N ' ' A' ' 86' ' ' LYS . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 84' ' ' GLY . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.549 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.669 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.04 143.63 42.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.928 . . . . 0.0 109.468 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -100.58 130.02 46.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.261 -0.899 . . . . 0.0 109.832 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.685 ' O ' HG22 ' A' ' 12' ' ' THR . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CE1' HG13 ' A' ' 20' ' ' VAL . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.685 HG22 ' O ' ' A' ' 8' ' ' THR . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.604 ' HG3' HG23 ' A' ' 12' ' ' THR . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.436 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.488 HD22 ' OH ' ' A' ' 48' ' ' TYR . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 102' ' ' THR . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.482 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.586 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.566 ' ND2' HD13 ' A' ' 75' ' ' ILE . 0.4 OUTLIER -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.593 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.683 HG11 ' OH ' ' A' ' 74' ' ' TYR . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.42 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.461 ' O ' HD13 ' A' ' 68' ' ' LEU . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.539 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' CD2' HD23 ' A' ' 94' ' ' LEU . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.488 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 9.7 m80 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.623 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.683 ' OH ' HG11 ' A' ' 57' ' ' VAL . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.566 HD13 ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.728 ' CB ' HBC2 ' A' ' 104' ' ' HEC . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.407 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 89' ' ' LYS . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 87' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.628 HD21 ' CMB' ' A' ' 104' ' ' HEC . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 68' ' ' LEU . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.662 HG22 ' HB2' ' A' ' 3' ' ' ALA . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.532 HG21 ' HB2' ' A' ' 36' ' ' PHE . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.728 HBC2 ' CB ' ' A' ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -61.63 -32.82 72.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.417 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -135.46 161.45 35.43 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.377 -0.827 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.73 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' H ' ' HE3' ' A' ' 4' ' ' LYS . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.684 ' CE1' HG13 ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.402 ' O ' HG22 ' A' ' 12' ' ' THR . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.516 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.404 ' SG ' HG11 ' A' ' 28' ' ' VAL . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.68 ' CE1' HD21 ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.527 HG22 ' H ' ' A' ' 21' ' ' GLU . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.684 HG13 ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.527 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.404 HG11 ' SG ' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.442 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.896 HD22 ' H ' ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.85 HD13 HD12 ' A' ' 32' ' ' LEU . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.459 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.514 HD21 ' C ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.422 ' HB2' ' H ' ' A' ' 60' ' ' ASP . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.72 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.627 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB3' ' A' ' 82' ' ' PHE . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.627 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' CE1' ' A' ' 71' ' ' HIS . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.464 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 HD13 ' A' ' 68' ' ' LEU . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 3' ' ' ALA . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.684 ' CBD' HMD1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.05 144.3 40.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.263 -0.898 . . . . 0.0 109.461 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -135.69 164.69 27.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.306 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.718 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.688 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.532 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.493 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.506 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.657 HD13 ' HG ' ' A' ' 32' ' ' LEU . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.581 ' OH ' HD11 ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.486 ' OD1' ' CGD' ' A' ' 104' ' ' HEC . 0.7 OUTLIER -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.417 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.47 ' HA ' HD11 ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.599 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.521 HD12 HD11 ' A' ' 95' ' ' ILE . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.592 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.592 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.568 HG23 ' CGD' ' A' ' 104' ' ' HEC . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.488 ' NZ ' ' CMD' ' A' ' 104' ' ' HEC . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.661 HD21 ' CMB' ' A' ' 104' ' ' HEC . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.521 HD11 HD12 ' A' ' 68' ' ' LEU . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.718 HG22 ' HB2' ' A' ' 3' ' ' ALA . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.713 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 33.7 p . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -106.91 150.37 26.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.332 -0.855 . . . . 0.0 109.458 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -138.22 161.2 37.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.264 -0.897 . . . . 0.0 109.578 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.624 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.674 ' HA2' HD12 ' A' ' 9' ' ' LEU . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.674 HD12 ' HA2' ' A' ' 6' ' ' GLY . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.628 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.628 HG13 ' CE1' ' A' ' 10' ' ' PHE . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.603 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.603 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.71 HD13 HD13 ' A' ' 35' ' ' ILE . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.71 HD13 HD13 ' A' ' 32' ' ' LEU . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.578 ' HB2' HG21 ' A' ' 102' ' ' THR . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.48 ' O ' HD11 ' A' ' 58' ' ' LEU . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.409 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.518 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.592 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.445 ' N ' ' O1D' ' A' ' 104' ' ' HEC . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.944 HG11 ' OH ' ' A' ' 74' ' ' TYR . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 37' ' ' GLY . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.49 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.519 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.519 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.944 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.539 ' N ' HG22 ' A' ' 78' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.711 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.403 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.674 HD21 HD12 ' A' ' 94' ' ' LEU . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.674 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 65' ' ' SER . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.624 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.578 HG21 ' HB2' ' A' ' 36' ' ' PHE . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.695 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.66 -33.89 74.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' -2' ' ' LYS . 40.9 p90 -73.66 -7.95 54.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.634 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.602 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.423 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.602 HG13 ' CE1' ' A' ' 10' ' ' PHE . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.629 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.629 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.692 HD11 HD13 ' A' ' 35' ' ' ILE . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.407 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.692 HD13 HD11 ' A' ' 32' ' ' LEU . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.485 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.538 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.586 ' OH ' HD12 ' A' ' 32' ' ' LEU . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.442 HG11 ' HE2' ' A' ' 74' ' ' TYR . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.485 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 68' ' ' LEU . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 65' ' ' SER . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . 1.023 HG23 ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.463 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 10.6 m80 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.579 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.442 ' HE2' HG11 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.579 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 1.023 ' NH2' HG23 ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.692 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -5' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' -4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' -5' ' ' THR . 96.1 mt-10 42.4 -166.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.851 . . . . 0.0 109.546 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -137.18 162.31 33.8 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.201 -0.937 . . . . 0.0 109.553 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.535 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.618 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.565 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.554 ' CZ ' HG23 ' A' ' 20' ' ' VAL . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.565 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.571 HD12 HG22 ' A' ' 19' ' ' THR . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HB2' HD22 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.571 HG22 HD12 ' A' ' 15' ' ' LEU . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' CZ ' ' A' ' 10' ' ' PHE . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.705 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.458 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.811 ' OH ' HD22 ' A' ' 32' ' ' LEU . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.521 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.638 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.638 ' ND2' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 40' ' ' SER . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.554 HD13 HD23 ' A' ' 94' ' ' LEU . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.438 ' C ' ' O ' ' A' ' 67' ' ' TYR . 2.0 t-20 -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 79' ' ' LYS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 78' ' ' THR . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.521 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 75' ' ' ILE . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.534 ' O ' ' HB1' ' A' ' 72' ' ' ALA . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.685 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 90' ' ' ASP . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.504 ' HB3' HD11 ' A' ' 85' ' ' LEU . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.646 HD21 ' CMB' ' A' ' 104' ' ' HEC . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.418 HD11 HD12 ' A' ' 68' ' ' LEU . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.535 HG22 ' HB2' ' A' ' 3' ' ' ALA . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.748 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -58.32 144.67 40.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.837 . . . . 0.0 109.501 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -98.06 130.2 44.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.264 -0.898 . . . . 0.0 109.753 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.459 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.657 ' CD ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.762 HD11 ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.762 ' HE ' HD11 ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.543 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.063 HD11 HD13 ' A' ' 35' ' ' ILE . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 1.063 HD13 HD11 ' A' ' 32' ' ' LEU . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.421 ' HB2' ' NE2' ' A' ' 42' ' ' GLN . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.521 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' NE2' ' HB2' ' A' ' 39' ' ' HIS . 83.0 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.726 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.511 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.708 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.726 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.579 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.509 HG11 ' OH ' ' A' ' 74' ' ' TYR . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.521 ' HZ2' ' HG ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.528 ' CD1' HD23 ' A' ' 94' ' ' LEU . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 8.9 t-20 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.509 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.424 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.736 HD21 HMB1 ' A' ' 104' ' ' HEC . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.502 HD11 ' HG ' ' A' ' 68' ' ' LEU . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.736 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -61.66 -33.45 73.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.275 -0.89 . . . . 0.0 109.434 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -136.64 160.76 37.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.916 . . . . 0.0 109.506 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.867 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 12' ' ' THR . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.481 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.62 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 8' ' ' THR . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HG3' HG23 ' A' ' 12' ' ' THR . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.62 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.614 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.595 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD22 ' ND1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.412 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.614 ' N ' ' NE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.497 ' OD1' ' O ' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.412 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.591 ' CE2' ' O2A' ' A' ' 104' ' ' HEC . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.516 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 42.5 m-20 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.545 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 85' ' ' LEU . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' TYR . 5.0 t-20 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.446 HG23 HAD2 ' A' ' 104' ' ' HEC . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.748 HD21 HD12 ' A' ' 94' ' ' LEU . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.484 ' HB3' HD11 ' A' ' 85' ' ' LEU . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.472 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.748 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.545 HD11 ' HA ' ' A' ' 65' ' ' SER . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.867 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' HEC . . . . . 0.667 HMB1 HBB3 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.273 0.558 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.629 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.77 HD11 ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.77 ' HE ' HD11 ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.639 ' CE1' HD21 ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.803 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.803 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.757 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.431 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.596 ' O ' HD11 ' A' ' 53' ' ' ILE . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.596 HD11 ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.569 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.494 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.748 HD12 HD23 ' A' ' 85' ' ' LEU . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.415 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.748 HD23 HD12 ' A' ' 68' ' ' LEU . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.401 ' HB3' HD11 ' A' ' 85' ' ' LEU . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.4 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.761 HG22 ' HB2' ' A' ' 3' ' ' ALA . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.252 0.549 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.459 ' HE3' ' H ' ' A' ' 4' ' ' LYS . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.555 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.608 ' CE1' HG13 ' A' ' 20' ' ' VAL . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.555 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.554 ' O ' HG21 ' A' ' 28' ' ' VAL . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.621 HG22 ' H ' ' A' ' 21' ' ' GLU . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' H ' HG22 ' A' ' 19' ' ' THR . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.642 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.642 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.775 HD13 HD13 ' A' ' 35' ' ' ILE . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 32' ' ' LEU . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.575 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.612 ' OH ' HD22 ' A' ' 32' ' ' LEU . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.455 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 44.8 t-20 -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.453 ' H ' ' HB2' ' A' ' 40' ' ' SER . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.424 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.561 HD22 ' C ' ' A' ' 72' ' ' ALA . 35.8 t30 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HB2' HG22 ' A' ' 78' ' ' THR . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.472 HD12 ' HE1' ' A' ' 67' ' ' TYR . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.78 HG22 ' HB2' ' A' ' 72' ' ' ALA . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.493 ' N ' HG23 ' A' ' 78' ' ' THR . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.587 ' CE ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.697 HG12 ' O ' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.742 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.742 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 35' ' ' ILE . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.523 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.436 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.712 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.437 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.637 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.496 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.673 HG11 ' OH ' ' A' ' 74' ' ' TYR . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.532 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.532 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.673 ' OH ' HG11 ' A' ' 57' ' ' VAL . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 65' ' ' SER . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.642 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.593 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.478 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 14' ' ' CYS . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.869 HG23 ' O ' ' A' ' 8' ' ' THR . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 82' ' ' PHE . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.594 HG23 ' HG2' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HG2' HG23 ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.468 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.505 HG12 ' N ' ' A' ' 29' ' ' GLY . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.505 ' N ' HG12 ' A' ' 28' ' ' VAL . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.569 HD11 HD13 ' A' ' 35' ' ' ILE . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.586 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.569 HD13 HD11 ' A' ' 32' ' ' LEU . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.818 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.818 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 51' ' ' ALA . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' H ' HG22 ' A' ' 49' ' ' THR . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.474 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.578 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.747 HG11 ' CE1' ' A' ' 74' ' ' TYR . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.577 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HD13 ' A' ' 68' ' ' LEU . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 70' ' ' ASN . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 64' ' ' MET . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.402 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.747 ' CE1' HG11 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.418 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.5 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.416 ' CB ' HH21 ' A' ' 91' ' ' ARG . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.416 HH21 ' CB ' ' A' ' 88' ' ' GLU . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.593 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.577 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.728 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.511 HD11 ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.511 ' HE ' HD11 ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 21' ' ' GLU . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.453 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.718 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD23 ' A' ' 32' ' ' LEU . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.928 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.715 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.422 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.928 ' OH ' HD22 ' A' ' 32' ' ' LEU . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.408 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.639 HD13 HD23 ' A' ' 94' ' ' LEU . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.89 HG22 ' NH2' ' A' ' 91' ' ' ARG . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.589 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 71' ' ' HIS . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' CE1' ' A' ' 82' ' ' PHE . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.89 ' NH2' HG22 ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.639 HD23 HD13 ' A' ' 68' ' ' LEU . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.728 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.247 0.546 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.779 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' HG23 ' A' ' 12' ' ' THR . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.657 HD23 ' HG ' ' A' ' 94' ' ' LEU . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.721 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 8' ' ' THR . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 19' ' ' THR . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.737 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.499 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.519 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.598 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.737 ' ND2' ' H ' ' A' ' 19' ' ' THR . 19.5 m120 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.831 HD23 ' N ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.648 ' HB2' HG21 ' A' ' 102' ' ' THR . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.646 ' O ' HD11 ' A' ' 53' ' ' ILE . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.646 HD11 ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.609 HG11 ' OH ' ' A' ' 74' ' ' TYR . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.452 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 21.8 t30 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.74 ' HB3' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.462 ' HB2' HD22 ' A' ' 70' ' ' ASN . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.609 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.628 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.505 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.423 HD11 HD12 ' A' ' 94' ' ' LEU . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 85' ' ' LEU . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 65' ' ' SER . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.779 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.488 HD11 HD22 ' A' ' 94' ' ' LEU . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.648 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.654 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.833 ' N ' ' HZ3' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.494 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CE1' HG13 ' A' ' 20' ' ' VAL . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.56 ' O ' HG22 ' A' ' 12' ' ' THR . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.497 HG13 ' CE1' ' A' ' 10' ' ' PHE . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 19' ' ' THR . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.698 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.698 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.703 HD11 ' OH ' ' A' ' 48' ' ' TYR . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 34' ' ' GLY . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 33' ' ' HIS . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.814 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.814 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.57 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.685 ' NE2' ' NE ' ' A' ' 38' ' ' ARG . 22.8 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.493 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.79 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.703 ' OH ' HD11 ' A' ' 32' ' ' LEU . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.491 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 48.5 t-20 -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.597 HD11 ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.499 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.402 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.49 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 HD23 ' A' ' 94' ' ' LEU . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.564 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.486 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.4 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.716 ' CZ ' HD11 ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.716 HD11 ' CZ ' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.414 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.527 HD23 HD13 ' A' ' 68' ' ' LEU . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' 65' ' ' SER . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.654 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.721 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.744 HD11 ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CE1' HG23 ' A' ' 20' ' ' VAL . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.744 ' HE ' HD11 ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.541 ' ND1' HD23 ' A' ' 32' ' ' LEU . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' CE1' ' A' ' 10' ' ' PHE . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.666 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.634 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.475 ' ND1' HG13 ' A' ' 20' ' ' VAL . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.564 HD13 ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.465 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.666 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.465 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.787 HD22 ' H ' ' A' ' 73' ' ' LYS . 23.5 t30 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.531 ' H ' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.657 ' H ' HD22 ' A' ' 70' ' ' ASN . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.787 ' H ' HD22 ' A' ' 70' ' ' ASN . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD21 HD12 ' A' ' 94' ' ' LEU . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 85' ' ' LEU . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.798 HD12 HD21 ' A' ' 85' ' ' LEU . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.721 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 94' ' ' LEU . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.52 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CG ' ' N ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 12' ' ' THR . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.564 ' CE1' HG13 ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 8' ' ' THR . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.776 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.776 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.567 HD12 ' OH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.57 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.57 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.473 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.749 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.534 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.68 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.749 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.461 HG21 ' HE2' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.578 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.488 ' C ' HD22 ' A' ' 56' ' ' ASN . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.473 ' H ' ' HB2' ' A' ' 40' ' ' SER . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.645 HD13 HD23 ' A' ' 94' ' ' LEU . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 82' ' ' PHE . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.444 ' HG2' HH21 ' A' ' 91' ' ' ARG . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 88' ' ' GLU . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.645 HD23 HD13 ' A' ' 68' ' ' LEU . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.52 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.689 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.261 0.553 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . 0.401 ' HB2' ' ND2' ' A' ' 92' ' ' ASN . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.406 ' N ' ' HB3' ' A' ' 93' ' ' ASP . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' HG23 ' A' ' 12' ' ' THR . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 8' ' ' THR . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' A' ' 28' ' ' VAL . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.602 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' A' ' 17' ' ' CYS . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.59 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.59 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.918 HD11 HD13 ' A' ' 35' ' ' ILE . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.602 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 38.6 t60 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.918 HD13 HD11 ' A' ' 32' ' ' LEU . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.435 ' HB2' HG21 ' A' ' 102' ' ' THR . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 24.7 m80 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.503 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.804 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.47 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.804 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.622 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.59 ' HA ' HD11 ' A' ' 95' ' ' ILE . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.947 HG23 ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 72' ' ' ALA . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.65 ' CG ' ' N ' ' A' ' 83' ' ' GLY . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.51 HD21 ' CZ ' ' A' ' 82' ' ' PHE . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.401 ' ND2' ' HB2' ' A' ' -2' ' ' LYS . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.406 ' HB3' ' N ' ' A' ' 6' ' ' GLY . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 ' HA ' ' A' ' 65' ' ' SER . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 36' ' ' PHE . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.177 0.513 . . . . 0.0 109.661 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.811 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.642 HD23 ' HG ' ' A' ' 94' ' ' LEU . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.508 ' NE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HA ' ' HD1' ' A' ' 26' ' ' HIS . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.952 HD11 HD13 ' A' ' 35' ' ' ILE . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.952 HD13 HD11 ' A' ' 32' ' ' LEU . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.497 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.667 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.508 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.667 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.539 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.675 ' O ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.675 HG21 ' O ' ' A' ' 71' ' ' HIS . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.43 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.642 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 65' ' ' SER . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.811 HG22 ' HB2' ' A' ' 3' ' ' ALA . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.589 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.825 ' O ' HG23 ' A' ' 12' ' ' THR . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.549 HD23 ' HG ' ' A' ' 94' ' ' LEU . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.605 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.825 HG23 ' O ' ' A' ' 8' ' ' THR . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.492 HD12 HG22 ' A' ' 19' ' ' THR . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB2' HD22 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.559 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.605 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.662 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' NZ ' HG21 ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.59 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.872 HD23 ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.452 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.631 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.654 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.421 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 55' ' ' LYS . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.488 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.903 HG11 ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HB3' ' H ' ' A' ' 73' ' ' LYS . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.732 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 1.092 ' HB1' HG21 ' A' ' 78' ' ' THR . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' H ' ' HB3' ' A' ' 70' ' ' ASN . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.903 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 1.092 HG21 ' HB1' ' A' ' 72' ' ' ALA . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' ' CE1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.432 ' O ' ' N ' ' A' ' 86' ' ' LYS . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 84' ' ' GLY . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.549 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.292 0.568 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.685 ' O ' HG22 ' A' ' 12' ' ' THR . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CE1' HG13 ' A' ' 20' ' ' VAL . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.685 HG22 ' O ' ' A' ' 8' ' ' THR . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.604 ' HG3' HG23 ' A' ' 12' ' ' THR . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.436 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.488 HD22 ' OH ' ' A' ' 48' ' ' TYR . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 102' ' ' THR . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.416 ' OD1' HD13 ' A' ' 75' ' ' ILE . 56.2 t-20 -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.593 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.683 HG11 ' OH ' ' A' ' 74' ' ' TYR . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.42 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.461 ' O ' HD13 ' A' ' 68' ' ' LEU . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.511 ' O ' ' O ' ' A' ' 70' ' ' ASN . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' CD2' HD23 ' A' ' 94' ' ' LEU . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.488 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 9.7 m80 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.623 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.683 ' OH ' HG11 ' A' ' 57' ' ' VAL . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.407 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 89' ' ' LYS . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 87' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.524 HD23 ' CD2' ' A' ' 68' ' ' LEU . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 68' ' ' LEU . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.662 HG22 ' HB2' ' A' ' 3' ' ' ALA . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.532 HG21 ' HB2' ' A' ' 36' ' ' PHE . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.73 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HE3' ' H ' ' A' ' 4' ' ' LYS . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.684 ' CE1' HG13 ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.402 ' O ' HG22 ' A' ' 12' ' ' THR . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.516 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.404 ' SG ' HG11 ' A' ' 28' ' ' VAL . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.68 ' CE1' HD21 ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.527 HG22 ' H ' ' A' ' 21' ' ' GLU . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.684 HG13 ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.527 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.404 HG11 ' SG ' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.442 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.85 HD13 HD12 ' A' ' 32' ' ' LEU . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.462 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.459 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.44 ' HB3' HD22 ' A' ' 52' ' ' ASN . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 55' ' ' LYS . 41.0 t-20 -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.552 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.422 ' HB2' ' H ' ' A' ' 60' ' ' ASP . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.72 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.627 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB3' ' A' ' 82' ' ' PHE . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.627 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' CE1' ' A' ' 71' ' ' HIS . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.464 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 HD13 ' A' ' 68' ' ' LEU . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 3' ' ' ALA . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.718 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.688 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.532 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.493 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.506 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.657 HD13 ' HG ' ' A' ' 32' ' ' LEU . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.581 ' OH ' HD11 ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.439 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 41.5 t-20 -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.417 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.485 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.47 ' HA ' HD11 ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.52 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.521 HD12 HD11 ' A' ' 95' ' ' ILE . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.592 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.592 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.524 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 68' ' ' LEU . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.521 HD11 HD12 ' A' ' 68' ' ' LEU . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.718 HG22 ' HB2' ' A' ' 3' ' ' ALA . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.624 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.674 ' HA2' HD12 ' A' ' 9' ' ' LEU . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.674 HD12 ' HA2' ' A' ' 6' ' ' GLY . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.628 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.628 HG13 ' CE1' ' A' ' 10' ' ' PHE . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.603 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.603 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.71 HD13 HD13 ' A' ' 35' ' ' ILE . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.71 HD13 HD13 ' A' ' 32' ' ' LEU . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.578 ' HB2' HG21 ' A' ' 102' ' ' THR . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.48 ' O ' HD11 ' A' ' 58' ' ' LEU . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.409 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.518 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.569 ' OH ' HD22 ' A' ' 32' ' ' LEU . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.492 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.944 HG11 ' OH ' ' A' ' 74' ' ' TYR . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 37' ' ' GLY . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.49 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.519 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.519 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.944 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.539 ' N ' HG22 ' A' ' 78' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.711 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.403 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.674 HD21 HD12 ' A' ' 94' ' ' LEU . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.674 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 65' ' ' SER . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.624 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.578 HG21 ' HB2' ' A' ' 36' ' ' PHE . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . 0.431 ' HB3' HD22 ' A' ' 62' ' ' ASN . 40.9 p90 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.243 0.545 . . . . 0.0 109.562 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.634 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.602 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.423 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.602 HG13 ' CE1' ' A' ' 10' ' ' PHE . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.629 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.629 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.692 HD11 HD13 ' A' ' 35' ' ' ILE . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.407 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.692 HD13 HD11 ' A' ' 32' ' ' LEU . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.485 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.538 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.586 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 62.6 t-20 -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.442 HG11 ' HE2' ' A' ' 74' ' ' TYR . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.485 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.431 HD22 ' HB3' ' A' ' -3' ' ' PHE . 26.3 m120 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 68' ' ' LEU . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.499 ' O ' ' O ' ' A' ' 70' ' ' ASN . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 65' ' ' SER . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 1.023 HG23 ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.463 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 10.6 m80 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.579 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.442 ' HE2' HG11 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.579 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 1.023 ' NH2' HG23 ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.234 0.54 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.535 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.618 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.565 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.554 ' CZ ' HG23 ' A' ' 20' ' ' VAL . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.565 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.571 HD12 HG22 ' A' ' 19' ' ' THR . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HB2' HD22 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.571 HG22 HD12 ' A' ' 15' ' ' LEU . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' CZ ' ' A' ' 10' ' ' PHE . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.705 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.458 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.811 ' OH ' HD22 ' A' ' 32' ' ' LEU . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.521 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 40' ' ' SER . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.554 HD13 HD23 ' A' ' 94' ' ' LEU . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 79' ' ' LYS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' A' ' 70' ' ' ASN . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 78' ' ' THR . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.521 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 75' ' ' ILE . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.534 ' O ' ' HB1' ' A' ' 72' ' ' ALA . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 90' ' ' ASP . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.504 ' HB3' HD11 ' A' ' 85' ' ' LEU . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.642 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.418 HD11 HD12 ' A' ' 68' ' ' LEU . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.535 HG22 ' HB2' ' A' ' 3' ' ' ALA . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.258 0.552 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.459 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.657 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.762 HD11 ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.762 ' HE ' HD11 ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.543 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.063 HD11 HD13 ' A' ' 35' ' ' ILE . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 1.063 HD13 HD11 ' A' ' 32' ' ' LEU . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.521 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.726 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.511 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.708 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.726 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.579 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.509 HG11 ' OH ' ' A' ' 74' ' ' TYR . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.521 ' HZ2' ' HG ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.528 ' CD1' HD23 ' A' ' 94' ' ' LEU . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.74 HD22 ' H ' ' A' ' 73' ' ' LYS . 29.4 t30 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.583 ' H ' ' ND2' ' A' ' 70' ' ' ASN . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.74 ' H ' HD22 ' A' ' 70' ' ' ASN . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.509 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.424 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD23 ' CD1' ' A' ' 68' ' ' LEU . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.502 HD11 ' HG ' ' A' ' 68' ' ' LEU . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.867 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 12' ' ' THR . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.481 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.62 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 8' ' ' THR . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HG3' HG23 ' A' ' 12' ' ' THR . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.62 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.614 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.595 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD22 ' ND1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.412 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.614 ' N ' ' NE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.521 ' CD2' ' ND2' ' A' ' 52' ' ' ASN . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.497 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.412 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.504 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.404 ' N ' HD22 ' A' ' 62' ' ' ASN . 2.9 m120 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.545 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 85' ' ' LEU . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.757 HD22 ' N ' ' A' ' 73' ' ' LYS . 12.2 t30 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.757 ' N ' HD22 ' A' ' 70' ' ' ASN . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.748 HD21 HD12 ' A' ' 94' ' ' LEU . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.484 ' HB3' HD11 ' A' ' 85' ' ' LEU . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.472 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.748 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.545 HD11 ' HA ' ' A' ' 65' ' ' SER . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.867 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -101.37 139.36 37.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 109.421 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -101.04 129.87 46.96 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.237 -0.914 . . . . 0.0 109.672 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.99 150.96 29.84 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.182 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.87 -178.55 4.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.338 -0.851 . . . . 0.0 109.793 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.96 -78.12 0.04 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -154.25 117.15 4.44 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -1.132 . . . . 0.0 109.013 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -68.9 -31.64 70.7 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.832 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.629 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -42.65 -67.25 0.28 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.361 -0.837 . . . . 0.0 109.422 -179.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.31 -37.41 83.15 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.283 -0.885 . . . . 0.0 109.629 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.48 91.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.89 99.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.212 -1.169 . . . . 0.0 109.347 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.1 p -74.61 -30.86 61.82 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.296 -0.877 . . . . 0.0 109.646 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.77 HD11 ' HE ' ' A' ' 13' ' ' ARG . 39.8 tp -56.32 -45.36 80.36 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.16 -0.962 . . . . 0.0 109.03 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 10.7 t80 -62.66 -45.12 94.28 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.467 -0.771 . . . . 0.0 108.979 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -62.86 -34.29 77.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.683 -0.636 . . . . 0.0 110.847 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.1 p -93.82 5.67 50.9 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.081 -1.012 . . . . 0.0 111.41 -178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.77 ' HE ' HD11 ' A' ' 9' ' ' LEU . 85.6 mtt-85 -140.0 -66.11 0.45 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.715 -1.241 . . . . 0.0 111.58 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -66.11 -30.36 70.84 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.907 -1.121 . . . . 0.0 110.423 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.39 -35.67 68.0 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 110.17 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -56.88 -37.45 71.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.143 -0.973 . . . . 0.0 110.564 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.8 m -111.71 -42.86 3.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.229 -0.92 . . . . 0.0 110.633 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.639 ' CE1' HD21 ' A' ' 32' ' ' LEU . 99.4 m-70 -97.45 155.83 16.75 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.117 -0.989 . . . . 0.0 110.69 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.6 m -120.24 139.92 51.96 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.508 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.3 t -67.15 -39.11 82.44 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 O-C-N 121.133 -0.98 . . . . 0.0 110.286 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -54.23 142.25 26.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.181 -0.949 . . . . 0.0 109.832 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -76.2 131.31 39.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.412 -0.805 . . . . 0.0 109.07 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 25.63 67.55 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -53.51 171.84 0.67 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.75 -18.76 22.19 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.979 2.453 . . . . 0.0 112.466 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.803 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 94.0 m-70 54.07 52.05 13.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.127 -0.983 . . . . 0.0 108.959 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -60.99 -85.88 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.178 -0.952 . . . . 0.0 110.459 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 t -67.66 -47.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.823 . . . . 0.0 110.13 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -141.45 174.41 22.94 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.9 Cg_endo -62.39 156.03 53.93 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.601 2.201 . . . . 0.0 110.89 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.803 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 5.0 m120 -102.64 130.33 49.5 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.919 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.757 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.0 mm? -80.5 -117.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.484 -0.76 . . . . 0.0 110.215 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 38.9 t60 73.23 89.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.31 0.576 . . . . 0.0 110.384 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.08 3.43 56.82 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 120.093 -1.051 . . . . 0.0 111.278 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -80.38 -11.24 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.559 -1.553 . . . . 0.0 110.07 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.516 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.9 m-85 -51.73 -27.89 13.36 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.138 -0.976 . . . . 0.0 109.499 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.81 30.33 8.18 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mmt85 -132.26 170.97 14.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.183 -1.186 . . . . 0.0 110.264 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -89.16 152.47 21.6 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.659 -0.651 . . . . 0.0 109.582 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.477 ' OG ' ' CD1' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -61.4 131.6 50.77 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.58 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.73 -0.69 42.16 Favored Glycine 0 N--CA 1.486 2.022 0 C-N-CA 120.1 -1.048 . . . . 0.0 111.168 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -101.64 118.35 36.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.948 -1.325 . . . . 0.0 110.256 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -141.46 164.18 30.91 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.06 -51.54 3.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 110.201 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.431 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -78.28 -69.35 1.4 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.595 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.5 t80 -112.42 125.19 53.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -1.111 . . . . 0.0 110.921 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.595 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 47.2 p -72.69 150.44 42.92 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 74.7 m-85 -62.99 174.39 1.11 Allowed 'General case' 0 C--N 1.293 -1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.2 m -60.51 147.09 42.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.439 -0.788 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.0 -37.74 34.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.282 -0.886 . . . . 0.0 109.961 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.34 -52.41 63.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.134 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.488 ' O ' ' O ' ' A' ' 55' ' ' LYS . 38.7 t-20 -61.23 -42.68 99.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.364 -0.835 . . . . 0.0 109.486 179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.596 HD11 ' O ' ' A' ' 48' ' ' TYR . 99.0 mt -61.31 -36.35 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.423 -0.798 . . . . 0.0 109.774 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.0 tttm -56.14 -42.61 77.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.007 . . . . 0.0 108.415 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' ASN . 25.6 mttm -96.87 128.56 43.95 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.569 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.2 OUTLIER -134.65 127.87 31.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.074 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.7 t -133.78 137.92 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.442 -0.786 . . . . 0.0 110.003 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.9 tp -55.7 143.89 29.0 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.5 ' O ' ' O ' ' A' ' 36' ' ' PHE . 30.9 m95 -99.82 144.62 28.67 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.305 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.7 t0 -152.35 160.74 43.27 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.494 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 50.5 mp0 -56.98 -39.35 74.48 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.845 -1.16 . . . . 0.0 108.954 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -71.92 -45.14 62.23 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.28 -43.21 95.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.337 -0.852 . . . . 0.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.516 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 59.7 mtp -62.43 -34.41 76.71 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.224 -0.922 . . . . 0.0 110.093 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.503 ' O ' ' NH1' ' A' ' 91' ' ' ARG . 21.5 m -57.22 -42.76 82.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.014 -1.054 . . . . 0.0 109.287 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -66.27 -38.93 88.97 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.146 -0.971 . . . . 0.0 109.45 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 72.5 t80 -63.54 -43.63 96.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.343 -0.848 . . . . 0.0 110.069 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.748 HD12 HD23 ' A' ' 85' ' ' LEU . 3.0 mm? -52.94 -42.23 65.25 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.115 -0.991 . . . . 0.0 109.677 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.6 m -51.35 -39.7 57.6 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' A' ' 72' ' ' ALA . 45.1 t30 -139.66 120.29 14.21 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.597 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -51.11 -4.6 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.0 109.664 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -160.13 80.92 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.871 -1.143 . . . . 0.0 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -94.96 -78.76 0.44 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.279 -0.888 . . . . 0.0 109.037 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -71.88 -14.41 61.94 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.477 ' CD1' ' OG ' ' A' ' 40' ' ' SER . 3.5 mt -117.94 67.93 6.33 Favored Pre-proline 0 N--CA 1.488 1.426 0 O-C-N 121.652 -0.655 . . . . 0.0 109.671 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.44 -31.51 91.48 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.975 1.784 . . . . 0.0 111.762 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.7 -24.74 49.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 97.3 m -68.95 142.89 54.57 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.642 -0.916 . . . . 0.0 109.747 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -77.08 164.31 25.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.439 -0.788 . . . . 0.0 109.479 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.415 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.9 mtm -129.19 154.96 46.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.367 -0.833 . . . . 0.0 109.254 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . -179.34 24.4 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.03 -1.043 . . . . 0.0 110.554 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 70.3 t80 -101.02 144.5 29.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.961 -1.087 . . . . 0.0 109.248 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.93 -50.84 49.09 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . 153.44 84.52 0.05 OUTLIER Glycine 0 N--CA 1.493 2.453 0 O-C-N 120.958 -1.319 . . . . 0.0 110.376 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.748 HD23 HD12 ' A' ' 68' ' ' LEU . 9.6 tp -78.96 25.82 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -1.189 . . . . 0.0 109.018 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLY . 61.0 mttp -54.01 -30.21 46.53 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.361 -0.837 . . . . 0.0 109.751 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -59.94 121.4 11.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 109.179 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.575 ' OE1' ' NH2' ' A' ' 91' ' ' ARG . 77.5 mm-40 -64.96 -30.92 71.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 110.168 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -57.03 -46.85 82.07 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.105 -0.997 . . . . 0.0 110.103 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.401 ' HB3' HD11 ' A' ' 85' ' ' LEU . 83.0 m-20 -70.03 -49.44 51.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.014 -1.054 . . . . 0.0 109.423 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.575 ' NH2' ' OE1' ' A' ' 88' ' ' GLU . 38.9 ttp180 -59.11 -39.93 83.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 110.394 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.4 ' O ' ' OG1' ' A' ' 96' ' ' THR . 77.5 m-20 -63.21 -55.19 27.08 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.127 -0.983 . . . . 0.0 110.557 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -64.56 -38.74 92.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.632 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.604 HD21 ' CMB' ' A' ' 104' ' ' HEC . 55.9 tp -52.15 -63.31 1.18 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.705 0.764 . . . . 0.0 110.261 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.52 -30.04 48.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.761 HG22 ' HB2' ' A' ' 3' ' ' ALA . 29.1 m -53.08 -40.71 64.28 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.019 -1.051 . . . . 0.0 108.713 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -74.96 -45.94 38.9 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.436 -0.79 . . . . 0.0 109.737 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.6 mt -60.29 -45.83 91.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.302 -0.874 . . . . 0.0 109.357 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' O ' ' N ' ' A' ' 103' ' ' GLU . 17.1 tttp -61.64 -37.95 85.9 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.399 -0.813 . . . . 0.0 109.153 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -59.13 -41.53 88.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.407 -0.808 . . . . 0.0 109.076 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.06 -49.99 45.58 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.402 ' O ' ' C ' ' A' ' 103' ' ' GLU . 45.1 m -62.74 -31.22 72.12 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.1 tt0 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.792 . . . . 0.0 109.472 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.682 HMD1 ' CBD' ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -109.06 155.4 20.99 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.363 -0.836 . . . . 0.0 109.521 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -134.25 160.58 37.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.588 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -81.82 135.52 35.45 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 109.603 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -118.1 -164.66 1.03 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.756 . . . . 0.0 109.474 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -173.21 -74.43 0.05 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.7 t -140.19 104.3 4.79 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.226 -1.161 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.18 -28.49 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.392 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.459 ' HE3' ' H ' ' A' ' 4' ' ' LYS . 6.5 mtmt -57.19 -45.93 83.3 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.358 -0.839 . . . . 0.0 109.66 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -64.79 -43.02 94.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.14 -0.975 . . . . 0.0 109.44 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.52 -34.15 88.33 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.17 78.72 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.36 -1.082 . . . . 0.0 109.708 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.7 p -76.56 -29.58 56.7 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.719 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.555 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 37.0 tp -57.32 -45.41 84.25 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.203 -0.935 . . . . 0.0 109.042 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.608 ' CE1' HG13 ' A' ' 20' ' ' VAL . 24.0 t80 -64.52 -43.92 92.53 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.414 -0.804 . . . . 0.0 108.989 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -62.4 -35.83 80.43 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.569 -0.707 . . . . 0.0 110.971 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.2 p -93.91 5.33 52.04 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.07 -1.019 . . . . 0.0 111.391 -178.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.555 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 92.8 mtt180 -138.48 -66.85 0.48 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.801 -1.187 . . . . 0.0 111.511 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.74 -28.78 69.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.869 -1.144 . . . . 0.0 110.112 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.5 tp -54.64 -35.83 63.9 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.966 -1.084 . . . . 0.0 109.825 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.554 ' O ' HG21 ' A' ' 28' ' ' VAL . 94.6 mt-30 -57.33 -37.14 72.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.186 -0.946 . . . . 0.0 110.276 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.7 m -113.57 -44.85 3.16 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.195 -0.941 . . . . 0.0 110.806 -179.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.464 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.2 m-70 -99.83 155.37 17.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.958 -1.089 . . . . 0.0 111.136 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.621 HG22 ' H ' ' A' ' 21' ' ' GLU . 26.5 m -127.99 128.29 44.76 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.618 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 31.4 m -72.61 -12.79 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.876 -1.14 . . . . 0.0 109.847 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' H ' HG22 ' A' ' 19' ' ' THR . 83.8 tt0 -55.19 144.08 25.51 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.936 -1.103 . . . . 0.0 108.773 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -52.88 -29.89 30.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.927 . . . . 0.0 109.015 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -144.48 92.97 0.16 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.502 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -109.4 166.13 12.56 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.451 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 57.1 Cg_endo -72.49 139.03 30.77 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.717 2.278 . . . . 0.0 111.658 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.642 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.6 m-70 -96.64 48.74 1.08 Allowed 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.269 -0.895 . . . . 0.0 108.591 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 ttpm? -53.05 -46.93 68.75 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.228 -0.92 . . . . 0.0 110.002 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -97.54 -69.89 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.075 -1.015 . . . . 0.0 109.282 179.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -130.96 173.07 20.41 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -51.45 144.87 30.43 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.603 2.202 . . . . 0.0 111.459 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.642 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.0 m120 -97.74 124.12 41.96 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.21 -0.932 . . . . 0.0 109.424 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.775 HD13 HD13 ' A' ' 35' ' ' ILE . 17.5 mt -105.43 151.99 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.349 -0.844 . . . . 0.0 111.211 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.618 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 81.5 t60 -173.71 102.18 0.11 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.18 9.14 62.34 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 32' ' ' LEU . 35.6 pt -65.98 -13.06 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.987 -1.302 . . . . 0.0 109.506 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.495 ' O ' ' O ' ' A' ' 59' ' ' TRP . 16.3 m-85 -49.16 -30.29 6.58 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.424 -0.798 . . . . 0.0 109.841 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.52 33.46 5.93 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.024 -1.231 . . . . 0.0 110.024 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.7 169.12 18.05 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.124 -1.221 . . . . 0.0 110.361 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -90.19 152.41 21.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.563 -0.71 . . . . 0.0 109.88 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -56.09 131.04 46.53 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.436 -0.79 . . . . 0.0 108.87 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.18 2.48 51.33 Favored Glycine 0 N--CA 1.486 2.018 0 C-N-CA 119.581 -1.295 . . . . 0.0 110.318 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -107.25 116.77 32.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.251 -1.147 . . . . 0.0 109.885 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -141.85 144.09 33.69 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.484 -0.76 . . . . 0.0 109.356 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -80.97 -35.48 32.05 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.451 -0.781 . . . . 0.0 109.124 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.15 -70.74 1.33 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.575 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.6 t80 -132.73 140.19 47.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -1.1 . . . . 0.0 110.913 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.575 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 51.5 p -66.87 157.84 32.09 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.612 ' OH ' HD22 ' A' ' 32' ' ' LEU . 12.2 m-85 -69.55 -163.8 0.06 Allowed 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.461 -0.775 . . . . 0.0 110.009 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -69.43 148.96 48.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.523 -0.736 . . . . 0.0 109.151 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 51' ' ' ALA . 30.2 p-10 -53.12 -38.52 62.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.087 -1.008 . . . . 0.0 109.754 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . . . -68.51 -47.52 66.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.908 -1.12 . . . . 0.0 108.81 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.68 HD22 ' CGD' ' A' ' 104' ' ' HEC . 44.8 t-20 -58.88 -43.06 90.86 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.487 -0.758 . . . . 0.0 109.532 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.445 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 97.6 mt -63.74 -31.82 54.57 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.385 -0.822 . . . . 0.0 109.609 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -55.82 -43.73 77.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.114 -0.991 . . . . 0.0 108.82 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -103.8 125.83 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -125.36 129.49 50.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.327 -0.858 . . . . 0.0 109.789 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.453 ' H ' ' HB2' ' A' ' 40' ' ' SER . 58.4 t -130.93 136.77 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -54.32 143.22 23.98 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.158 -0.964 . . . . 0.0 108.742 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.495 ' O ' ' O ' ' A' ' 36' ' ' PHE . 32.5 m95 -100.26 144.45 29.26 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.427 -0.796 . . . . 0.0 110.16 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.0 t0 -145.61 160.07 42.2 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.54 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.6 mt-10 -54.91 -37.92 66.98 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.053 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -77.82 -45.63 23.83 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.376 -0.827 . . . . 0.0 109.885 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -61.72 -41.76 98.05 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.151 -0.968 . . . . 0.0 110.061 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.424 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 61.2 mtp -62.68 -35.51 79.9 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.214 -0.929 . . . . 0.0 109.899 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 86.7 p -57.2 -35.75 70.01 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.087 -1.008 . . . . 0.0 109.199 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -66.38 -40.24 89.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.213 -0.929 . . . . 0.0 109.272 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.591 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 67.8 t80 -65.52 -43.04 91.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.321 -0.862 . . . . 0.0 109.94 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.0 -40.28 60.74 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.141 -0.974 . . . . 0.0 109.576 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 m -57.79 -40.58 80.19 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.053 -1.03 . . . . 0.0 108.725 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.561 HD22 ' C ' ' A' ' 72' ' ' ALA . 35.8 t30 -137.93 124.3 20.63 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.591 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -57.65 1.32 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.035 -1.041 . . . . 0.0 109.618 -179.813 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HB2' HG22 ' A' ' 78' ' ' THR . . . -159.54 84.44 0.77 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.835 -1.166 . . . . 0.0 110.419 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -97.83 -78.16 0.49 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.052 -1.03 . . . . 0.0 108.412 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -74.44 -29.43 61.47 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.331 -0.856 . . . . 0.0 108.952 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.472 HD12 ' HE1' ' A' ' 67' ' ' TYR . 7.5 mt -70.74 115.64 37.76 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.422 -0.799 . . . . 0.0 109.652 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.572 ' O ' ' C ' ' A' ' 77' ' ' GLY . 42.6 Cg_exo -51.13 131.47 35.48 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.044 1.829 . . . . 0.0 113.048 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.572 ' C ' ' O ' ' A' ' 76' ' ' PRO . . . 14.88 56.24 0.01 OUTLIER Glycine 0 N--CA 1.5 2.965 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.78 HG22 ' HB2' ' A' ' 72' ' ' ALA . 0.5 OUTLIER -71.23 169.33 15.39 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.028 -1.278 . . . . 0.0 108.844 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.493 ' N ' HG23 ' A' ' 78' ' ' THR . 24.4 mttm -64.88 135.66 55.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.988 -1.07 . . . . 0.0 108.918 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -126.56 151.96 47.21 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.391 -0.818 . . . . 0.0 109.334 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.644 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . -172.35 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.09 -1.006 . . . . 0.0 110.363 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 69.5 t80 -105.89 142.61 35.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.133 -0.98 . . . . 0.0 109.552 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.81 93.0 Favored Glycine 0 N--CA 1.495 2.582 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 125.76 132.58 3.77 Favored Glycine 0 N--CA 1.496 2.695 0 O-C-N 121.129 -1.218 . . . . 0.0 110.136 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.6 mt -92.16 78.05 5.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.359 -1.083 . . . . 0.0 108.744 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -59.49 -36.93 76.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.443 -0.785 . . . . 0.0 109.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mttp -84.12 128.93 34.88 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.256 -0.902 . . . . 0.0 109.533 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 55.8 mp0 -64.69 -28.42 69.59 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.34 -0.85 . . . . 0.0 109.598 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -56.07 -44.71 79.19 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -64.57 -49.68 70.24 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.076 -1.015 . . . . 0.0 108.953 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -59.32 -46.98 87.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.472 -0.768 . . . . 0.0 110.223 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.5 -42.2 87.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.93 . . . . 0.0 110.195 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -60.95 -39.26 88.85 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.41 -0.806 . . . . 0.0 109.815 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.04 -64.25 0.92 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.201 -0.937 . . . . 0.0 110.105 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.3 mt -54.72 -35.5 33.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 O-C-N 121.68 -0.638 . . . . 0.0 110.02 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.4 m -56.44 -39.84 73.79 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.15 -0.969 . . . . 0.0 108.648 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -82.06 -49.02 10.69 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.409 -0.807 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.8 mt -53.76 -47.45 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.194 -0.941 . . . . 0.0 108.964 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.54 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 22.3 tttm -59.9 -38.41 82.19 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.556 -0.715 . . . . 0.0 109.226 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -58.97 -44.09 91.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 109.105 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.38 -49.02 59.32 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 38.3 m -62.15 -31.0 71.43 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.723 . . . . 0.0 109.474 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.68 ' CGD' HD22 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.21 152.55 24.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.325 -0.859 . . . . 0.0 109.531 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -136.53 162.55 32.8 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.437 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -85.62 139.02 31.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.365 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.27 -145.48 0.4 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.395 -0.816 . . . . 0.0 109.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 171.39 -73.15 0.11 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 t -154.37 118.55 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.256 -1.144 . . . . 0.0 108.927 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.34 -34.14 76.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.147 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.587 ' CE ' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -61.49 -41.61 97.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.143 -0.973 . . . . 0.0 109.9 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 57.5 mttp -62.59 -38.26 89.45 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.054 -1.029 . . . . 0.0 109.736 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.01 -38.14 92.54 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.02 -38.76 92.46 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.264 -1.139 . . . . 0.0 109.156 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.9 m -61.99 -43.89 97.89 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.365 -0.834 . . . . 0.0 109.594 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.5 tp -67.59 -42.23 82.83 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.207 -0.933 . . . . 0.0 109.825 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 25.7 t80 -62.68 -50.15 72.29 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.307 -0.871 . . . . 0.0 110.745 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -68.0 -21.22 65.06 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.24 -0.913 . . . . 0.0 110.611 -178.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.6 p -98.42 3.44 48.41 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.984 -1.073 . . . . 0.0 110.899 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -147.6 -63.02 0.27 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.433 -1.417 . . . . 0.0 112.165 -179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.45 -30.17 70.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.937 -1.102 . . . . 0.0 110.947 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.23 -34.83 64.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.835 -1.165 . . . . 0.0 110.09 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -56.35 -36.67 69.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.061 -1.024 . . . . 0.0 110.378 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.3 m -114.08 -46.1 3.02 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.218 -0.926 . . . . 0.0 110.79 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.1 m-70 -92.94 137.89 31.96 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.087 -1.008 . . . . 0.0 109.933 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 21' ' ' GLU . 4.4 m -107.85 -10.84 15.48 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.144 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.697 HG12 ' O ' ' A' ' 20' ' ' VAL . 55.4 t 50.06 8.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.683 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 19' ' ' THR . 84.3 tt0 -91.65 139.9 30.24 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.258 -0.901 . . . . 0.0 108.664 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -61.08 120.59 10.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.162 -0.961 . . . . 0.0 109.228 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.54 37.87 45.47 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.83 156.02 28.88 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.18 -17.59 54.84 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.979 2.453 . . . . 0.0 113.173 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.742 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 90.3 m-70 56.41 46.36 20.97 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.081 -1.012 . . . . 0.0 109.039 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.35 -48.33 77.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.0 110.405 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -97.86 -74.5 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.018 -1.051 . . . . 0.0 109.594 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.91 172.87 16.01 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.04 -1.624 . . . . 0.0 109.04 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -49.87 145.35 18.75 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 121.901 1.734 . . . . 0.0 110.816 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.742 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.8 m120 -90.87 132.21 36.04 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.985 -1.072 . . . . 0.0 109.352 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 35' ' ' ILE . 20.4 tp -94.58 131.02 40.77 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.616 -0.678 . . . . 0.0 110.154 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.592 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -172.95 120.6 0.37 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.927 -1.108 . . . . 0.0 111.203 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.22 25.83 69.93 Favored Glycine 0 N--CA 1.494 2.519 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.397 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.523 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.1 pt -95.86 -13.46 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.754 -1.439 . . . . 0.0 110.054 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.664 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 17.8 m-85 -47.07 -27.49 1.37 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.629 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.5 28.76 8.76 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -133.67 170.46 15.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.126 -1.22 . . . . 0.0 110.068 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -90.28 146.81 23.94 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.412 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 2.2 m -54.01 138.57 36.91 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.84 -13.81 53.08 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -101.17 117.77 35.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.125 -1.221 . . . . 0.0 109.687 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -142.43 137.6 30.49 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.364 -0.835 . . . . 0.0 109.409 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -75.49 -37.99 59.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.408 -0.807 . . . . 0.0 109.222 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.436 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -70.0 -63.9 3.12 Favored Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.712 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.7 t80 -147.72 147.4 29.89 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.163 -1.198 . . . . 0.0 110.854 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.678 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 19.6 p -69.75 147.42 50.52 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 61.4 m-85 -70.96 -170.79 0.48 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.509 -0.744 . . . . 0.0 110.825 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.437 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 59.5 m -71.65 150.64 44.41 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.439 -0.788 . . . . 0.0 109.869 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -49.54 -39.02 33.02 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.295 -0.878 . . . . 0.0 110.032 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.6 -54.98 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.898 -1.126 . . . . 0.0 108.634 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.497 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.2 t-20 -58.48 -42.73 88.2 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.528 -0.732 . . . . 0.0 109.218 178.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.637 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.4 mt -66.08 -37.79 80.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.382 -0.824 . . . . 0.0 109.731 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -56.25 -42.83 77.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.085 -1.01 . . . . 0.0 108.475 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 26.6 mttt -99.48 119.86 38.7 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.496 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 27.9 p-10 -127.24 123.83 37.45 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.246 -0.909 . . . . 0.0 109.709 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.673 HG11 ' OH ' ' A' ' 74' ' ' TYR . 96.6 t -132.44 136.31 56.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.917 . . . . 0.0 110.647 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp -49.68 145.55 5.05 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.458 ' O ' ' O ' ' A' ' 36' ' ' PHE . 24.4 m95 -104.0 144.15 31.92 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.732 0.777 . . . . 0.0 110.453 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.494 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 50.9 t0 -145.25 157.54 44.04 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 50.8 mp0 -55.79 -38.96 70.63 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.814 -1.179 . . . . 0.0 109.185 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -71.88 -44.43 63.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.877 . . . . 0.0 109.799 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.98 -41.61 97.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.19 -0.944 . . . . 0.0 110.211 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.664 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 67.2 mtp -61.75 -34.42 75.81 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.05 -1.032 . . . . 0.0 109.722 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.6 m -56.15 -38.36 70.74 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.092 -1.005 . . . . 0.0 109.11 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.05 -40.83 97.15 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.189 -0.944 . . . . 0.0 109.149 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.525 ' O ' ' O ' ' A' ' 70' ' ' ASN . 54.6 t80 -66.27 -42.84 87.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.347 -0.846 . . . . 0.0 109.961 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 68' ' ' LEU . 1.9 mm? -48.95 -38.96 24.56 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -47.96 -37.95 15.67 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.152 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.532 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 41.9 t-20 -140.77 -158.87 0.9 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.394 -0.816 . . . . 0.0 109.123 179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.532 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -123.63 9.86 9.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.211 -0.931 . . . . 0.0 109.314 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -173.43 2.65 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.334 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -55.88 -42.6 76.15 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.901 -1.124 . . . . 0.0 108.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.673 ' OH ' HG11 ' A' ' 57' ' ' VAL . 47.8 t80 -67.64 -36.33 80.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.386 -0.821 . . . . 0.0 109.036 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.12 86.24 42.34 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.553 -0.717 . . . . 0.0 109.712 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -58.08 141.21 96.23 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.195 1.93 . . . . 0.0 111.746 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.34 4.55 70.9 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.512 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 1.7 m -90.84 164.73 13.95 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.487 -1.007 . . . . 0.0 109.365 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.512 ' N ' ' CG2' ' A' ' 78' ' ' THR . 23.7 mttm -72.78 144.82 47.42 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.409 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.5 mtm -133.46 155.62 49.22 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.451 -0.78 . . . . 0.0 108.995 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.454 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . 179.67 24.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.962 -1.086 . . . . 0.0 110.337 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.552 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 86.1 t80 -112.73 148.02 35.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.64 -48.5 84.38 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.552 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 128.59 126.24 2.84 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 121.203 -1.175 . . . . 0.0 110.173 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -85.26 71.47 10.85 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.342 -1.093 . . . . 0.0 108.696 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 mttp -58.58 -34.03 70.62 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.535 -0.728 . . . . 0.0 109.783 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -84.81 126.54 33.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.235 -0.915 . . . . 0.0 109.47 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.39 -27.44 69.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -55.56 -46.6 77.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.74 -51.31 69.88 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.398 -0.814 . . . . 0.0 109.193 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 49.1 ttp180 -56.82 -44.02 81.59 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.415 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -63.88 -43.55 95.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -64.82 -41.43 95.77 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 0.0 110.106 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.87 -62.33 1.82 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.394 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 65' ' ' SER . 22.0 mt -53.72 -36.97 30.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 O-C-N 121.73 -0.607 . . . . 0.0 109.812 -178.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 32.2 m -57.89 -38.65 76.2 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.054 -1.029 . . . . 0.0 108.237 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -80.36 -48.66 12.61 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.587 -0.695 . . . . 0.0 109.88 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.5 mt -55.78 -49.47 73.1 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 109.456 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 103' ' ' GLU . 77.2 tttt -60.48 -39.52 87.94 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.45 -0.781 . . . . 0.0 109.356 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -59.57 -43.25 93.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.455 -0.778 . . . . 0.0 109.116 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.86 63.11 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.642 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.52 -30.85 71.59 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.549 -0.72 . . . . 0.0 109.451 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.706 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.34 0.59 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.59 -33.54 74.07 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.174 -0.954 . . . . 0.0 109.468 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -136.3 162.6 32.56 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.313 -0.867 . . . . 0.0 109.449 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -85.09 139.39 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.411 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -112.35 -144.96 0.39 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.471 -0.768 . . . . 0.0 109.643 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 165.7 -82.75 0.1 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 109.81 4.98 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.312 -1.11 . . . . 0.0 109.1 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.593 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.81 -22.85 67.11 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.0 109.056 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -56.83 -44.87 82.51 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.49 -0.756 . . . . 0.0 109.26 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -63.46 -39.23 93.92 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.26 -0.9 . . . . 0.0 109.36 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.91 -35.5 87.1 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.72 99.59 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.26 -1.141 . . . . 0.0 109.516 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 12' ' ' THR . 32.3 m -62.12 -44.51 96.49 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.299 -0.876 . . . . 0.0 109.371 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.478 ' O ' ' OG1' ' A' ' 12' ' ' THR . 22.8 tp -68.74 -37.7 79.6 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.003 -1.06 . . . . 0.0 109.125 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 14' ' ' CYS . 34.5 t80 -60.08 -51.76 68.26 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.409 -0.807 . . . . 0.0 110.144 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -66.59 -24.19 66.3 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.155 -0.965 . . . . 0.0 110.638 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.869 HG23 ' O ' ' A' ' 8' ' ' THR . 51.4 p -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.892 -1.13 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 82' ' ' PHE . 93.6 mtt-85 -144.03 -59.82 0.39 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.71 -1.244 . . . . 0.0 111.112 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -44.51 -56.51 4.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.167 -0.958 . . . . 0.0 110.332 -179.284 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -58.6 -36.3 73.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.947 . . . . 0.0 110.422 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.88 -36.97 75.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.595 -179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.438 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.8 m -111.6 -49.2 3.01 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.098 -1.001 . . . . 0.0 110.767 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 95.3 m-70 -99.94 151.53 21.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.937 -1.102 . . . . 0.0 110.505 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.4 p -124.13 150.86 44.6 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.594 HG23 ' HG2' ' A' ' 21' ' ' GLU . 31.2 m -97.85 -131.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.926 -1.109 . . . . 0.0 109.657 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HG2' HG23 ' A' ' 20' ' ' VAL . 78.0 mm-40 49.78 178.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.167 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -93.97 128.98 40.6 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.125 -0.984 . . . . 0.0 109.498 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.0 39.16 46.82 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.493 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -57.19 150.79 28.56 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.476 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 60.8 Cg_endo -74.03 142.52 31.27 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.48 2.12 . . . . 0.0 111.671 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.468 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 70.7 m-70 -89.24 64.74 7.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.026 -1.046 . . . . 0.0 109.227 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -53.48 -41.1 65.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.1 -1.0 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.505 HG12 ' N ' ' A' ' 29' ' ' GLY . 92.3 t -139.3 -93.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.059 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.505 ' N ' HG12 ' A' ' 28' ' ' VAL . . . -80.71 163.45 46.02 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.48 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 9.2 Cg_exo -44.67 154.57 0.33 Allowed 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.521 2.147 . . . . 0.0 111.282 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' OD1' ' O ' ' A' ' 24' ' ' GLY . 8.4 m120 -93.13 132.64 37.08 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.219 -0.925 . . . . 0.0 109.233 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD11 HD13 ' A' ' 35' ' ' ILE . 6.2 tp -105.2 130.63 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.54 -0.725 . . . . 0.0 110.94 -178.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.586 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -174.53 115.62 0.19 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.26 -0.9 . . . . 0.0 110.318 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.98 16.09 73.29 Favored Glycine 0 N--CA 1.493 2.452 0 C-N-CA 120.274 -0.965 . . . . 0.0 111.307 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.569 HD13 HD11 ' A' ' 32' ' ' LEU . 2.0 pt -78.34 -15.15 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 120.623 -1.516 . . . . 0.0 109.773 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' O ' ' O ' ' A' ' 59' ' ' TRP . 22.5 m-85 -47.69 -29.76 3.28 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 109.719 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -109.24 26.5 14.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -131.23 168.97 16.6 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.062 -1.258 . . . . 0.0 110.169 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -87.76 155.58 19.83 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.494 -0.754 . . . . 0.0 109.688 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.2 OUTLIER -59.63 130.42 46.73 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.502 -0.749 . . . . 0.0 110.392 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.06 -0.56 57.45 Favored Glycine 0 N--CA 1.486 1.998 0 C-N-CA 120.042 -1.075 . . . . 0.0 111.316 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -98.24 120.55 38.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.91 -1.347 . . . . 0.0 109.898 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.818 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -137.3 155.65 49.19 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -98.85 -33.35 10.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.192 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.64 -69.84 1.34 Allowed Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' CE1' ' O ' ' A' ' 47' ' ' SER . 5.8 t80 -119.03 129.05 54.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.477 -1.014 . . . . 0.0 110.808 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.537 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.9 m -67.57 142.5 56.47 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.818 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 93.7 m-85 -69.18 -177.79 1.17 Allowed 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.224 -0.923 . . . . 0.0 110.66 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 51' ' ' ALA . 56.1 m -67.99 148.3 51.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.567 -0.708 . . . . 0.0 109.998 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -52.72 -37.36 59.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.408 -0.807 . . . . 0.0 110.312 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' H ' HG22 ' A' ' 49' ' ' THR . . . -59.99 -57.93 10.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.879 -1.138 . . . . 0.0 109.317 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 55' ' ' LYS . 52.6 t-20 -58.5 -42.91 88.72 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.395 -0.815 . . . . 0.0 109.512 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.474 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.5 mt -65.52 -33.09 61.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.328 -0.858 . . . . 0.0 109.779 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -55.34 -41.83 73.0 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.046 -1.033 . . . . 0.0 108.439 179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' O ' ' O ' ' A' ' 52' ' ' ASN . 42.5 tttt -108.34 120.41 42.29 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.578 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.65 130.6 53.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.27 -0.894 . . . . 0.0 109.869 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.747 HG11 ' CE1' ' A' ' 74' ' ' TYR . 41.7 t -129.54 137.49 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.457 -0.777 . . . . 0.0 109.861 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -55.61 144.76 25.51 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.2 m95 -100.57 143.17 31.06 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.382 -0.824 . . . . 0.0 110.659 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -144.1 158.71 43.55 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.577 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.67 -38.77 70.04 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.885 -1.134 . . . . 0.0 109.123 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.79 -43.91 52.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.317 -0.864 . . . . 0.0 109.854 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -63.82 -41.45 97.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.194 -0.942 . . . . 0.0 110.042 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HD13 ' A' ' 68' ' ' LEU . 67.4 mtp -63.16 -35.46 80.38 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.294 -0.879 . . . . 0.0 110.091 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.4 m -57.15 -41.76 79.73 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.024 -1.047 . . . . 0.0 109.23 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.92 -39.29 93.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.19 -0.944 . . . . 0.0 108.98 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 70' ' ' ASN . 66.5 t80 -65.04 -43.43 92.38 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 64' ' ' MET . 7.3 mp -50.75 -34.85 28.81 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.445 -0.785 . . . . 0.0 109.715 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 28.1 m -50.56 -39.15 48.6 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.115 -0.99 . . . . 0.0 108.845 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.506 ' O ' ' O ' ' A' ' 67' ' ' TYR . 79.8 m-20 -139.51 -156.49 0.68 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.422 -0.799 . . . . 0.0 109.029 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.402 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -125.48 3.19 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.274 -0.892 . . . . 0.0 109.566 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.64 10.43 0.49 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.079 -1.013 . . . . 0.0 110.463 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -58.21 -44.0 87.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.823 -1.173 . . . . 0.0 109.325 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.747 ' CE1' HG11 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -78.27 -30.14 48.39 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.226 -0.922 . . . . 0.0 109.077 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.418 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -125.97 80.13 68.03 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.481 -0.762 . . . . 0.0 109.45 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.39 144.76 90.71 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.598 2.199 . . . . 0.0 112.146 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.92 8.63 75.65 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.127 -1.589 . . . . 0.0 109.127 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 79.1 m -97.18 152.99 18.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.279 -1.13 . . . . 0.0 109.837 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -56.36 146.76 23.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.451 -0.781 . . . . 0.0 109.672 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.5 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -135.52 155.96 49.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.32 -0.862 . . . . 0.0 109.213 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 176.13 42.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.957 -1.089 . . . . 0.0 110.444 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.614 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 36.6 t80 -113.65 151.11 32.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.108 -0.995 . . . . 0.0 109.816 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.614 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -55.02 -85.96 0.02 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.28 108.87 0.21 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.645 -1.264 . . . . 0.0 110.512 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.4 mt -79.34 64.51 4.26 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.289 -1.124 . . . . 0.0 108.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -56.32 -37.25 69.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.376 -0.828 . . . . 0.0 109.806 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.16 132.98 34.13 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.314 -0.866 . . . . 0.0 109.326 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.416 ' CB ' HH21 ' A' ' 91' ' ' ARG . 21.8 pt-20 -67.88 -19.75 65.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.253 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.5 tttt -57.13 -46.56 82.57 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.296 -0.877 . . . . 0.0 109.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -60.38 -46.42 90.04 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.366 -0.834 . . . . 0.0 109.115 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.416 HH21 ' CB ' ' A' ' 88' ' ' GLU . 61.2 mtm180 -59.74 -40.22 87.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.862 . . . . 0.0 109.999 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -68.28 -56.17 9.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.056 -1.028 . . . . 0.0 110.524 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.54 -38.99 89.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.201 -0.937 . . . . 0.0 109.255 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.687 HD21 HBB3 ' A' ' 104' ' ' HEC . 11.6 tp -57.85 -55.13 38.9 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.515 -0.741 . . . . 0.0 109.97 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.87 -32.73 59.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.561 -0.712 . . . . 0.0 110.244 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.593 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.4 m -51.78 -41.65 61.82 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.126 -0.983 . . . . 0.0 108.792 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -72.72 -44.82 61.21 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.382 -0.824 . . . . 0.0 109.575 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.95 -50.31 74.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.632 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.577 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 31.1 tttt -62.2 -39.23 92.05 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.304 -0.873 . . . . 0.0 109.217 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -59.64 -43.22 93.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.352 -0.842 . . . . 0.0 109.151 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.4 -49.25 61.42 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.0 m -62.96 -31.07 72.1 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.539 -0.726 . . . . 0.0 109.505 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.882 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -111.32 153.26 26.22 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.408 -0.808 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -135.31 162.25 33.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.315 -0.866 . . . . 0.0 109.329 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -87.13 138.53 31.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.087 -1.008 . . . . 0.0 109.683 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -110.23 -142.24 0.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.471 -0.768 . . . . 0.0 109.604 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 163.32 -86.34 0.11 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.26 103.21 4.86 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.256 -1.143 . . . . 0.0 109.159 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.728 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.43 -20.91 66.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.376 -0.828 . . . . 0.0 109.462 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -55.56 -50.29 70.44 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.291 -0.881 . . . . 0.0 109.526 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -67.22 -42.79 83.45 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.284 -0.885 . . . . 0.0 109.677 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.13 -35.4 91.69 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.02 -47.22 86.0 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.219 -1.165 . . . . 0.0 109.43 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.0 p -76.56 -28.93 56.44 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.256 -0.903 . . . . 0.0 109.558 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.511 HD11 ' HE ' ' A' ' 13' ' ' ARG . 36.6 tp -55.16 -48.0 74.37 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.168 -0.957 . . . . 0.0 109.178 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 20.6 t80 -63.83 -43.47 96.12 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -63.92 -36.04 82.63 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.547 -0.72 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -93.49 6.73 47.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.175 -0.953 . . . . 0.0 111.419 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.511 ' HE ' HD11 ' A' ' 9' ' ' LEU . 82.7 mtt-85 -141.41 -66.74 0.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.693 -1.254 . . . . 0.0 111.609 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 m -67.17 -30.9 70.99 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.949 -1.094 . . . . 0.0 110.512 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.72 -37.02 70.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.861 -1.149 . . . . 0.0 110.584 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -53.64 -40.75 66.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.03 -1.044 . . . . 0.0 110.254 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.4 m -106.15 -38.74 6.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.158 -0.963 . . . . 0.0 110.345 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.36 162.04 13.19 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 122.323 1.059 . . . . 0.0 111.957 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 21' ' ' GLU . 7.3 m -136.42 123.57 21.71 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.601 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 21.0 m -65.77 -6.92 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 120.755 -1.216 . . . . 0.0 109.755 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 23' ' ' GLY . 83.9 tt0 -69.76 141.02 53.49 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.944 -1.097 . . . . 0.0 108.483 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -53.76 -30.9 46.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.035 -1.04 . . . . 0.0 109.033 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.453 ' H ' ' HG2' ' A' ' 21' ' ' GLU . . . -128.02 119.65 3.2 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -125.76 160.73 20.26 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -62.24 -20.84 71.38 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.875 2.383 . . . . 0.0 112.38 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.718 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 76.4 m-70 56.52 41.46 28.64 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.211 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -55.9 -48.75 75.09 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.085 -1.009 . . . . 0.0 109.233 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 t -93.62 -73.4 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.543 -0.723 . . . . 0.0 109.582 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.01 176.14 18.18 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -53.39 144.66 49.09 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.25 1.967 . . . . 0.0 111.244 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD23 ' A' ' 32' ' ' LEU . 7.5 m120 -101.83 127.44 48.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.177 -0.952 . . . . 0.0 109.41 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.928 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -105.04 167.75 9.5 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.069 0.938 . . . . 0.0 111.212 -178.648 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.601 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 25.2 t-80 177.99 109.61 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.59 6.88 57.18 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.47 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 33.2 mm -53.14 -33.03 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.136 -1.214 . . . . 0.0 108.665 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -50.03 123.48 8.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.63 26.46 60.89 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 59' ' ' TRP . 10.8 tpp85 -136.49 164.36 28.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -1.151 . . . . 0.0 108.972 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -86.44 142.92 28.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.863 -1.148 . . . . 0.0 109.209 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 4.0 t -62.76 142.14 58.29 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.452 -0.78 . . . . 0.0 109.977 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.01 -2.14 59.73 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.431 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.6 mt-30 -103.16 116.72 33.03 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -1.16 . . . . 0.0 109.515 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.715 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -143.54 148.33 35.79 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.72 -41.71 11.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 109.367 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.422 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -61.75 -58.02 14.97 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.583 ' CD1' ' N ' ' A' ' 47' ' ' SER . 4.2 t80 -144.98 140.85 28.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.158 -1.201 . . . . 0.0 110.393 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.583 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 70.5 m -68.99 139.89 55.02 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.459 -0.776 . . . . 0.0 108.931 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.928 ' OH ' HD22 ' A' ' 32' ' ' LEU . 67.8 m-85 -63.23 -175.33 0.1 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.434 -0.792 . . . . 0.0 110.378 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.8 m -71.25 146.78 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -50.85 -37.55 43.82 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.167 -0.958 . . . . 0.0 109.969 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.02 65.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 55' ' ' LYS . 43.7 t-20 -60.74 -42.98 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.367 -0.833 . . . . 0.0 109.846 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 81.5 mt -64.58 -36.18 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.41 -0.807 . . . . 0.0 110.138 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -57.09 -43.48 82.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.096 -1.002 . . . . 0.0 109.375 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 52' ' ' ASN . 78.3 tttt -108.28 127.31 53.74 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -0.837 . . . . 0.0 108.853 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -148.11 151.19 35.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.011 -1.055 . . . . 0.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.39 140.56 37.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.02 143.78 9.86 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 108.435 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.47 ' CD1' ' CG2' ' A' ' 35' ' ' ILE . 33.7 m95 -101.38 147.29 26.51 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.988 0.899 . . . . 0.0 111.176 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -147.56 161.45 41.09 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -53.91 -36.2 62.47 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.981 -1.074 . . . . 0.0 109.313 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -79.91 -47.94 14.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.81 -42.66 93.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.196 -0.94 . . . . 0.0 110.233 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.408 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.4 mtp -60.89 -33.76 73.6 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.106 -0.996 . . . . 0.0 109.604 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 m -55.29 -39.81 70.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.044 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.27 -37.41 87.39 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.297 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' O ' ' A' ' 71' ' ' HIS . 58.8 t80 -62.6 -44.39 96.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.267 -0.896 . . . . 0.0 109.737 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.639 HD13 HD23 ' A' ' 94' ' ' LEU . 46.5 mt -52.35 -38.29 58.33 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.184 -0.947 . . . . 0.0 109.771 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.89 HG22 ' NH2' ' A' ' 91' ' ' ARG . 55.8 p -59.18 -38.29 79.46 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.017 -1.052 . . . . 0.0 108.912 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 40.3 t-20 -144.62 131.43 20.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.363 -0.836 . . . . 0.0 108.858 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.589 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.2 OUTLIER -57.91 -4.02 0.27 Allowed 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.987 -1.07 . . . . 0.0 109.726 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -154.68 47.87 0.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.059 -1.026 . . . . 0.0 110.119 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -59.43 -43.74 93.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 109.558 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -121.21 10.72 10.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.394 -0.816 . . . . 0.0 109.811 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.2 mt -137.14 74.1 50.04 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.65 -30.03 64.04 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.194 1.93 . . . . 0.0 111.725 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.9 -23.8 57.03 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.846 -1.701 . . . . 0.0 108.846 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 71' ' ' HIS . 6.7 m -71.25 142.37 50.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.519 -0.989 . . . . 0.0 110.253 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -76.4 146.54 38.61 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 50.0 ttm -96.4 133.45 40.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.066 -1.021 . . . . 0.0 109.149 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.559 ' HB1' HBC2 ' A' ' 104' ' ' HEC . . . -149.95 -36.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.037 -1.04 . . . . 0.0 110.433 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 83' ' ' GLY . 27.2 t80 -96.55 153.98 17.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.922 -1.111 . . . . 0.0 109.844 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.636 ' N ' ' CD1' ' A' ' 82' ' ' PHE . . . -165.3 155.92 27.57 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.13 3.95 56.63 Favored Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.12 -1.224 . . . . 0.0 111.026 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' CE1' ' A' ' 82' ' ' PHE . 0.9 OUTLIER -84.83 11.35 9.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.577 -1.543 . . . . 0.0 109.15 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -54.2 -31.12 52.15 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.298 -0.876 . . . . 0.0 109.331 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -52.05 124.2 12.33 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.156 -0.965 . . . . 0.0 109.095 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -63.22 -31.78 73.02 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.294 -0.879 . . . . 0.0 109.699 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -57.76 -46.55 84.38 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.275 -0.89 . . . . 0.0 110.042 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.8 -48.04 67.41 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.101 -0.999 . . . . 0.0 109.425 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.89 ' NH2' HG22 ' A' ' 69' ' ' THR . 37.7 ttm180 -57.81 -43.31 85.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.729 . . . . 0.0 110.415 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.4 m-20 -71.38 -54.17 11.64 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.147 -0.97 . . . . 0.0 110.324 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.71 -39.15 93.11 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.381 -0.824 . . . . 0.0 109.85 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.639 HD23 HD13 ' A' ' 68' ' ' LEU . 36.3 tp -53.09 -58.1 8.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.359 -0.838 . . . . 0.0 109.859 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 85.7 mt -67.36 -30.53 49.38 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.728 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -52.52 -41.43 63.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.092 -1.005 . . . . 0.0 109.202 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -77.81 -46.53 21.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.375 -0.828 . . . . 0.0 110.071 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.4 mt -57.72 -47.19 83.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.205 -0.934 . . . . 0.0 109.529 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 22.7 ttpp -62.16 -38.77 90.3 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.464 -0.773 . . . . 0.0 109.543 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -59.43 -43.32 93.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.852 . . . . 0.0 109.347 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.51 -50.1 54.68 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.2 m -63.23 -30.91 71.97 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.255 -1.016 . . . . 0.0 108.255 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.3 tt0 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.499 -0.751 . . . . 0.0 109.476 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.615 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.32 0.581 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.84 -33.05 73.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.232 -0.917 . . . . 0.0 109.462 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.18 161.09 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.544 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -75.1 133.94 41.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.873 . . . . 0.0 109.538 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -128.61 -175.4 3.51 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.436 -0.79 . . . . 0.0 109.688 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -160.84 -69.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.61 111.12 5.18 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.33 -1.1 . . . . 0.0 109.178 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.779 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.85 -23.21 67.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.257 -0.902 . . . . 0.0 109.253 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -56.32 -51.1 69.5 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.422 -0.799 . . . . 0.0 109.531 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -65.45 -39.66 92.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.01 -35.88 91.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.26 90.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.22 -1.164 . . . . 0.0 109.533 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' HG23 ' A' ' 12' ' ' THR . 41.2 p -75.54 -28.89 59.25 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.242 -0.911 . . . . 0.0 109.626 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.657 HD23 ' HG ' ' A' ' 94' ' ' LEU . 38.0 tp -56.44 -45.69 80.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.122 -0.986 . . . . 0.0 109.135 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.721 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 53.3 t80 -65.09 -43.54 91.79 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.234 -0.916 . . . . 0.0 108.885 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -63.89 -34.55 78.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.591 -0.693 . . . . 0.0 111.061 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 8' ' ' THR . 70.7 p -91.8 2.41 56.52 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.077 -1.014 . . . . 0.0 111.865 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -138.05 -64.63 0.53 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.62 -1.3 . . . . 0.0 111.699 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.574 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.6 m -66.68 -36.72 83.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.073 -1.017 . . . . 0.0 111.142 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 19' ' ' THR . 9.3 tp -56.69 -34.46 67.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.952 -1.092 . . . . 0.0 109.923 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -54.7 -35.28 63.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.094 -1.004 . . . . 0.0 109.65 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 33.2 m -103.22 -85.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.201 -0.937 . . . . 0.0 109.544 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -113.86 146.49 39.92 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.631 0.729 . . . . 0.0 109.407 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.737 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.1 p -105.83 167.05 10.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.666 -0.646 . . . . 0.0 109.734 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 5.8 m -104.48 15.9 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.373 -0.829 . . . . 0.0 109.689 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -56.63 149.5 17.54 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.177 -0.952 . . . . 0.0 108.809 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -51.65 -29.81 19.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.75 45.6 0.77 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 153.74 51.38 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.499 ' O ' ' OD1' ' A' ' 31' ' ' ASN . 48.1 Cg_endo -70.13 138.1 35.9 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.716 2.277 . . . . 0.0 112.135 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 56.4 m-70 -73.38 65.24 0.87 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.226 -0.922 . . . . 0.0 108.999 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -51.47 -40.56 59.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.112 -0.992 . . . . 0.0 109.303 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.4 p -147.66 -47.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.396 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.598 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -98.06 -173.36 32.96 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.497 ' O ' ' O ' ' A' ' 31' ' ' ASN . 10.8 Cg_endo -86.02 10.56 3.62 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.419 2.746 . . . . 0.0 113.824 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.737 ' ND2' ' H ' ' A' ' 19' ' ' THR . 19.5 m120 44.55 93.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.86 -1.15 . . . . 0.0 109.505 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.831 HD23 ' N ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.88 141.77 29.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.032 -1.042 . . . . 0.0 111.141 -178.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -151.62 114.95 4.79 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.36 6.65 59.79 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 59' ' ' TRP . 32.9 mm -53.32 -34.19 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.982 -1.305 . . . . 0.0 108.839 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.648 ' HB2' HG21 ' A' ' 102' ' ' THR . 47.7 m-85 -49.39 117.01 1.95 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.36 -0.837 . . . . 0.0 108.857 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.57 10.63 61.64 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 59' ' ' TRP . 22.6 mmt85 -121.01 170.21 9.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.336 -1.096 . . . . 0.0 109.97 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.2 m80 -90.69 144.9 25.27 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.651 -0.656 . . . . 0.0 109.486 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -55.58 135.37 51.0 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.381 -0.825 . . . . 0.0 109.564 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 101.43 -0.13 53.49 Favored Glycine 0 N--CA 1.486 2.02 0 C-N-CA 119.838 -1.173 . . . . 0.0 110.905 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -99.25 118.34 35.72 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.829 -1.395 . . . . 0.0 110.072 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.57 156.81 48.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.581 -0.699 . . . . 0.0 109.406 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -93.79 -38.52 11.22 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -0.865 . . . . 0.0 109.656 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.38 -73.44 1.28 Allowed Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.607 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 6.8 t80 -119.19 131.68 55.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -1.055 . . . . 0.0 110.252 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.607 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 28.3 p -67.8 154.92 40.48 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.646 ' O ' HD11 ' A' ' 53' ' ' ILE . 48.0 m-85 -66.34 -175.59 0.37 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.35 -0.844 . . . . 0.0 110.57 -179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.8 m -67.62 148.83 50.86 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.484 -0.76 . . . . 0.0 109.42 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -48.5 -37.62 17.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 110.194 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 77' ' ' GLY . . . -62.51 -56.59 16.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.88 -1.137 . . . . 0.0 109.267 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.498 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.4 t-20 -58.16 -42.51 86.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.405 -0.81 . . . . 0.0 109.528 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.646 HD11 ' O ' ' A' ' 48' ' ' TYR . 93.9 mt -63.61 -37.58 80.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.872 . . . . 0.0 109.851 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -56.58 -42.62 78.96 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.104 -0.998 . . . . 0.0 108.657 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' ASN . 34.4 mttm -99.84 123.13 43.77 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.52 127.2 40.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.0 109.795 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.609 HG11 ' OH ' ' A' ' 74' ' ' TYR . 44.0 t -129.96 135.11 61.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.469 -0.77 . . . . 0.0 109.512 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.9 tp -52.48 144.34 13.6 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.408 -0.917 . . . . 0.0 108.532 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.452 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 31.3 m95 -102.66 144.43 31.06 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.82 0.819 . . . . 0.0 111.139 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 57.2 t0 -143.02 158.63 43.42 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -53.89 -37.86 64.19 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.988 -1.07 . . . . 0.0 109.362 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -75.27 -45.1 42.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 0.0 110.087 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.47 -41.46 98.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.145 -0.972 . . . . 0.0 110.265 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.468 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 56.4 mtp -61.28 -34.38 75.11 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.012 -1.055 . . . . 0.0 109.718 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.3 p -57.63 -34.1 68.96 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.097 -1.002 . . . . 0.0 108.756 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.27 -39.79 93.06 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.386 -0.821 . . . . 0.0 109.123 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.8 t80 -64.51 -43.78 92.99 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.13 -0.981 . . . . 0.0 109.558 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 61.5 mt -52.57 -32.45 41.16 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.075 -1.016 . . . . 0.0 109.512 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.4 m -52.84 -41.65 64.43 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.17 -0.956 . . . . 0.0 109.842 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' TYR . 21.8 t30 -155.82 170.25 22.52 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.166 -0.959 . . . . 0.0 109.598 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -103.3 128.49 50.33 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.007 -1.058 . . . . 0.0 110.556 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.74 ' HB3' ' O ' ' A' ' 71' ' ' HIS . . . 77.91 -20.41 0.38 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.445 -0.784 . . . . 0.0 111.27 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.462 ' HB2' HD22 ' A' ' 70' ' ' ASN . 64.9 tttt -56.24 -43.25 78.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.677 -1.264 . . . . 0.0 109.199 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.609 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.3 t80 -64.15 -36.05 82.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.187 -0.946 . . . . 0.0 108.999 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.88 85.65 23.27 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.495 -0.753 . . . . 0.0 109.444 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.14 141.14 70.28 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.176 1.917 . . . . 0.0 111.711 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.528 ' O ' ' CB ' ' A' ' 51' ' ' ALA . . . 92.64 -2.54 73.54 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 42.5 m -97.49 155.45 16.93 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.39 -1.064 . . . . 0.0 109.239 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 7.4 mtmp? -65.34 148.92 50.86 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.224 -0.923 . . . . 0.0 110.498 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.2 mtt -98.94 168.91 9.8 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.628 ' HB3' ' CD2' ' A' ' 71' ' ' HIS . . . -166.26 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.815 -1.178 . . . . 0.0 111.1 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.505 ' H ' ' CG ' ' A' ' 71' ' ' HIS . 23.6 t80 -92.33 130.4 38.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.855 -1.153 . . . . 0.0 109.45 -178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.5 -40.43 94.42 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 135.78 148.24 5.57 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.423 HD11 HD12 ' A' ' 94' ' ' LEU . 53.2 mt -90.63 92.01 8.66 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.354 -1.086 . . . . 0.0 108.919 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -61.18 -35.41 77.07 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.458 -0.776 . . . . 0.0 110.044 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -87.9 128.18 35.36 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.227 -0.92 . . . . 0.0 109.688 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -29.44 70.45 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 0.0 109.406 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -56.19 -47.94 77.34 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.556 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -62.84 -53.25 57.12 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.398 -0.814 . . . . 0.0 109.282 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 85' ' ' LEU . 55.4 ttp180 -58.81 -43.02 90.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.345 -0.847 . . . . 0.0 110.315 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -63.95 -44.8 91.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.996 -1.065 . . . . 0.0 110.32 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -63.47 -39.65 95.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.271 -0.893 . . . . 0.0 109.595 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.2 mt -53.57 -65.57 0.54 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.446 -0.784 . . . . 0.0 109.926 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 65' ' ' SER . 65.8 mt -52.73 -36.26 22.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 O-C-N 121.709 -0.62 . . . . 0.0 109.937 -179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.779 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.2 m -56.05 -39.4 71.96 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.163 -0.96 . . . . 0.0 108.613 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -83.12 -48.29 10.72 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD11 HD22 ' A' ' 94' ' ' LEU . 73.5 mt -52.12 -50.72 61.13 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.189 -0.945 . . . . 0.0 109.199 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 39.2 tttt -61.26 -39.3 89.86 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.384 -0.823 . . . . 0.0 109.153 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.5 tttm -59.57 -43.3 93.65 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 109.162 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.11 59.59 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.648 HG21 ' HB2' ' A' ' 36' ' ' PHE . 46.4 m -62.54 -31.3 72.06 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 109.49 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.814 HMD1 HBD1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . 0.426 ' N ' HD21 ' A' ' 62' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -58.13 143.32 44.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.214 -0.929 . . . . 0.0 109.563 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -137.29 161.75 35.38 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.292 -0.88 . . . . 0.0 109.322 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -74.32 131.14 40.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.92 . . . . 0.0 109.499 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -126.55 -168.3 1.84 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.423 -0.798 . . . . 0.0 109.62 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -147.08 -67.01 0.01 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.52 115.21 5.23 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.24 -1.153 . . . . 0.0 109.322 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.654 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.36 -32.17 72.92 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.389 -0.819 . . . . 0.0 109.879 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.833 ' N ' ' HZ3' ' A' ' 4' ' ' LYS . 3.0 mtmm -58.16 -46.75 85.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.209 -0.932 . . . . 0.0 109.649 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -65.15 -44.28 89.12 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.126 -0.984 . . . . 0.0 109.551 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.51 -30.88 73.2 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.66 -45.36 92.25 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.235 -1.156 . . . . 0.0 109.848 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.8 p -75.03 -29.18 60.73 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.158 -0.964 . . . . 0.0 109.837 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.494 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 32.9 tp -55.27 -46.4 76.12 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.106 -0.997 . . . . 0.0 109.245 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CE1' HG13 ' A' ' 20' ' ' VAL . 22.0 t80 -65.24 -45.2 85.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.319 -0.863 . . . . 0.0 108.856 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.63 -32.02 72.98 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.616 -0.677 . . . . 0.0 110.698 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.56 ' O ' HG22 ' A' ' 12' ' ' THR . 28.8 m -97.13 4.26 51.3 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.171 -0.956 . . . . 0.0 111.345 -178.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 95.0 mtt180 -138.81 -65.31 0.5 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.76 -1.213 . . . . 0.0 111.336 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' HIS . 2.0 m -66.32 -28.57 68.78 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.922 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.48 -36.25 66.43 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.989 -1.069 . . . . 0.0 109.997 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -56.75 -35.98 69.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.201 -0.937 . . . . 0.0 110.269 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.409 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.8 m -114.85 -45.2 2.99 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.271 -0.893 . . . . 0.0 110.965 -179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.0 m-70 -99.12 152.65 19.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.873 -1.142 . . . . 0.0 110.665 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.8 m -128.13 129.98 47.4 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.497 HG13 ' CE1' ' A' ' 10' ' ' PHE . 25.2 m -75.59 -24.36 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.961 -1.087 . . . . 0.0 109.663 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 19' ' ' THR . 96.9 mt-10 -56.56 143.54 35.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.254 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -72.9 128.58 35.91 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.261 -0.899 . . . . 0.0 109.411 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.61 19.73 63.25 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.49 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.35 160.14 32.46 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.565 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 58.9 Cg_endo -73.07 142.34 34.26 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.781 2.32 . . . . 0.0 111.957 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.698 ' HD1' ' N ' ' A' ' 31' ' ' ASN . 90.0 m-70 -99.37 30.18 3.65 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.24 -0.913 . . . . 0.0 108.809 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 26' ' ' HIS . 17.8 tttt -34.34 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.748 -0.595 . . . . 0.0 110.872 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.33 -48.68 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.149 -0.969 . . . . 0.0 110.082 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -153.01 175.47 31.5 Favored Glycine 0 N--CA 1.491 2.328 0 C-N-CA 119.681 -1.247 . . . . 0.0 110.397 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HA ' ' ND1' ' A' ' 26' ' ' HIS . 13.1 Cg_exo -53.16 150.69 24.04 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.755 2.303 . . . . 0.0 111.449 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.698 ' N ' ' HD1' ' A' ' 26' ' ' HIS . 7.3 m120 -103.0 129.33 49.71 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.483 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.703 HD11 ' OH ' ' A' ' 48' ' ' TYR . 3.6 mp -101.63 146.67 27.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.291 -0.881 . . . . 0.0 110.16 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 34' ' ' GLY . 31.6 p-80 -174.03 7.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.488 -0.757 . . . . 0.0 109.099 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 33' ' ' HIS . . . -156.61 8.38 0.24 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -61.66 -40.78 87.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.724 -0.868 . . . . 0.0 109.909 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -50.29 120.7 4.76 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.085 -1.009 . . . . 0.0 109.061 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.23 28.64 52.81 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.814 ' HE ' ' H ' ' A' ' 39' ' ' HIS . 7.4 tpm_? -143.02 163.22 33.4 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.02 -1.283 . . . . 0.0 109.511 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.814 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 32.4 m80 -83.41 146.29 28.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.57 ' OG ' ' NE1' ' A' ' 59' ' ' TRP . 2.7 m -64.26 139.13 58.73 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.579 -0.701 . . . . 0.0 110.436 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 94.72 2.55 63.0 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.685 ' NE2' ' NE ' ' A' ' 38' ' ' ARG . 22.8 mt-30 -103.35 18.84 20.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -1.186 . . . . 0.0 110.219 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -54.88 130.26 40.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.046 -1.033 . . . . 0.0 108.972 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -72.1 -42.64 65.87 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -0.887 . . . . 0.0 109.371 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.493 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.0 -49.15 78.23 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.79 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.0 t80 -155.98 130.53 8.97 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.279 -1.13 . . . . 0.0 110.425 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.592 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 24.2 p -71.76 147.35 47.4 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.703 ' OH ' HD11 ' A' ' 32' ' ' LEU . 22.1 m-85 -67.51 178.93 1.44 Allowed 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.286 -0.884 . . . . 0.0 110.926 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 55.9 m -59.61 149.54 29.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.826 -0.546 . . . . 0.0 109.855 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -50.65 -38.68 47.66 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.385 -0.822 . . . . 0.0 109.785 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.81 65.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.913 -1.117 . . . . 0.0 108.651 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.491 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 48.5 t-20 -59.43 -43.61 93.06 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.375 -0.828 . . . . 0.0 108.995 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.597 HD11 ' O ' ' A' ' 48' ' ' TYR . 98.7 mt -64.46 -33.04 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.636 -0.665 . . . . 0.0 109.619 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -53.66 -42.24 67.66 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.2 tptt -103.97 107.24 18.03 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.499 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.9 p-10 -116.53 131.07 57.05 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.836 . . . . 0.0 109.548 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.9 t -134.09 138.35 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.437 -0.789 . . . . 0.0 110.222 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.5 tp -53.31 143.8 17.81 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.689 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 26.5 m95 -99.97 143.04 30.65 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.484 -0.886 . . . . 0.0 110.935 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.8 t0 -146.83 164.97 31.13 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.535 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.8 mt-10 -56.47 -38.84 72.26 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.063 -1.023 . . . . 0.0 109.696 -179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.426 HD21 ' N ' ' A' ' -5' ' ' THR . 85.7 m-20 -73.69 -45.44 52.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 0.0 110.306 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -64.21 -42.0 96.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 110.296 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.689 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 94.2 mmm -60.33 -35.89 76.69 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.197 -0.939 . . . . 0.0 109.81 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.402 ' HA ' HD11 ' A' ' 95' ' ' ILE . 22.9 t -59.33 -38.83 81.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.163 -0.961 . . . . 0.0 109.897 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -62.4 -38.78 90.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.13 -0.981 . . . . 0.0 109.651 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.579 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.1 t80 -63.56 -39.11 93.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.899 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 HD23 ' A' ' 94' ' ' LEU . 67.4 mt -57.67 -36.23 71.62 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.136 -0.977 . . . . 0.0 109.838 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -52.75 -41.37 63.97 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.053 -1.03 . . . . 0.0 108.34 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.564 ' C ' ' H ' ' A' ' 72' ' ' ALA . 29.7 t-20 -152.29 138.24 18.11 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.486 ' O ' ' CE1' ' A' ' 67' ' ' TYR . 0.4 OUTLIER -57.96 1.9 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.936 -1.103 . . . . 0.0 109.877 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -169.39 48.86 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.111 -0.993 . . . . 0.0 109.493 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -59.15 -46.23 88.91 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.361 -0.837 . . . . 0.0 110.352 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.716 ' CZ ' HD11 ' A' ' 75' ' ' ILE . 42.1 p90 -120.1 10.2 11.35 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.716 HD11 ' CZ ' ' A' ' 74' ' ' TYR . 32.5 mt -131.36 73.61 79.82 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.536 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.35 -33.75 77.81 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 111.921 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.53 -25.88 51.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.36 -1.896 . . . . 0.0 108.36 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.6 m -74.87 140.15 43.64 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.471 -1.017 . . . . 0.0 109.963 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -75.43 161.66 29.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.494 -0.754 . . . . 0.0 109.618 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.8 ttp -108.39 142.47 38.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.376 -0.827 . . . . 0.0 109.086 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.918 ' HB1' HBC2 ' A' ' 104' ' ' HEC . . . -149.76 -34.93 0.17 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.954 -1.091 . . . . 0.0 110.478 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.414 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 51.2 t80 -98.55 138.31 35.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.06 . . . . 0.0 109.44 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.94 78.79 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 124.73 140.39 5.47 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.85 -1.3 . . . . 0.0 109.85 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 mt -93.63 79.01 4.28 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -1.116 . . . . 0.0 109.03 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.82 -34.04 73.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.345 -0.847 . . . . 0.0 109.644 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -70.4 125.45 26.82 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.344 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.37 -30.94 71.97 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.878 . . . . 0.0 109.781 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -57.65 -51.0 71.3 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.917 . . . . 0.0 109.766 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -65.24 -51.17 62.59 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 109.426 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -58.16 -43.93 87.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.28 -0.887 . . . . 0.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -69.5 -50.57 44.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.108 -0.995 . . . . 0.0 110.167 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -63.33 -36.04 82.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.868 . . . . 0.0 109.282 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.648 HD21 ' CMB' ' A' ' 104' ' ' HEC . 27.0 tp -52.87 -58.75 5.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.66 0.743 . . . . 0.0 110.009 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' 65' ' ' SER . 80.1 mt -64.19 -31.06 51.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.596 -0.69 . . . . 0.0 110.17 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.654 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.2 m -51.67 -40.5 60.15 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.136 -0.977 . . . . 0.0 108.929 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -78.05 -46.62 20.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.313 -0.867 . . . . 0.0 110.041 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 84.6 mt -55.75 -47.81 76.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -0.925 . . . . 0.0 109.21 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.535 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 14.0 tttp -61.68 -39.14 90.37 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.429 -0.794 . . . . 0.0 109.08 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.6 tttp -59.35 -42.87 92.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.396 -0.815 . . . . 0.0 109.096 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.13 -48.9 64.15 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.4 m -62.85 -31.16 72.13 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.587 -0.696 . . . . 0.0 109.453 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.918 HBC2 ' HB1' ' A' ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . 0.439 ' HB ' HD21 ' A' ' 62' ' ' ASN . 1.1 m . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.59 143.94 44.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 109.486 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -136.12 164.37 28.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.297 -0.877 . . . . 0.0 109.293 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -69.74 138.1 52.53 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.114 -0.991 . . . . 0.0 109.731 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.44 -149.15 0.3 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.306 -0.871 . . . . 0.0 109.748 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 172.54 -78.08 0.09 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.07 110.39 4.42 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.299 -1.118 . . . . 0.0 109.062 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.721 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.58 -23.68 67.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.34 -0.85 . . . . 0.0 109.356 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.1 mtmt -55.43 -57.83 10.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.397 -0.814 . . . . 0.0 109.524 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -66.34 -38.32 87.36 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.295 -0.878 . . . . 0.0 109.698 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -59.59 -39.39 95.01 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.23 -44.53 94.98 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.237 -1.155 . . . . 0.0 109.263 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.1 p -76.39 -28.69 56.82 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.279 -0.888 . . . . 0.0 109.732 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.744 HD11 ' HE ' ' A' ' 13' ' ' ARG . 37.9 tp -57.01 -45.78 82.81 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.13 -0.981 . . . . 0.0 108.949 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CE1' HG23 ' A' ' 20' ' ' VAL . 21.0 t80 -63.54 -44.69 93.44 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.08 -34.95 78.7 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.623 -0.673 . . . . 0.0 110.867 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.8 p -94.05 6.14 49.47 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.244 -0.91 . . . . 0.0 111.495 -178.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.744 ' HE ' HD11 ' A' ' 9' ' ' LEU . 91.3 mtt-85 -139.78 -65.95 0.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.672 -1.268 . . . . 0.0 111.399 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.25 -28.31 67.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 110.378 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -56.25 -35.72 67.73 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.943 -1.098 . . . . 0.0 109.98 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.2 -36.84 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.89 . . . . 0.0 110.449 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 77.1 m -114.44 -47.2 2.93 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.174 -0.954 . . . . 0.0 110.71 -179.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.541 ' ND1' HD23 ' A' ' 32' ' ' LEU . 95.2 m-70 -96.83 154.63 17.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.911 -1.118 . . . . 0.0 110.109 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.2 p -123.13 138.19 54.72 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' CE1' ' A' ' 10' ' ' PHE . 73.4 t -65.51 -35.55 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.238 -0.914 . . . . 0.0 109.721 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -52.78 144.97 13.16 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.348 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -80.95 135.0 35.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.379 -0.826 . . . . 0.0 109.505 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.06 31.77 54.49 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -60.41 166.46 11.45 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.36 -16.64 29.65 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 123.129 2.553 . . . . 0.0 113.03 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.666 ' HE2' ' CA ' ' A' ' 45' ' ' GLY . 88.7 m-70 56.6 43.55 25.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.072 -1.017 . . . . 0.0 109.081 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -54.36 -78.86 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.062 -1.024 . . . . 0.0 110.114 -178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.4 t -71.26 -48.94 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 110.286 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.41 170.74 28.16 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.73 -1.224 . . . . 0.0 110.282 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.489 ' CG ' ' O2D' ' A' ' 104' ' ' HEC . 12.5 Cg_exo -52.21 152.38 15.11 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.412 2.075 . . . . 0.0 111.2 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 6.9 m120 -96.92 132.31 42.82 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 109.14 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.634 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.1 mm? -87.6 -122.43 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.351 -0.843 . . . . 0.0 110.131 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.475 ' ND1' HG13 ' A' ' 20' ' ' VAL . 57.7 t60 64.17 73.63 0.43 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.601 -0.687 . . . . 0.0 110.587 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.52 -22.27 2.71 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 119.503 -1.332 . . . . 0.0 110.878 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.564 HD13 ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.44 -5.78 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 120.925 -1.338 . . . . 0.0 110.902 -179.114 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.667 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 0.9 OUTLIER -55.0 -3.94 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.794 -1.191 . . . . 0.0 109.374 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -142.37 34.22 1.84 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.8 mmt-85 -135.5 174.49 10.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.309 -1.112 . . . . 0.0 110.131 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -89.23 141.52 28.45 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.481 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.2 OUTLIER -53.35 136.81 36.63 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.208 -0.932 . . . . 0.0 109.389 -179.491 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.72 -5.5 51.12 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -103.58 118.47 36.8 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -1.202 . . . . 0.0 109.871 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -162.9 106.43 1.07 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.51 -0.744 . . . . 0.0 109.15 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.83 -35.56 78.62 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.3 -0.875 . . . . 0.0 108.862 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.666 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -56.1 -37.52 72.23 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 108.32 -1.912 . . . . 0.0 108.32 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.555 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -176.2 126.68 0.2 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.516 -0.991 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 49.4 m -64.61 139.84 58.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.352 -0.843 . . . . 0.0 108.9 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.597 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 55.7 m-85 -65.16 -172.64 0.1 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.408 -0.807 . . . . 0.0 109.856 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 49.5 m -70.62 148.25 48.31 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.384 -0.823 . . . . 0.0 109.113 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -51.19 -37.87 49.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.181 -0.949 . . . . 0.0 109.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.55 63.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.066 -1.021 . . . . 0.0 109.369 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 55' ' ' LYS . 50.7 t-20 -58.6 -42.67 88.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.324 -0.86 . . . . 0.0 109.467 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.93 -33.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.475 -0.766 . . . . 0.0 109.983 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -55.75 -44.44 77.62 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.099 -1.0 . . . . 0.0 108.667 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.512 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 39.4 tttt -101.88 124.65 47.87 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.6 p-10 -142.0 142.2 32.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.995 -1.066 . . . . 0.0 110.771 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.0 t -143.58 140.0 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.56 -0.712 . . . . 0.0 109.56 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.8 tp -49.9 145.18 5.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.048 -1.032 . . . . 0.0 108.438 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.465 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 26.8 m95 -102.64 145.2 30.02 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.818 0.818 . . . . 0.0 110.829 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.497 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 43.7 t0 -149.77 163.56 37.65 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.497 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 59.9 mp0 -57.24 -38.3 73.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.878 -1.139 . . . . 0.0 109.524 -179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.439 HD21 ' HB ' ' A' ' -5' ' ' THR . 85.3 m-20 -74.0 -44.91 52.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.9 -43.07 94.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 110.419 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.667 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 72.2 mtp -62.38 -33.75 75.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.138 -0.976 . . . . 0.0 109.898 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.5 m -54.09 -40.13 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.075 -1.015 . . . . 0.0 109.038 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -64.95 -38.89 92.47 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.23 -0.919 . . . . 0.0 108.987 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' ' O ' ' A' ' 70' ' ' ASN . 61.4 t80 -65.26 -43.0 92.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 109.956 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.8 mt -54.37 -34.07 60.42 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.101 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.4 p -56.05 -15.09 3.1 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.967 -1.083 . . . . 0.0 108.888 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.787 HD22 ' H ' ' A' ' 73' ' ' LYS . 23.5 t30 -158.15 -164.82 1.58 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.391 -0.818 . . . . 0.0 108.889 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.531 ' H ' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -124.06 -2.59 8.15 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.229 -0.92 . . . . 0.0 109.359 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.657 ' H ' HD22 ' A' ' 70' ' ' ASN . . . -172.65 8.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.198 -0.939 . . . . 0.0 109.725 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.787 ' H ' HD22 ' A' ' 70' ' ' ASN . 62.8 tttm -59.25 -47.13 86.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.132 -0.98 . . . . 0.0 108.515 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.512 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . 19.5 t80 -71.88 -31.39 66.38 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 mt -125.31 77.76 67.88 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -51.08 -33.1 41.88 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.31 2.007 . . . . 0.0 111.883 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.26 -24.28 55.03 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.536 -1.826 . . . . 0.0 108.536 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 m -77.07 144.55 38.48 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.456 -1.026 . . . . 0.0 110.319 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 mttt -72.42 164.85 25.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.605 -0.684 . . . . 0.0 109.682 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.6 mtm -125.99 153.78 43.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.412 -0.805 . . . . 0.0 109.542 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -178.8 21.98 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.436 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.7 t80 -107.23 145.17 32.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.92 -1.112 . . . . 0.0 109.409 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.44 -45.87 74.66 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 148.19 93.34 0.12 Allowed Glycine 0 N--CA 1.494 2.532 0 O-C-N 120.984 -1.304 . . . . 0.0 110.222 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD21 HD12 ' A' ' 94' ' ' LEU . 9.8 tp -79.47 20.87 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -1.142 . . . . 0.0 109.011 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 49.8 tttt -52.22 -30.44 27.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.392 -0.817 . . . . 0.0 109.553 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -59.77 122.78 15.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.153 -0.967 . . . . 0.0 109.221 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.28 -29.78 70.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.449 -0.782 . . . . 0.0 109.985 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -55.65 -51.73 66.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.829 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 85' ' ' LEU . 82.5 m-20 -65.07 -48.23 74.49 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.355 -0.841 . . . . 0.0 109.652 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -59.45 -45.25 92.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.408 -0.808 . . . . 0.0 110.572 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -64.29 -44.74 90.71 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.076 -1.015 . . . . 0.0 110.142 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -66.93 -40.94 87.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.243 -0.91 . . . . 0.0 109.823 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.798 HD12 HD21 ' A' ' 85' ' ' LEU . 1.7 mt -55.04 -63.16 1.24 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 0.0 110.415 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mt -53.13 -35.08 22.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 121.688 -0.632 . . . . 0.0 109.994 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.721 HG22 ' HB2' ' A' ' 3' ' ' ALA . 23.0 m -56.68 -40.12 75.0 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.109 -0.994 . . . . 0.0 108.546 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -81.87 -48.25 11.78 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.42 -0.8 . . . . 0.0 110.09 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 94' ' ' LEU . 47.9 mt -55.39 -46.15 76.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.908 . . . . 0.0 109.266 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 103' ' ' GLU . 35.8 tttp -61.59 -39.71 92.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.447 -0.783 . . . . 0.0 109.53 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.54 -43.27 93.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.368 -0.833 . . . . 0.0 109.285 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.93 -50.03 52.89 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 m -62.69 -31.31 72.19 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.562 -0.711 . . . . 0.0 109.506 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.667 HMD1 ' CBD' ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.17 137.63 41.07 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.872 . . . . 0.0 109.536 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 28.2 p90 -139.83 165.51 27.11 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.302 -0.874 . . . . 0.0 109.302 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.66 140.76 53.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 109.686 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.99 -152.92 0.49 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.388 -0.82 . . . . 0.0 109.603 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 164.74 -77.69 0.14 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.57 99.92 4.34 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.338 -1.095 . . . . 0.0 109.294 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.52 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.27 -30.61 71.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.328 -0.857 . . . . 0.0 109.731 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CG ' ' N ' ' A' ' 5' ' ' LYS . 2.6 ptpt -59.37 -50.0 75.66 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.25 -0.906 . . . . 0.0 109.763 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 4' ' ' LYS . 68.5 mttm -63.6 -40.85 97.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.093 -1.004 . . . . 0.0 109.529 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.99 -36.23 92.57 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.98 -41.0 97.54 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.0 109.608 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 12' ' ' THR . 39.4 p -73.45 -33.12 64.73 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.203 -0.936 . . . . 0.0 109.695 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 36.0 tp -56.35 -44.55 80.19 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.11 -0.994 . . . . 0.0 109.043 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.564 ' CE1' HG13 ' A' ' 20' ' ' VAL . 19.8 t80 -62.15 -44.98 95.42 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.454 -0.779 . . . . 0.0 109.174 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -62.44 -33.82 75.56 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.565 -0.709 . . . . 0.0 110.771 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 8' ' ' THR . 60.9 p -89.89 0.82 56.84 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.128 -0.983 . . . . 0.0 111.69 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.1 mtt180 -138.98 -65.07 0.49 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.653 -1.28 . . . . 0.0 111.926 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.2 m -65.37 -28.0 68.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.879 -1.138 . . . . 0.0 110.86 -177.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -54.7 -35.45 63.65 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.923 -1.11 . . . . 0.0 110.075 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -57.83 -38.49 75.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.084 -1.01 . . . . 0.0 110.564 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.455 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 71.7 m -111.4 -45.62 3.37 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.118 -0.989 . . . . 0.0 110.505 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -95.32 152.88 18.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.141 -0.974 . . . . 0.0 110.467 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 21' ' ' GLU . 22.6 m -124.86 129.78 51.08 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.588 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 23.8 m -76.1 -16.33 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.997 -1.064 . . . . 0.0 109.496 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -75.09 142.71 43.64 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.435 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -66.09 136.46 56.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.255 -0.903 . . . . 0.0 109.535 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.25 43.59 12.92 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.26 152.61 36.96 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.02 -16.89 41.04 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.824 2.349 . . . . 0.0 113.178 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.776 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 87.2 m-70 56.72 41.13 28.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.063 -1.023 . . . . 0.0 109.083 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 53.8 tttt -56.92 -48.21 78.78 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.132 -0.98 . . . . 0.0 110.224 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.8 t -98.22 -71.04 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.017 -1.052 . . . . 0.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.77 174.13 17.14 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -51.98 145.74 31.94 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.05 1.834 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.776 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 10.6 m120 -96.43 130.86 43.48 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.145 -0.972 . . . . 0.0 109.539 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.567 HD12 ' OH ' ' A' ' 48' ' ' TYR . 15.7 tp -76.89 -125.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.58 -0.7 . . . . 0.0 110.167 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 36.6 t60 65.4 52.99 1.32 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.637 -0.665 . . . . 0.0 109.612 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 173.26 34.76 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.64 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.57 ' C ' ' H ' ' A' ' 37' ' ' GLY . 3.6 pt -134.86 -120.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 120.98 -1.306 . . . . 0.0 109.854 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.659 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 14.7 m-85 57.05 0.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.088 -1.007 . . . . 0.0 108.962 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.57 ' H ' ' C ' ' A' ' 35' ' ' ILE . . . -166.27 19.98 0.1 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -128.04 169.51 13.96 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.461 -1.023 . . . . 0.0 109.419 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -85.13 139.13 31.94 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.335 -0.853 . . . . 0.0 109.321 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.473 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -49.66 135.45 18.75 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.538 -0.726 . . . . 0.0 109.872 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.98 -12.84 37.86 Favored Glycine 0 N--CA 1.489 2.188 0 C-N-CA 120.062 -1.066 . . . . 0.0 110.54 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -98.27 117.2 32.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.983 -1.304 . . . . 0.0 110.027 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.749 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.54 132.16 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.429 -0.794 . . . . 0.0 109.139 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -74.82 -41.78 59.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -0.904 . . . . 0.0 109.572 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.534 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -59.42 -51.6 58.16 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.68 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.1 t80 -159.17 145.07 16.38 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.158 -1.201 . . . . 0.0 110.254 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.626 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 25.1 p -72.24 138.18 47.32 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.749 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 91.5 m-85 -63.99 -175.5 0.15 Allowed 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.461 HG21 ' HE2' ' A' ' 79' ' ' LYS . 17.7 m -68.87 146.7 52.6 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.765 . . . . 0.0 109.857 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -49.5 -37.4 26.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.428 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.26 -54.49 36.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.081 -1.012 . . . . 0.0 108.96 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.2 -42.86 95.99 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.334 -0.854 . . . . 0.0 109.109 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.578 ' O ' ' ND2' ' A' ' 56' ' ' ASN . 91.4 mt -65.27 -32.08 56.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 O-C-N 121.497 -0.752 . . . . 0.0 109.601 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.34 -43.42 74.96 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.093 -1.005 . . . . 0.0 108.745 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.488 ' C ' HD22 ' A' ' 56' ' ' ASN . 15.0 tttp -104.01 120.46 41.1 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -118.73 130.54 55.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.406 -0.809 . . . . 0.0 109.648 -179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.473 ' H ' ' HB2' ' A' ' 40' ' ' SER . 44.9 t -131.45 135.41 59.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.15 144.98 18.24 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.296 -0.878 . . . . 0.0 108.633 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 30.0 m95 -99.61 139.75 34.82 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.833 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.481 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 52.6 t0 -144.92 156.65 44.1 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 51.7 mp0 -56.0 -39.03 71.28 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.868 -1.145 . . . . 0.0 109.447 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -72.91 -41.72 64.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 0.0 109.898 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -65.08 -38.11 89.69 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.224 -0.922 . . . . 0.0 110.548 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.659 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 53.0 mtp -62.0 -36.55 81.86 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.24 -0.913 . . . . 0.0 110.769 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.3 m -58.12 -41.16 83.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.794 -1.191 . . . . 0.0 109.714 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.02 -38.06 87.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.606 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 61.4 t80 -63.74 -45.35 90.28 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.204 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.645 HD13 HD23 ' A' ' 94' ' ' LEU . 85.8 mt -56.08 -31.29 63.07 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.236 -0.915 . . . . 0.0 109.914 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.566 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 25.7 m -51.25 -42.56 61.13 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.208 -0.932 . . . . 0.0 110.693 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 72' ' ' ALA . 73.5 m-20 -137.74 23.33 2.88 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.982 -1.074 . . . . 0.0 110.463 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.606 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER 50.06 11.6 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.903 -1.123 . . . . 0.0 109.143 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 70' ' ' ASN . . . -177.49 17.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.324 -0.86 . . . . 0.0 109.851 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -57.5 -38.59 74.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.012 -1.055 . . . . 0.0 109.58 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.9 -12.45 38.89 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.323 -0.861 . . . . 0.0 109.894 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.523 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -128.01 82.37 68.56 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.342 -0.849 . . . . 0.0 110.499 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -60.19 134.62 56.99 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 C-N-CA 121.957 1.771 . . . . 0.0 111.284 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.81 68.44 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.523 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 36.4 m -73.32 146.45 45.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.292 -1.122 . . . . 0.0 109.674 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 49' ' ' THR . 33.1 mttm -54.5 140.15 35.41 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.256 -0.903 . . . . 0.0 110.18 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.1 mtm -131.66 149.16 52.58 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.44 -0.788 . . . . 0.0 108.933 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 169.26 71.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.065 -1.022 . . . . 0.0 109.891 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.629 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 79.6 t80 -128.09 -90.3 0.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.629 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 179.77 -99.85 0.13 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -152.36 64.78 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.683 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 82' ' ' PHE . 3.3 tp -79.82 15.41 1.42 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.134 -1.215 . . . . 0.0 108.609 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.9 tttm -53.27 -30.18 37.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.833 . . . . 0.0 109.705 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -56.03 125.53 21.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.168 -0.958 . . . . 0.0 109.421 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.444 ' HG2' HH21 ' A' ' 91' ' ' ARG . 97.9 mt-10 -64.96 -29.9 70.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 110.1 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.3 mttp -56.22 -46.9 79.34 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.159 -0.963 . . . . 0.0 110.198 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.55 -50.23 39.7 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.047 -1.033 . . . . 0.0 109.674 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.566 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 84.0 mtm180 -59.96 -35.88 75.91 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.384 -0.823 . . . . 0.0 110.476 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 88' ' ' GLU . 66.8 m-20 -63.99 -62.21 1.78 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.064 -1.023 . . . . 0.0 110.22 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -62.66 -37.93 88.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.333 -0.855 . . . . 0.0 109.702 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.718 HD21 ' CMB' ' A' ' 104' ' ' HEC . 60.5 tp -51.09 -63.28 1.18 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.434 -0.791 . . . . 0.0 109.924 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.8 mt -65.03 -29.15 46.55 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 121.713 -0.617 . . . . 0.0 110.503 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.52 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.0 m -52.69 -40.92 63.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.951 -1.093 . . . . 0.0 108.894 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.689 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 87.4 t80 -75.5 -45.41 38.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.348 -0.845 . . . . 0.0 109.812 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.7 mt -61.54 -44.05 97.76 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 103' ' ' GLU . 13.5 tttm -61.46 -38.67 88.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.313 -0.867 . . . . 0.0 109.393 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -59.15 -43.38 92.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.275 -0.89 . . . . 0.0 109.1 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.8 65.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 50.5 m -62.79 -31.02 71.91 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.7 tt0 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.576 -0.703 . . . . 0.0 109.512 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.739 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -57.71 -33.39 68.35 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.218 -0.926 . . . . 0.0 109.364 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -97.28 128.36 44.06 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.31 -0.869 . . . . 0.0 109.738 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . 0.401 ' HB2' ' ND2' ' A' ' 92' ' ' ASN . 21.3 mmtm -104.33 150.35 24.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.17 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -89.93 -159.64 0.62 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.187 -0.945 . . . . 0.0 109.965 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 167.58 -111.85 0.46 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.96 110.29 4.19 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.19 -1.182 . . . . 0.0 109.046 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.674 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -63.46 -23.27 67.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.353 -0.842 . . . . 0.0 109.339 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.08 -51.01 69.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.324 -0.86 . . . . 0.0 109.482 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.23 -40.76 90.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.242 -0.911 . . . . 0.0 109.615 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.406 ' N ' ' HB3' ' A' ' 93' ' ' ASP . . . -62.17 -37.14 94.02 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.55 99.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.222 -1.163 . . . . 0.0 109.429 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' HG23 ' A' ' 12' ' ' THR . 36.8 p -78.16 -32.65 50.32 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.929 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 tp -61.55 -43.84 98.13 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.079 -1.013 . . . . 0.0 109.206 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -63.57 -47.09 82.94 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.513 -0.742 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mmtm -64.82 -33.9 77.08 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.493 -0.754 . . . . 0.0 110.882 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 8' ' ' THR . 72.1 p -89.51 2.81 54.08 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.128 -0.983 . . . . 0.0 111.72 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -145.47 -63.36 0.33 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.512 -1.368 . . . . 0.0 112.007 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.5 -32.89 74.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.934 -1.104 . . . . 0.0 111.26 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.43 -36.01 68.49 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.632 -1.293 . . . . 0.0 110.431 -179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -53.92 -41.23 67.46 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.961 -1.087 . . . . 0.0 110.254 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.494 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 90.6 m -106.62 -41.34 5.28 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.014 . . . . 0.0 110.308 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -95.66 154.04 17.42 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.927 0.87 . . . . 0.0 111.686 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -123.66 138.96 54.44 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.602 ' O ' ' CD2' ' A' ' 33' ' ' HIS . 39.2 t -65.64 -33.65 65.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.076 -1.015 . . . . 0.0 110.162 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -51.93 144.96 10.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.015 -1.053 . . . . 0.0 109.721 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -56.29 -34.12 66.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.402 -0.811 . . . . 0.0 109.382 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.23 132.0 7.41 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.584 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -134.12 168.59 23.3 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -56.56 -19.32 29.17 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.749 2.299 . . . . 0.0 111.654 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 69.5 m-70 57.79 36.96 26.95 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.522 -0.736 . . . . 0.0 109.546 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -57.4 -46.77 83.1 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.083 -1.01 . . . . 0.0 109.933 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' A' ' 17' ' ' CYS . 14.5 t -94.42 -62.85 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.083 -1.011 . . . . 0.0 109.805 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.59 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -130.95 173.72 20.16 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -58.93 22.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.513 2.142 . . . . 0.0 112.408 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.59 ' H ' ' C ' ' A' ' 29' ' ' GLY . 16.7 m120 55.96 -137.5 1.09 Allowed 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.339 -0.85 . . . . 0.0 109.62 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.918 HD11 HD13 ' A' ' 35' ' ' ILE . 10.6 tp -177.49 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.27 -0.894 . . . . 0.0 109.841 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.602 ' CD2' ' O ' ' A' ' 20' ' ' VAL . 38.6 t60 60.97 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.401 -0.812 . . . . 0.0 110.222 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.49 -2.4 49.84 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 120.06 -1.066 . . . . 0.0 111.012 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.918 HD13 HD11 ' A' ' 32' ' ' LEU . 48.2 pt -83.39 -20.2 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.73 -1.453 . . . . 0.0 110.592 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.435 ' HB2' HG21 ' A' ' 102' ' ' THR . 8.3 m-85 -59.67 128.87 39.11 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.905 -1.122 . . . . 0.0 108.52 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.32 24.89 64.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.443 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 6.2 tpp180 -141.8 166.6 24.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.491 -1.005 . . . . 0.0 108.835 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 38' ' ' ARG . 24.7 m80 -85.42 141.79 29.72 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.874 -1.141 . . . . 0.0 109.263 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.503 ' CA ' ' HE1' ' A' ' 59' ' ' TRP . 3.9 t -62.2 141.73 58.04 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.306 -0.871 . . . . 0.0 109.848 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 98.87 -1.93 58.17 Favored Glycine 0 N--CA 1.482 1.722 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.443 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 95.1 mt-30 -104.37 117.17 33.54 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.301 -1.117 . . . . 0.0 109.824 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.804 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -147.99 143.2 27.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.381 -0.824 . . . . 0.0 109.363 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -84.97 -44.85 12.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.47 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -58.17 -47.07 91.6 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.804 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 6.4 t80 -154.56 153.79 32.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.196 -1.179 . . . . 0.0 110.043 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.665 ' N ' ' CD1' ' A' ' 46' ' ' TYR . 4.8 t -88.6 130.14 35.33 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.622 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 69.7 m-85 -54.08 -175.66 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.144 -0.973 . . . . 0.0 110.428 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -70.01 146.3 51.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.45 -0.781 . . . . 0.0 109.478 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -48.99 -37.66 20.94 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.0 109.819 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.41 -52.21 62.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.936 -1.103 . . . . 0.0 109.198 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' O ' ' A' ' 55' ' ' LYS . 48.3 t-20 -61.08 -42.61 98.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.363 -0.836 . . . . 0.0 109.478 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 79.1 mt -65.76 -39.27 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.837 . . . . 0.0 109.938 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -57.27 -42.81 82.3 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.059 -1.026 . . . . 0.0 108.897 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 52' ' ' ASN . 23.5 mttm -104.38 120.27 40.84 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.487 -0.758 . . . . 0.0 109.14 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.6 p-10 -145.61 152.62 39.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.953 -1.092 . . . . 0.0 110.613 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' LEU . 60.7 t -143.91 139.65 25.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 O-C-N 121.587 -0.696 . . . . 0.0 109.203 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.42 ' C ' ' O ' ' A' ' 57' ' ' VAL . 52.1 tp -48.09 144.45 3.71 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.694 ' CE3' ' SD ' ' A' ' 64' ' ' MET . 25.7 m95 -99.69 142.54 31.04 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.37 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 52.1 t0 -149.26 170.41 18.55 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.584 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 97.9 mt-10 -59.23 -40.31 85.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.019 -1.051 . . . . 0.0 110.04 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -73.16 -44.38 60.06 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.162 -0.961 . . . . 0.0 110.553 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -64.66 -42.93 95.07 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.093 -1.005 . . . . 0.0 110.777 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.694 ' SD ' ' CE3' ' A' ' 59' ' ' TRP . 90.7 mmm -61.18 -36.49 80.0 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.149 -0.969 . . . . 0.0 110.356 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.59 ' HA ' HD11 ' A' ' 95' ' ' ILE . 83.4 p -60.44 -36.72 78.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.888 -1.132 . . . . 0.0 109.621 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.527 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.1 mt-10 -64.51 -37.71 88.5 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.187 -0.945 . . . . 0.0 109.507 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.573 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 61.2 t80 -63.87 -39.71 94.83 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.767 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 80.3 mt -55.28 -36.82 66.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.095 -1.003 . . . . 0.0 109.303 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.947 HG23 ' NH2' ' A' ' 91' ' ' ARG . 31.4 m -55.52 -40.34 71.69 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.19 -0.944 . . . . 0.0 108.99 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 72' ' ' ALA . 24.0 t30 -148.75 138.72 22.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 108.761 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.48 14.31 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.893 -1.129 . . . . 0.0 110.518 -179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -172.19 33.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.992 -1.067 . . . . 0.0 109.749 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -58.18 -41.54 84.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 109.707 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 30.5 m-85 -112.76 11.33 19.36 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.401 -0.812 . . . . 0.0 110.143 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.54 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 3.2 mt -132.57 70.87 79.33 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.052 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -55.22 134.4 63.58 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 C-N-CA 121.929 1.753 . . . . 0.0 111.437 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.98 -10.87 68.03 Favored Glycine 0 N--CA 1.486 1.989 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.54 ' OG1' ' CG2' ' A' ' 75' ' ' ILE . 59.8 m -73.76 145.26 45.23 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.271 -1.135 . . . . 0.0 109.664 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -61.64 141.83 57.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 72' ' ' ALA . 79.9 mtp -133.34 151.39 51.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.0 109.112 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -166.78 -45.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.948 -1.095 . . . . 0.0 110.458 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.775 ' CE2' HBB2 ' A' ' 104' ' ' HEC . 29.5 t80 -72.79 -110.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.944 -1.098 . . . . 0.0 110.381 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.65 ' N ' ' CG ' ' A' ' 82' ' ' PHE . . . 82.41 -173.48 52.97 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.138 -1.585 . . . . 0.0 109.138 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 -5.99 58.26 Favored Glycine 0 N--CA 1.491 2.364 0 O-C-N 121.138 -1.213 . . . . 0.0 110.576 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.51 HD21 ' CZ ' ' A' ' 82' ' ' PHE . 19.5 mt -82.7 35.38 0.46 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.838 -1.39 . . . . 0.0 109.518 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -51.21 -30.54 17.58 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.235 -0.916 . . . . 0.0 109.012 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -77.57 130.82 37.4 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.299 -0.876 . . . . 0.0 109.233 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -63.15 -27.08 69.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.357 -0.839 . . . . 0.0 110.157 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -55.27 -44.43 75.61 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.133 -0.979 . . . . 0.0 110.549 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -63.76 -44.42 93.51 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.979 -1.076 . . . . 0.0 109.707 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 69' ' ' THR . 87.5 mtt180 -63.19 -44.39 95.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.467 -0.77 . . . . 0.0 110.533 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.401 ' ND2' ' HB2' ' A' ' -2' ' ' LYS . 75.8 m-20 -67.36 -45.58 75.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.094 -1.004 . . . . 0.0 110.595 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.406 ' HB3' ' N ' ' A' ' 6' ' ' GLY . 86.1 m-20 -63.75 -39.25 93.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.355 -0.84 . . . . 0.0 110.32 -179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.16 -61.73 2.41 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 0.0 110.75 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 ' HA ' ' A' ' 65' ' ' SER . 27.4 mt -54.7 -38.02 41.8 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 121.623 -0.673 . . . . 0.0 109.98 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.674 HG22 ' HB2' ' A' ' 3' ' ' ALA . 20.2 m -56.55 -36.58 69.45 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -82.73 -48.97 10.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.686 -0.634 . . . . 0.0 110.031 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.6 mt -54.01 -49.75 68.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.137 -0.977 . . . . 0.0 109.227 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.584 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 58.0 tttp -60.53 -39.6 88.45 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.367 -0.833 . . . . 0.0 109.307 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -60.28 -43.71 95.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.379 -0.826 . . . . 0.0 109.282 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.02 -51.34 25.99 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 36' ' ' PHE . 43.5 m -61.94 -31.63 71.97 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.551 -0.718 . . . . 0.0 109.509 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.775 HBB2 ' CE2' ' A' ' 82' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 18.0 p . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -107.84 152.22 24.7 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.342 -0.849 . . . . 0.0 109.536 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' ' -2' ' ' LYS . 54.6 p90 -73.53 -5.74 42.07 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.309 -0.869 . . . . 0.0 109.661 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' -3' ' ' PHE . 22.9 tptt 57.3 112.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -0.878 . . . . 0.0 109.367 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.58 0.92 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.306 -0.871 . . . . 0.0 109.872 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -165.14 -76.7 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.2 107.02 4.27 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.253 -1.145 . . . . 0.0 109.112 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.811 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -65.56 -20.94 66.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.839 . . . . 0.0 109.577 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -55.02 -54.89 37.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.256 -0.903 . . . . 0.0 109.522 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -67.99 -41.89 81.61 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.252 -0.905 . . . . 0.0 109.728 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.2 -35.93 92.74 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.55 -48.15 83.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.175 -1.191 . . . . 0.0 109.578 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.7 p -77.8 -28.5 50.42 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.244 -0.91 . . . . 0.0 109.683 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.642 HD23 ' HG ' ' A' ' 94' ' ' LEU . 15.4 tp -56.87 -44.18 81.96 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.197 -0.939 . . . . 0.0 108.657 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 16.0 t80 -66.15 -45.5 80.76 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.536 -0.728 . . . . 0.0 109.653 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -62.49 -36.4 82.37 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.395 -0.816 . . . . 0.0 111.011 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.8 p -96.82 7.7 46.0 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.079 -1.013 . . . . 0.0 111.006 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.5 mmt-85 -135.33 -68.65 0.52 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.963 -1.085 . . . . 0.0 111.199 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.99 -30.11 69.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.083 -1.011 . . . . 0.0 110.454 -178.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.2 tp -56.36 -35.18 67.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.003 -1.061 . . . . 0.0 110.088 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -57.19 -38.31 73.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.157 -0.965 . . . . 0.0 110.481 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 73.0 m -111.21 -45.52 3.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.156 -0.965 . . . . 0.0 110.537 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.433 ' N ' ' O ' ' A' ' 14' ' ' CYS . 99.0 m-70 -94.76 155.68 16.72 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.115 -0.99 . . . . 0.0 110.285 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -119.09 141.75 48.49 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.636 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 37.3 t -60.54 -39.74 82.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 121.033 -1.042 . . . . 0.0 109.614 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.16 143.28 27.96 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.839 -1.163 . . . . 0.0 109.026 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -55.82 -33.23 64.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 108.894 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -100.47 -73.96 1.07 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.494 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.57 171.62 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.524 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 59.2 Cg_endo -76.3 142.33 23.94 Favored 'Trans proline' 0 C--N 1.304 -1.807 0 C-N-CA 122.822 2.348 . . . . 0.0 111.707 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.508 ' NE2' ' C ' ' A' ' 45' ' ' GLY . 95.0 m-70 -96.2 42.09 1.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.944 . . . . 0.0 109.195 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 26' ' ' HIS . 56.6 mttm -34.52 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.642 -0.662 . . . . 0.0 110.877 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -67.55 -48.02 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -146.1 172.12 26.82 Favored Glycine 0 N--CA 1.493 2.435 0 C-N-CA 119.522 -1.323 . . . . 0.0 110.852 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HA ' ' HD1' ' A' ' 26' ' ' HIS . 11.8 Cg_exo -45.85 159.42 0.22 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.816 2.344 . . . . 0.0 111.399 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 25' ' ' PRO . 10.1 m120 -99.17 135.6 40.33 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.334 -0.854 . . . . 0.0 109.599 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.952 HD11 HD13 ' A' ' 35' ' ' ILE . 6.8 tp -88.33 -138.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.493 0.663 . . . . 0.0 111.386 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.636 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 54.7 t60 69.47 115.09 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.313 0.578 . . . . 0.0 110.48 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.38 4.55 54.96 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 120.043 -1.075 . . . . 0.0 111.451 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.952 HD13 HD11 ' A' ' 32' ' ' LEU . 24.1 pt -93.7 -7.92 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.634 -1.509 . . . . 0.0 110.681 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.672 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 3.3 m-85 -57.01 -14.03 3.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.945 -1.097 . . . . 0.0 110.013 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -129.9 33.06 3.03 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.9 mmt180 -137.2 173.96 11.13 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.274 -1.133 . . . . 0.0 110.263 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -89.41 148.34 23.53 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.497 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.3 OUTLIER -59.0 134.61 57.14 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.133 -0.98 . . . . 0.0 110.006 -179.203 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.23 -0.13 55.93 Favored Glycine 0 N--CA 1.483 1.824 0 C-N-CA 119.948 -1.12 . . . . 0.0 110.669 179.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.17 118.66 37.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.985 -1.303 . . . . 0.0 109.986 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.667 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.51 148.67 32.45 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.526 -0.734 . . . . 0.0 109.149 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -92.27 -44.79 8.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.254 -0.904 . . . . 0.0 109.605 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.508 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -62.54 -54.46 33.89 Favored Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -141.96 138.82 32.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.153 -1.204 . . . . 0.0 110.454 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.591 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 43.6 p -75.64 139.64 42.12 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.667 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 80.1 m-85 -63.95 -177.33 0.25 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.331 -0.856 . . . . 0.0 110.606 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.0 m -68.83 145.23 53.91 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.588 -0.695 . . . . 0.0 109.331 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -50.29 -37.16 34.9 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 0.0 109.671 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.96 68.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.106 -0.996 . . . . 0.0 109.418 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 55' ' ' LYS . 40.5 t30 -60.48 -41.85 95.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.29 -0.881 . . . . 0.0 109.503 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 87.4 mt -63.1 -37.22 78.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.76 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -57.82 -44.37 86.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.061 -1.024 . . . . 0.0 108.871 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 52' ' ' ASN . 36.3 mttm -99.36 121.41 41.07 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 39.1 p-10 -148.33 146.06 28.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.85 -1.157 . . . . 0.0 110.833 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 56.6 t -144.75 142.01 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.536 -0.727 . . . . 0.0 109.487 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.1 tp -51.1 146.88 5.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.9 -1.125 . . . . 0.0 108.236 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 24.6 m95 -104.08 147.05 27.86 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.913 0.863 . . . . 0.0 111.415 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 55.5 t0 -147.3 164.81 32.04 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.454 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 97.4 mt-10 -56.68 -38.15 71.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.886 -1.134 . . . . 0.0 109.554 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -77.84 -43.26 30.91 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 110.304 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -62.67 -43.64 98.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.672 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 67.9 mtp -63.1 -33.56 75.7 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.127 -0.983 . . . . 0.0 109.887 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.539 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.1 t -54.93 -39.95 69.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.063 -1.023 . . . . 0.0 108.836 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.1 -38.3 90.56 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.351 -0.843 . . . . 0.0 109.001 179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' O ' ' O ' ' A' ' 70' ' ' ASN . 58.7 t80 -63.78 -42.85 97.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.34 -0.85 . . . . 0.0 109.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.46 -36.09 61.25 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.2 -0.938 . . . . 0.0 109.496 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.2 m -54.34 -41.55 69.21 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.067 -1.021 . . . . 0.0 108.741 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 72' ' ' ALA . 30.7 t-20 -147.39 137.23 22.95 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.675 ' O ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -56.23 -0.47 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.0 109.972 -179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -162.48 42.45 0.13 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.949 -1.094 . . . . 0.0 110.553 -179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -59.82 -40.65 89.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.092 -1.005 . . . . 0.0 109.726 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -116.22 3.98 13.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.28 -0.888 . . . . 0.0 110.476 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.9 mt -138.73 73.97 39.66 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.055 -1.028 . . . . 0.0 110.172 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -51.79 -29.78 35.49 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.461 2.107 . . . . 0.0 112.353 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.29 -23.79 49.22 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.675 HG21 ' O ' ' A' ' 71' ' ' HIS . 1.8 m -70.78 143.83 51.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.45 -1.029 . . . . 0.0 110.367 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -78.25 147.83 34.19 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.6 mtm -102.69 137.98 40.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.089 -1.007 . . . . 0.0 109.214 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -163.77 12.65 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.044 -1.035 . . . . 0.0 110.59 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.43 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 68.8 t80 -106.32 144.44 33.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.971 -1.081 . . . . 0.0 109.424 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.91 -43.24 87.55 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.43 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 119.39 128.99 3.82 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.2 mt -90.96 74.2 6.43 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -1.067 . . . . 0.0 108.756 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -58.6 -35.79 73.0 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.491 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -83.03 128.21 34.27 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.281 -0.887 . . . . 0.0 109.435 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.52 -28.51 69.7 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -56.6 -43.38 80.06 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.918 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.67 -49.98 71.04 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.964 -1.085 . . . . 0.0 109.128 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -58.94 -45.22 90.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 110.473 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -63.7 -42.6 97.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.064 -1.023 . . . . 0.0 110.075 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -61.82 -39.72 92.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.403 -0.811 . . . . 0.0 109.555 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.642 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.44 -63.62 1.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.827 . . . . 0.0 110.175 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 65' ' ' SER . 39.4 mt -52.93 -37.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 121.607 -0.683 . . . . 0.0 110.081 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.811 HG22 ' HB2' ' A' ' 3' ' ' ALA . 18.4 m -55.33 -40.13 70.83 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -79.78 -47.92 14.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.551 -0.718 . . . . 0.0 109.95 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.32 -43.72 83.54 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.147 -0.97 . . . . 0.0 109.028 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 103' ' ' GLU . 85.9 tttt -60.2 -39.03 85.11 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.385 -0.822 . . . . 0.0 109.387 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.55 -43.26 93.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.429 -0.794 . . . . 0.0 109.164 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.14 -50.6 46.36 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.0 m -62.32 -31.25 71.84 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.476 -0.765 . . . . 0.0 109.441 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.682 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . 0.58 ' N ' ' ND2' ' A' ' 62' ' ' ASN . 95.3 m . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -108.68 151.48 26.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 109.529 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -137.51 162.28 34.13 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 0.0 109.471 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -86.86 141.33 28.86 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.349 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -101.94 -166.48 1.3 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.227 -0.921 . . . . 0.0 109.728 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.25 -78.39 0.04 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.6 p -155.17 116.71 4.04 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.316 -1.108 . . . . 0.0 109.116 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.56 69.33 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.318 -0.864 . . . . 0.0 109.712 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.589 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -55.0 -62.37 1.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.363 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -61.88 -38.84 89.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.258 -0.901 . . . . 0.0 109.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.74 -40.4 98.06 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.89 -45.37 86.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.211 -1.17 . . . . 0.0 109.449 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.825 ' O ' HG23 ' A' ' 12' ' ' THR . 41.3 p -76.04 -29.57 58.11 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.257 -0.902 . . . . 0.0 109.62 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.549 HD23 ' HG ' ' A' ' 94' ' ' LEU . 35.0 tp -57.38 -44.38 84.4 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.138 -0.976 . . . . 0.0 108.885 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.605 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 50.1 t80 -63.63 -45.62 89.42 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mttp -63.7 -32.68 74.24 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.695 -0.628 . . . . 0.0 110.459 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.825 HG23 ' O ' ' A' ' 8' ' ' THR . 68.0 p -81.71 -8.3 59.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.307 -0.87 . . . . 0.0 112.305 -177.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -142.72 -60.25 0.44 Allowed 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.43 -1.419 . . . . 0.0 112.416 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.9 m -60.22 -35.15 74.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.814 -1.179 . . . . 0.0 110.688 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.492 HD12 HG22 ' A' ' 19' ' ' THR . 7.7 tp -58.09 -32.46 68.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.074 -1.016 . . . . 0.0 109.763 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -54.87 -37.36 66.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.159 -0.963 . . . . 0.0 110.178 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 51.0 m -101.95 -83.86 0.46 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.034 -1.041 . . . . 0.0 109.619 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB2' HD22 ' A' ' 31' ' ' ASN . 30.3 p80 -113.92 144.45 43.04 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.475 -0.766 . . . . 0.0 109.435 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.559 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 4.8 p -105.74 162.49 13.49 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.653 -0.654 . . . . 0.0 109.858 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.605 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 30.8 m -115.41 14.65 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.498 -0.751 . . . . 0.0 109.187 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -77.35 145.75 37.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.338 -0.851 . . . . 0.0 109.055 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -55.94 120.76 7.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.143 -0.973 . . . . 0.0 109.378 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.73 21.53 68.64 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.78 142.75 45.71 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.455 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 62.9 Cg_endo -74.63 145.2 32.7 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.481 2.12 . . . . 0.0 112.622 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.662 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 88.6 m-70 -85.36 68.99 10.66 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' NZ ' HG21 ' A' ' 19' ' ' THR . 41.6 mttp -50.33 -41.89 52.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.203 -0.936 . . . . 0.0 109.605 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 29' ' ' GLY . 8.8 p -151.03 -47.9 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.022 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.59 ' N ' HG13 ' A' ' 28' ' ' VAL . . . -105.46 158.8 15.73 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 -179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.41 138.82 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.548 2.165 . . . . 0.0 111.307 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.662 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 17.5 m120 -95.32 123.59 38.92 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.4 -0.812 . . . . 0.0 109.268 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.872 HD23 ' N ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -117.43 147.87 42.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.523 -0.736 . . . . 0.0 110.362 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -156.33 114.0 3.25 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.462 -0.774 . . . . 0.0 109.386 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 6.9 69.21 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.62 -7.58 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -1.181 . . . . 0.0 109.499 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CZ ' ' SD ' ' A' ' 64' ' ' MET . 9.1 m-85 -47.01 -25.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.365 -0.835 . . . . 0.0 109.19 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -114.98 31.08 6.45 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -129.63 172.4 11.64 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.362 -1.081 . . . . 0.0 110.544 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -89.21 142.88 27.26 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.583 ' OG ' ' CZ2' ' A' ' 59' ' ' TRP . 5.8 m -55.47 138.36 46.43 Favored 'General case' 0 C--N 1.298 -1.637 0 C-N-CA 119.696 -0.801 . . . . 0.0 109.595 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.16 -1.55 56.28 Favored Glycine 0 N--CA 1.484 1.898 0 C-N-CA 119.984 -1.103 . . . . 0.0 110.585 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -99.77 118.71 36.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.871 -1.37 . . . . 0.0 109.81 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -155.47 112.18 3.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -0.795 . . . . 0.0 109.376 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.6 mp0 -66.78 -37.52 84.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 109.251 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.452 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.7 -41.88 94.04 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 108.669 -1.772 . . . . 0.0 108.669 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.631 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 2.4 t80 -168.15 133.88 1.89 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.348 -1.089 . . . . 0.0 109.879 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.589 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 25.4 m -65.32 140.52 58.69 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.402 -0.811 . . . . 0.0 109.052 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.654 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 59.2 m-85 -63.5 -171.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.309 -0.87 . . . . 0.0 110.633 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.43 ' OG1' ' CE ' ' A' ' 79' ' ' LYS . 37.7 m -74.63 146.98 41.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.521 -0.737 . . . . 0.0 109.583 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -49.89 -37.94 33.51 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.172 -0.955 . . . . 0.0 109.839 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.421 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -63.82 -55.54 22.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.063 -1.023 . . . . 0.0 109.168 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.46 ' CB ' ' O1D' ' A' ' 104' ' ' HEC . 44.5 t-20 -58.24 -42.67 86.87 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.446 -0.784 . . . . 0.0 109.326 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.0 mt -65.42 -34.18 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.366 -0.834 . . . . 0.0 109.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.3 ttpm? -54.85 -41.93 71.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.114 -0.991 . . . . 0.0 108.71 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 52' ' ' ASN . 13.8 tttp -108.89 122.81 47.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.488 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 40.8 p-10 -130.81 143.4 50.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 109.886 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.903 HG11 ' OH ' ' A' ' 74' ' ' TYR . 39.2 t -141.23 140.18 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.362 -0.836 . . . . 0.0 110.547 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.5 tp -55.08 144.69 22.9 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.583 ' CZ2' ' OG ' ' A' ' 40' ' ' SER . 26.1 m95 -101.61 146.49 27.63 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.61 -0.836 . . . . 0.0 110.906 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.6 t0 -147.75 156.84 43.17 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.58 ' OE2' ' NZ ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -54.99 -38.62 68.06 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.9 -1.125 . . . . 0.0 109.311 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' -5' ' ' THR . 49.4 t30 -73.63 -43.83 58.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.244 -0.91 . . . . 0.0 110.069 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -64.16 -40.37 95.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.168 -0.957 . . . . 0.0 110.474 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.564 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 69.1 mtp -62.52 -35.63 80.0 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.206 -0.934 . . . . 0.0 110.387 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -53.74 -44.42 69.92 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.896 -1.128 . . . . 0.0 109.384 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.92 -37.1 83.41 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.082 -1.011 . . . . 0.0 108.985 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 71' ' ' HIS . 57.6 t80 -65.67 -43.12 90.28 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.424 -0.798 . . . . 0.0 110.454 -179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.1 mt -52.87 -37.18 60.11 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.755 -1.216 . . . . 0.0 109.535 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -77.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.071 -1.018 . . . . 0.0 109.495 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HB3' ' H ' ' A' ' 73' ' ' LYS . 24.2 m120 -67.47 -36.77 81.78 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.101 -0.999 . . . . 0.0 110.334 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.732 ' O ' ' HB2' ' A' ' 72' ' ' ALA . 30.2 t-80 55.91 31.42 17.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.393 -0.817 . . . . 0.0 109.452 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 1.092 ' HB1' HG21 ' A' ' 78' ' ' THR . . . 169.1 -37.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.031 -1.668 . . . . 0.0 111.025 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' H ' ' HB3' ' A' ' 70' ' ' ASN . 19.7 tttt -55.22 -33.18 62.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.841 -1.162 . . . . 0.0 108.987 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.903 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.1 t80 -56.82 -38.92 73.28 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.448 -0.782 . . . . 0.0 109.227 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -122.17 87.23 47.75 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.424 -0.798 . . . . 0.0 109.798 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -53.11 144.04 48.62 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.271 1.981 . . . . 0.0 111.753 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 98.88 -6.75 60.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 1.092 HG21 ' HB1' ' A' ' 72' ' ' ALA . 1.9 t -54.23 140.99 31.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.33 -1.1 . . . . 0.0 109.349 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.56 ' O ' ' SD ' ' A' ' 80' ' ' MET . 31.4 mttt -60.72 -46.31 90.92 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.084 -1.01 . . . . 0.0 110.149 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.56 ' SD ' ' O ' ' A' ' 79' ' ' LYS . 92.2 mmm -142.76 166.48 24.52 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.14 -0.975 . . . . 0.0 109.46 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.594 ' C ' ' HD1' ' A' ' 71' ' ' HIS . . . -120.85 -123.63 0.28 Allowed 'General case' 0 N--CA 1.484 1.27 0 O-C-N 121.5 -0.75 . . . . 0.0 109.474 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.4 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 72.4 t80 -165.35 -74.0 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.119 -0.988 . . . . 0.0 109.675 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 61.17 106.85 0.01 OUTLIER Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' O ' ' N ' ' A' ' 86' ' ' LYS . . . 171.92 -32.99 0.13 Allowed Glycine 0 N--CA 1.491 2.327 0 O-C-N 121.11 -1.23 . . . . 0.0 110.334 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.34 52.8 0.19 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.882 -1.363 . . . . 0.0 109.374 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 84' ' ' GLY . 68.8 mttm -56.92 -33.13 66.64 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.131 -0.981 . . . . 0.0 109.424 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.6 mttm -88.27 133.2 34.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.354 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.56 -28.81 69.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.252 -0.905 . . . . 0.0 109.769 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -56.06 -41.97 75.9 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.295 -0.878 . . . . 0.0 110.218 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.31 -43.74 96.09 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.094 -1.004 . . . . 0.0 109.418 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -61.09 -42.51 98.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.369 -0.832 . . . . 0.0 109.772 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -65.91 -43.57 87.77 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.251 -0.905 . . . . 0.0 110.308 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.34 -41.71 98.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.355 -0.841 . . . . 0.0 109.93 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.549 ' HG ' HD23 ' A' ' 9' ' ' LEU . 1.6 mt -56.75 -61.08 2.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.172 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 21.0 mt -55.02 -34.8 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 O-C-N 121.732 -0.605 . . . . 0.0 109.866 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -57.08 -39.69 75.45 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.205 -0.935 . . . . 0.0 108.668 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -81.59 -49.24 10.77 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.454 -0.779 . . . . 0.0 110.048 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.89 -52.01 59.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.251 -0.906 . . . . 0.0 109.366 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.58 ' NZ ' ' OE2' ' A' ' 61' ' ' GLU . 31.3 tttt -61.01 -38.52 86.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.495 -0.753 . . . . 0.0 109.21 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -59.32 -43.06 92.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.32 -0.862 . . . . 0.0 108.991 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.35 63.15 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 60.1 m -61.86 -31.4 71.66 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.578 -0.701 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.669 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.04 143.63 42.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.928 . . . . 0.0 109.468 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -100.58 130.02 46.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.261 -0.899 . . . . 0.0 109.832 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -104.48 152.43 22.36 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.387 -0.82 . . . . 0.0 109.126 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.35 170.81 15.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.282 -0.886 . . . . 0.0 109.886 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -145.87 -63.52 0.01 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.93 111.76 4.02 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.313 -1.11 . . . . 0.0 108.981 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -62.29 -24.15 67.13 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -0.874 . . . . 0.0 109.272 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -57.2 -45.26 83.92 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -64.6 -34.9 79.35 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.317 -0.865 . . . . 0.0 110.157 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.75 -43.98 80.36 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.904 -1.279 . . . . 0.0 109.904 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -65.51 -38.43 89.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.254 -1.145 . . . . 0.0 109.136 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.685 ' O ' HG22 ' A' ' 12' ' ' THR . 35.2 m -63.59 -41.91 98.3 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.407 -0.808 . . . . 0.0 110.187 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.2 tp -69.18 -49.14 59.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.203 -0.936 . . . . 0.0 110.593 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CE1' HG13 ' A' ' 20' ' ' VAL . 25.5 t80 -64.89 -46.46 81.67 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.191 -0.943 . . . . 0.0 110.757 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 pttp -64.33 -28.21 69.55 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.302 -0.874 . . . . 0.0 111.047 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.685 HG22 ' O ' ' A' ' 8' ' ' THR . 11.7 t -101.87 6.29 41.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.07 -1.019 . . . . 0.0 111.237 -178.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.604 ' HG3' HG23 ' A' ' 12' ' ' THR . 90.7 mtt-85 -138.17 -64.93 0.52 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.777 -1.202 . . . . 0.0 111.154 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -67.55 -26.03 66.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.871 -1.143 . . . . 0.0 109.678 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.2 tp -55.89 -36.07 67.22 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.113 -0.992 . . . . 0.0 109.98 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -57.32 -37.39 72.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 74.2 m -112.72 -44.6 3.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.235 -0.916 . . . . 0.0 110.78 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.451 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.6 m-70 -99.45 148.99 23.65 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.981 -1.074 . . . . 0.0 110.879 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 21' ' ' GLU . 28.4 m -124.01 128.65 49.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 20.5 m -69.44 -18.45 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.802 -1.186 . . . . 0.0 109.611 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -60.71 140.5 57.49 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.117 -0.99 . . . . 0.0 109.168 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.3 tptt -77.97 133.21 38.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.186 -0.946 . . . . 0.0 109.42 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.21 32.68 47.39 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.02 156.35 37.22 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -59.89 -16.02 35.94 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.806 2.337 . . . . 0.0 112.435 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' GLU . 49.7 m-70 60.44 47.57 8.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.376 -0.828 . . . . 0.0 109.443 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.43 -39.23 70.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.131 -0.98 . . . . 0.0 108.515 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.76 -66.92 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-O 121.316 0.579 . . . . 0.0 109.46 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.11 158.25 22.33 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.2 Cg_endo -59.86 -1.32 1.12 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.967 2.445 . . . . 0.0 112.39 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.436 ' HA ' ' H ' ' A' ' 19' ' ' THR . 7.7 m120 59.9 93.16 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.504 -0.747 . . . . 0.0 110.19 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.488 HD22 ' OH ' ' A' ' 48' ' ' TYR . 13.7 mt -89.51 151.26 22.06 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.339 -0.85 . . . . 0.0 110.214 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 84.3 t60 -168.86 99.45 0.38 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.474 -0.766 . . . . 0.0 109.61 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.15 5.03 68.13 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -66.56 -10.22 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.995 -1.297 . . . . 0.0 108.925 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 102' ' ' THR . 11.0 m-85 -46.56 -33.13 3.87 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.429 -0.794 . . . . 0.0 109.301 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -112.12 37.19 3.78 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' CD ' ' OE1' ' A' ' 42' ' ' GLN . 5.2 tpp180 -135.66 163.54 29.91 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.416 -1.049 . . . . 0.0 109.191 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -84.1 154.42 23.19 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.144 -0.972 . . . . 0.0 109.639 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.482 ' OG ' ' O2A' ' A' ' 104' ' ' HEC . 0.3 OUTLIER -66.76 138.19 57.19 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.351 -0.843 . . . . 0.0 109.58 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.467 ' N ' ' CD2' ' A' ' 48' ' ' TYR . . . 99.96 1.26 56.11 Favored Glycine 0 N--CA 1.488 2.109 0 C-N-CA 120.051 -1.071 . . . . 0.0 110.536 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.445 ' OE1' ' CD ' ' A' ' 38' ' ' ARG . 86.3 mt-30 -108.36 118.83 37.78 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -1.13 . . . . 0.0 109.632 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.11 -171.19 3.64 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.572 -0.705 . . . . 0.0 109.422 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.596 ' O ' ' NE2' ' A' ' 26' ' ' HIS . 95.1 mt-10 -121.84 160.11 25.37 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.43 -72.89 0.33 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.341 -1.503 . . . . 0.0 109.341 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.573 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 12.4 t80 -125.39 124.62 41.9 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.424 -1.045 . . . . 0.0 110.814 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.573 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 24.9 m -74.8 156.93 35.98 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 178.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.586 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 7.1 m-30 -54.38 -170.3 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.589 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.6 m -69.19 146.14 52.65 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.227 -0.921 . . . . 0.0 109.554 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -50.61 -41.62 55.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.984 . . . . 0.0 109.777 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.07 -47.17 75.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.062 -1.024 . . . . 0.0 108.567 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.687 HD22 ' CGD' ' A' ' 104' ' ' HEC . 56.2 t-20 -58.28 -43.46 87.99 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.566 -0.708 . . . . 0.0 109.364 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.79 -31.62 54.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.42 -0.8 . . . . 0.0 109.681 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -54.87 -43.52 73.23 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.134 -0.979 . . . . 0.0 108.648 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -101.41 115.28 30.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.593 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.5 OUTLIER -119.44 123.08 43.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.386 -0.821 . . . . 0.0 109.567 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.683 HG11 ' OH ' ' A' ' 74' ' ' TYR . 75.3 t -131.47 140.35 48.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.607 -0.683 . . . . 0.0 109.906 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.9 tp -54.03 144.2 19.95 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.518 ' O ' ' O ' ' A' ' 36' ' ' PHE . 25.1 m95 -100.36 149.42 23.64 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.698 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.491 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 47.5 t0 -155.25 161.31 41.17 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' OE1' ' OD1' ' A' ' 60' ' ' ASP . 51.1 mp0 -56.84 -38.8 73.17 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.843 -1.161 . . . . 0.0 109.077 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.42 ' O ' ' OG ' ' A' ' 65' ' ' SER . 38.0 t30 -69.69 -46.62 65.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.268 -0.895 . . . . 0.0 109.643 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -66.57 -43.63 84.45 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.021 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.461 ' O ' HD13 ' A' ' 68' ' ' LEU . 62.9 mtp -63.15 -34.83 78.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.227 -0.921 . . . . 0.0 109.653 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 87.1 p -56.67 -34.77 67.7 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.138 -0.977 . . . . 0.0 109.12 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.53 -42.35 82.89 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.305 -0.872 . . . . 0.0 109.223 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.539 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 49.9 t80 -67.29 -41.07 86.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.934 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' CD2' HD23 ' A' ' 94' ' ' LEU . 8.4 mp -54.93 -34.7 63.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 110.44 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.445 ' OG1' ' NH2' ' A' ' 91' ' ' ARG . 28.1 m -48.15 -42.22 28.88 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.982 -1.074 . . . . 0.0 108.698 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.511 ' O ' ' O ' ' A' ' 67' ' ' TYR . 28.1 t30 -162.7 158.8 23.54 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.488 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 9.7 m80 -75.75 144.6 41.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.937 -1.102 . . . . 0.0 110.828 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.623 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 66.18 1.02 1.83 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.818 -0.552 . . . . 0.0 111.154 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -57.87 -50.2 74.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.611 -1.306 . . . . 0.0 108.885 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.683 ' OH ' HG11 ' A' ' 57' ' ' VAL . 42.4 t80 -70.38 -34.6 72.76 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' OD1' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -124.1 82.13 56.85 Favored Pre-proline 0 N--CA 1.491 1.605 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.02 147.67 95.05 Favored 'Trans proline' 0 C--N 1.303 -1.854 0 C-N-CA 122.47 2.113 . . . . 0.0 112.155 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.26 -13.04 60.25 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 69.9 p -84.0 171.32 13.07 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.058 -1.26 . . . . 0.0 109.888 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -66.91 149.44 50.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.6 mtt -124.44 158.3 33.13 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.728 ' CB ' HBC2 ' A' ' 104' ' ' HEC . . . -171.37 -26.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.797 -1.19 . . . . 0.0 110.903 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.407 ' HB3' ' ND1' ' A' ' 71' ' ' HIS . 44.2 t80 -91.01 137.51 32.31 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.719 -1.238 . . . . 0.0 109.306 -179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.2 -40.63 75.92 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.69 135.78 4.96 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 mt -92.82 66.23 4.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.321 -1.105 . . . . 0.0 109.05 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -58.41 -32.99 69.16 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.379 -0.826 . . . . 0.0 109.325 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 89' ' ' LYS . 12.0 tttm -69.6 126.55 30.08 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.303 -0.873 . . . . 0.0 109.265 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.64 -28.92 69.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.426 -0.796 . . . . 0.0 110.027 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 87' ' ' LYS . 16.4 tttm -56.09 -52.46 64.21 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.213 -0.929 . . . . 0.0 109.887 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -65.68 -48.27 72.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.313 -0.867 . . . . 0.0 109.411 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.445 ' NH2' ' OG1' ' A' ' 69' ' ' THR . 38.6 ttm180 -57.5 -41.66 81.23 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.399 -0.813 . . . . 0.0 110.225 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -68.51 -54.75 14.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.089 -1.007 . . . . 0.0 110.397 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.191 -0.943 . . . . 0.0 109.615 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.628 HD21 ' CMB' ' A' ' 104' ' ' HEC . 38.9 tp -51.38 -59.66 3.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.371 -0.83 . . . . 0.0 109.784 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 68' ' ' LEU . 83.3 mt -65.5 -32.03 56.44 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 O-C-N 121.754 -0.591 . . . . 0.0 110.625 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.662 HG22 ' HB2' ' A' ' 3' ' ' ALA . 34.7 m -53.89 -42.17 68.39 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.035 -1.041 . . . . 0.0 109.047 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 85.3 t80 -74.45 -45.42 46.4 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.325 -0.859 . . . . 0.0 109.73 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 74.0 mt -61.02 -45.02 96.48 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.337 -0.852 . . . . 0.0 109.663 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 103' ' ' GLU . 61.4 tttm -61.39 -38.97 88.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.476 -0.765 . . . . 0.0 109.447 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -59.32 -42.95 92.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.326 -0.858 . . . . 0.0 109.174 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.68 -50.08 53.91 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.532 HG21 ' HB2' ' A' ' 36' ' ' PHE . 38.4 m -62.74 -31.26 72.16 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.489 1.495 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.483 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.728 HBC2 ' CB ' ' A' ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -61.63 -32.82 72.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.417 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -135.46 161.45 35.43 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.377 -0.827 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -71.55 131.59 43.48 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -105.44 -166.68 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.335 -0.853 . . . . 0.0 109.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -164.53 -76.25 0.03 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.376 -1.489 . . . . 0.0 109.376 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.7 p -151.62 113.09 4.36 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.223 -1.163 . . . . 0.0 108.949 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.73 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.65 -28.67 68.65 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.203 -0.936 . . . . 0.0 109.751 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HE3' ' H ' ' A' ' 4' ' ' LYS . 5.5 mtmt -57.72 -49.81 75.3 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.297 -0.877 . . . . 0.0 109.585 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -66.22 -43.36 86.89 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.226 -0.921 . . . . 0.0 109.631 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.03 91.42 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.94 94.84 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.239 -1.154 . . . . 0.0 109.55 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -75.52 -29.96 59.64 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.226 -0.921 . . . . 0.0 109.724 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 40.6 tp -53.67 -47.27 70.55 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.115 -0.99 . . . . 0.0 109.096 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.684 ' CE1' HG13 ' A' ' 20' ' ' VAL . 20.2 t80 -65.29 -45.46 84.32 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.485 -0.759 . . . . 0.0 109.202 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -61.71 -32.36 72.57 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.471 -0.768 . . . . 0.0 110.822 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.402 ' O ' HG22 ' A' ' 12' ' ' THR . 6.7 m -96.23 2.98 53.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.981 . . . . 0.0 111.134 -178.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.516 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 94.5 mtt180 -136.56 -67.29 0.51 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.897 -1.127 . . . . 0.0 111.488 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -65.3 -27.25 68.49 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.938 -1.101 . . . . 0.0 110.147 -178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.5 tp -54.39 -35.35 62.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.974 -1.079 . . . . 0.0 109.695 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -56.88 -37.31 71.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.328 -0.857 . . . . 0.0 110.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.404 ' SG ' HG11 ' A' ' 28' ' ' VAL . 72.7 m -114.0 -43.7 3.23 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.239 -0.913 . . . . 0.0 110.913 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.68 ' CE1' HD21 ' A' ' 32' ' ' LEU . 97.5 m-70 -99.56 155.67 17.46 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.977 -1.077 . . . . 0.0 110.999 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.527 HG22 ' H ' ' A' ' 21' ' ' GLU . 25.5 m -125.46 129.98 50.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.684 HG13 ' CE1' ' A' ' 10' ' ' PHE . 33.5 m -77.42 -18.74 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 120.886 -1.134 . . . . 0.0 109.86 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.527 ' H ' HG22 ' A' ' 19' ' ' THR . 84.3 tt0 -53.84 145.67 15.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.202 -0.936 . . . . 0.0 109.314 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 24' ' ' GLY . 79.9 tttt -55.9 134.68 52.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.269 -0.894 . . . . 0.0 109.084 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . 66.63 -72.4 0.16 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 23' ' ' GLY . . . 51.94 171.34 0.02 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.577 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 72.3 Cg_endo -78.95 140.03 15.74 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.771 2.314 . . . . 0.0 112.175 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.585 ' ND1' ' OD1' ' A' ' 31' ' ' ASN . 91.2 m-70 -99.11 30.98 3.2 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -54.24 -48.38 71.17 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.29 -0.881 . . . . 0.0 110.328 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.404 HG11 ' SG ' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -101.54 -69.75 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.062 -1.024 . . . . 0.0 109.23 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 31' ' ' ASN . . . -110.13 158.33 14.53 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.442 ' O ' ' CE1' ' A' ' 26' ' ' HIS . 12.3 Cg_endo -59.96 4.03 0.19 Allowed 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.767 2.311 . . . . 0.0 112.517 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.585 ' OD1' ' ND1' ' A' ' 26' ' ' HIS . 3.0 m120 63.19 85.36 0.13 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.468 -0.77 . . . . 0.0 110.145 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 32' ' ' LEU . 2.1 mm? -58.16 -127.61 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.196 -0.94 . . . . 0.0 109.824 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.531 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 2.7 t-80 79.93 94.59 0.05 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.533 -0.73 . . . . 0.0 110.286 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.33 1.25 58.05 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 120.09 -1.053 . . . . 0.0 110.891 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.85 HD13 HD12 ' A' ' 32' ' ' LEU . 30.5 pt -75.81 -13.62 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.778 -1.425 . . . . 0.0 109.959 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CD1' ' SD ' ' A' ' 64' ' ' MET . 6.9 m-85 -49.45 -31.4 9.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.928 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -110.04 34.1 5.63 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -136.11 168.67 18.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.141 -1.211 . . . . 0.0 110.371 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -90.16 146.78 24.02 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -56.9 133.69 54.82 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 119.412 -0.915 . . . . 0.0 108.978 179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.77 -6.07 35.18 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -99.49 110.25 22.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.952 -1.323 . . . . 0.0 109.406 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -111.58 160.63 17.01 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.365 -0.835 . . . . 0.0 110.081 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -77.74 -34.34 52.54 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.575 -0.703 . . . . 0.0 109.993 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.459 ' HA3' ' HE2' ' A' ' 26' ' ' HIS . . . -129.62 -48.86 0.13 Allowed Glycine 0 N--CA 1.489 2.216 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.498 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE1' ' O ' ' A' ' 47' ' ' SER . 4.3 t80 -112.48 115.5 28.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -1.1 . . . . 0.0 110.847 -178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.624 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 19.3 m -60.3 144.91 49.37 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CZ ' ' O1A' ' A' ' 104' ' ' HEC . 61.0 m-85 -55.64 -177.67 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.324 -0.86 . . . . 0.0 110.221 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.6 m -60.23 146.91 41.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -50.48 -38.44 43.95 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.192 -0.943 . . . . 0.0 109.64 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.94 79.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.006 -1.059 . . . . 0.0 108.934 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 55' ' ' LYS . 41.0 t-20 -60.45 -42.85 96.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.411 -0.806 . . . . 0.0 109.389 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.64 -36.26 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.414 -0.804 . . . . 0.0 109.681 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -55.09 -41.76 71.97 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.022 -1.049 . . . . 0.0 108.212 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 52' ' ' ASN . 98.9 mttt -98.05 125.39 43.0 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.552 ' N ' ' OD1' ' A' ' 56' ' ' ASN . 0.4 OUTLIER -137.06 123.35 20.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.14 -0.975 . . . . 0.0 109.894 -179.656 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -133.37 140.51 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.476 -0.765 . . . . 0.0 109.907 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.05 144.47 23.46 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.493 ' O ' ' O ' ' A' ' 36' ' ' PHE . 31.3 m95 -101.37 147.22 26.58 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.592 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.463 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 53.4 t0 -150.94 166.49 30.48 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.53 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.8 mt-10 -56.16 -38.85 71.45 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.963 -1.086 . . . . 0.0 109.295 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -77.31 -43.88 31.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 110.012 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.422 ' HB2' ' H ' ' A' ' 60' ' ' ASP . 87.5 m-20 -63.38 -44.67 94.07 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.195 -0.941 . . . . 0.0 110.197 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.661 ' SD ' ' CD1' ' A' ' 36' ' ' PHE . 52.9 mtp -63.35 -35.57 80.84 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.115 -0.991 . . . . 0.0 109.509 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -55.25 -39.58 69.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.883 . . . . 0.0 109.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -64.08 -38.86 92.6 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.204 -0.935 . . . . 0.0 109.422 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 70' ' ' ASN . 63.9 t80 -64.76 -42.26 95.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.945 . . . . 0.0 109.915 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.72 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -53.69 -37.78 63.57 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.863 -1.148 . . . . 0.0 109.738 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 29.7 m -55.96 -41.64 75.03 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.067 -1.021 . . . . 0.0 108.781 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.627 ' C ' ' H ' ' A' ' 72' ' ' ALA . 49.0 t30 -144.94 136.22 25.11 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB3' ' A' ' 82' ' ' PHE . 0.4 OUTLIER -61.82 21.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.042 -1.036 . . . . 0.0 110.478 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.627 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -177.29 33.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.86 -1.15 . . . . 0.0 109.732 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -58.41 -43.75 88.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.192 -0.943 . . . . 0.0 109.968 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -111.43 -0.31 16.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.327 -0.858 . . . . 0.0 110.101 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mt -137.17 72.31 53.2 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.119 -0.988 . . . . 0.0 109.848 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.76 -34.53 75.17 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.443 2.095 . . . . 0.0 111.858 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.8 -22.95 42.85 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 m -72.3 145.94 47.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.685 -0.891 . . . . 0.0 109.799 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -70.92 160.56 32.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.352 -0.842 . . . . 0.0 109.687 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 64.7 mtt -118.74 143.27 46.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.416 -0.802 . . . . 0.0 109.041 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.33 -56.77 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.955 -1.09 . . . . 0.0 110.51 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' CE1' ' A' ' 71' ' ' HIS . 38.9 t80 -66.59 -75.06 0.1 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.951 -1.093 . . . . 0.0 110.452 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 45.72 77.69 0.09 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.1 -21.82 0.03 OUTLIER Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.573 -1.299 . . . . 0.0 110.782 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.2 41.03 0.05 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.835 -1.391 . . . . 0.0 109.933 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.464 ' H ' ' C ' ' A' ' 84' ' ' GLY . 46.8 mttp -55.67 -30.02 60.32 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.197 -0.939 . . . . 0.0 109.077 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.63 131.98 36.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.264 -0.897 . . . . 0.0 109.397 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.415 -0.803 . . . . 0.0 110.183 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -53.95 -51.0 65.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.129 -0.982 . . . . 0.0 109.879 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -62.24 -43.85 97.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.346 -0.846 . . . . 0.0 109.345 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -57.69 -42.36 83.52 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 0.0 110.311 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.46 -54.26 13.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 110.306 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -63.68 -39.24 93.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -0.86 . . . . 0.0 109.746 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 HD13 ' A' ' 68' ' ' LEU . 35.3 tp -52.49 -58.26 7.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.35 -0.844 . . . . 0.0 109.964 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.3 -30.25 49.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 O-C-N 121.672 -0.642 . . . . 0.0 110.406 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 3' ' ' ALA . 27.1 m -51.02 -42.08 60.21 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.065 -1.022 . . . . 0.0 109.051 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -75.19 -45.09 42.78 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.0 109.865 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.8 mt -60.68 -43.24 97.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.336 -0.852 . . . . 0.0 109.599 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.53 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 21.3 tttm -60.37 -38.17 83.04 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.494 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -58.62 -43.53 89.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -0.904 . . . . 0.0 109.079 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.32 -48.6 61.02 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 m -62.46 -30.9 71.58 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.53 -0.732 . . . . 0.0 109.444 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.684 HMD1 ' CBD' ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -58.05 144.3 40.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.263 -0.898 . . . . 0.0 109.461 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -135.69 164.69 27.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.306 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -63.41 134.18 55.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.126 -0.984 . . . . 0.0 109.676 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.53 -154.6 0.54 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.294 -0.878 . . . . 0.0 109.509 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -170.2 -64.23 0.04 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.9 p -139.5 159.63 41.71 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.272 -1.134 . . . . 0.0 109.194 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.718 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -123.32 -24.83 4.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.46 -0.775 . . . . 0.0 109.615 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.688 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.14 -52.0 67.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.181 -0.949 . . . . 0.0 109.355 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -64.78 -41.93 95.46 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.288 -0.883 . . . . 0.0 109.637 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.66 -35.92 92.54 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.532 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.72 -43.14 99.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.312 -1.111 . . . . 0.0 109.709 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.7 p -72.83 -31.61 64.91 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.217 -0.927 . . . . 0.0 109.627 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.3 tp -55.95 -44.73 78.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.161 -0.962 . . . . 0.0 108.866 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 20.6 t80 -64.96 -44.63 88.76 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.483 -0.761 . . . . 0.0 109.39 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 mttp -61.8 -37.17 83.4 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.508 -0.745 . . . . 0.0 111.093 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.7 p -96.58 8.25 44.6 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.999 -1.063 . . . . 0.0 111.094 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -135.2 -69.21 0.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.935 -1.103 . . . . 0.0 110.974 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -68.45 -27.43 66.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.175 -0.953 . . . . 0.0 110.354 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.3 tp -54.66 -36.16 64.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.987 -1.071 . . . . 0.0 110.012 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -57.76 -37.47 73.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.141 -0.974 . . . . 0.0 110.414 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 72.3 m -112.3 -44.92 3.32 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.177 -0.952 . . . . 0.0 110.824 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 14' ' ' CYS . 97.9 m-70 -98.29 150.19 21.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.085 -1.01 . . . . 0.0 110.71 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -130.6 125.79 35.03 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.01 -22.47 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.043 -1.036 . . . . 0.0 109.372 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.51 146.15 16.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 109.932 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -66.23 133.73 51.22 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.384 -0.823 . . . . 0.0 109.11 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.46 -114.94 1.16 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.021 -1.631 . . . . 0.0 109.021 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.506 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 151.42 56.53 0.01 OUTLIER Glycine 0 N--CA 1.488 2.146 0 C-N-CA 119.593 -1.289 . . . . 0.0 110.303 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.493 ' HD3' ' H ' ' A' ' 24' ' ' GLY . 11.7 Cg_endo -57.89 -26.57 74.85 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.402 2.068 . . . . 0.0 111.307 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.506 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 45.5 m-70 45.4 58.16 4.38 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.504 -0.748 . . . . 0.0 109.786 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -55.59 -42.0 74.18 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.19 -0.944 . . . . 0.0 109.611 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -130.47 -56.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.444 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.27 172.84 16.75 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -44.82 149.07 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 122.335 2.024 . . . . 0.0 111.671 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.71 130.37 45.92 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.207 -0.933 . . . . 0.0 109.818 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.5 mp -104.67 150.74 24.45 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.488 0.661 . . . . 0.0 110.397 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -176.7 90.55 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.775 -0.578 . . . . 0.0 109.621 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 2.79 58.27 Favored Glycine 0 N--CA 1.489 2.212 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.845 179.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.657 HD13 ' HG ' ' A' ' 32' ' ' LEU . 31.1 pt -60.27 -11.24 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 120.616 -1.52 . . . . 0.0 109.006 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.496 ' O ' ' O ' ' A' ' 59' ' ' TRP . 15.6 m-85 -47.19 -32.16 4.19 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.538 -0.726 . . . . 0.0 110.048 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.84 38.1 3.32 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -136.88 168.93 18.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.087 -1.243 . . . . 0.0 110.356 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -90.0 145.25 25.24 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 136.42 49.4 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.82 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.6 -4.64 43.31 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -106.4 116.81 32.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -1.16 . . . . 0.0 109.759 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.06 153.04 50.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -88.91 -36.09 16.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.413 -0.804 . . . . 0.0 109.361 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -88.97 -72.13 1.27 Allowed Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 7.1 t80 -122.22 131.91 54.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.483 -1.01 . . . . 0.0 110.826 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.562 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 53.2 p -67.27 150.69 48.69 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.581 ' OH ' HD11 ' A' ' 32' ' ' LEU . 59.2 m-85 -63.59 -178.22 0.27 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 121.419 -0.801 . . . . 0.0 109.985 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.0 m -68.3 148.6 50.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.346 -0.847 . . . . 0.0 109.615 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -50.53 -39.35 48.75 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.917 . . . . 0.0 109.72 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.66 67.23 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.983 -1.073 . . . . 0.0 108.594 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.63 HD22 ' CGD' ' A' ' 104' ' ' HEC . 41.5 t-20 -59.43 -42.61 92.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.393 -0.817 . . . . 0.0 108.87 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.94 -31.34 53.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.538 -0.727 . . . . 0.0 109.572 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -54.52 -44.25 72.6 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.112 -0.992 . . . . 0.0 108.505 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.417 ' NZ ' ' O ' ' A' ' 74' ' ' TYR . 67.8 tttt -101.15 122.64 43.97 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.485 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 36.9 p-10 -125.17 127.83 47.42 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.366 -0.834 . . . . 0.0 110.0 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.8 t -135.19 139.62 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.347 -0.846 . . . . 0.0 110.287 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.4 tp -55.43 144.62 25.02 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.3 m95 -101.95 144.24 30.82 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.246 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 56.3 t0 -147.36 160.85 42.06 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 96.4 mt-10 -54.47 -40.31 68.33 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.022 -1.049 . . . . 0.0 109.199 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -75.42 -43.73 48.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.346 -0.847 . . . . 0.0 109.844 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -63.2 -41.58 99.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.981 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 59.9 mtp -63.64 -37.02 85.77 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.47 ' HA ' HD11 ' A' ' 95' ' ' ILE . 24.5 m -56.03 -38.51 70.63 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.063 -1.023 . . . . 0.0 109.177 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 97.3 mt-10 -64.02 -38.65 91.85 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.237 -0.915 . . . . 0.0 109.318 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.599 ' CE2' ' C2A' ' A' ' 104' ' ' HEC . 69.5 t80 -64.89 -43.39 93.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.192 -0.943 . . . . 0.0 109.677 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.521 HD12 HD11 ' A' ' 95' ' ' ILE . 86.9 mt -52.35 -35.28 50.76 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.1 -1.0 . . . . 0.0 109.519 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.8 m -54.27 -42.48 70.02 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.105 -0.997 . . . . 0.0 108.61 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.592 ' C ' ' H ' ' A' ' 72' ' ' ALA . 21.7 t30 -146.39 136.75 23.82 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.38 18.46 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.986 -1.071 . . . . 0.0 110.867 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.592 ' H ' ' C ' ' A' ' 70' ' ' ASN . . . -174.48 32.16 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.755 -1.216 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -59.65 -41.38 90.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.102 -0.999 . . . . 0.0 110.199 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.585 ' CE1' ' OE1' ' A' ' 66' ' ' GLU . 16.7 m-85 -109.4 11.43 25.11 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.261 -0.899 . . . . 0.0 110.362 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.524 ' CG2' ' OG1' ' A' ' 78' ' ' THR . 2.4 mt -130.49 76.54 77.39 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 109.885 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.78 130.68 39.77 Favored 'Trans proline' 0 C--N 1.3 -1.988 0 C-N-CA 121.789 1.659 . . . . 0.0 111.455 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.62 -3.25 71.25 Favored Glycine 0 N--CA 1.486 2.026 0 N-CA-C 109.257 -1.537 . . . . 0.0 109.257 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.568 HG23 ' CGD' ' A' ' 104' ' ' HEC . 1.8 m -76.57 151.2 36.38 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.077 -1.249 . . . . 0.0 109.786 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.488 ' NZ ' ' CMD' ' A' ' 104' ' ' HEC . 8.0 mtmp? -72.83 143.53 47.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.917 . . . . 0.0 109.46 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.5 mtm -127.38 158.27 37.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.94 -47.3 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.122 -0.987 . . . . 0.0 110.11 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -58.06 -42.91 86.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 109.895 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 109.41 -67.44 0.22 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 151.22 151.37 5.57 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.5 mt -98.97 86.44 3.47 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.313 -1.11 . . . . 0.0 109.292 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -61.16 -34.54 75.2 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.396 -0.815 . . . . 0.0 109.677 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -69.11 123.06 20.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.277 -0.889 . . . . 0.0 109.195 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.75 -33.03 75.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.196 -0.94 . . . . 0.0 109.613 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -59.54 -44.13 93.3 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.24 -0.913 . . . . 0.0 110.156 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.96 -57.21 6.57 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.147 -0.971 . . . . 0.0 109.293 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -56.1 -42.38 76.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 110.132 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -70.69 -53.08 17.06 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.978 -1.076 . . . . 0.0 110.212 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.99 -35.63 80.84 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.33 -0.856 . . . . 0.0 109.345 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.661 HD21 ' CMB' ' A' ' 104' ' ' HEC . 34.3 tp -51.87 -59.13 4.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.491 -0.755 . . . . 0.0 110.041 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.521 HD11 HD12 ' A' ' 68' ' ' LEU . 89.3 mt -65.02 -32.45 58.33 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.634 -0.666 . . . . 0.0 110.533 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.718 HG22 ' HB2' ' A' ' 3' ' ' ALA . 19.3 m -52.37 -40.97 62.68 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.053 -1.029 . . . . 0.0 108.972 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 80.5 t80 -76.24 -46.33 28.65 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.33 -0.856 . . . . 0.0 109.941 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.51 -49.91 73.36 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.464 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 103' ' ' GLU . 29.1 tttm -62.83 -37.97 88.91 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.495 -0.753 . . . . 0.0 109.376 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -58.4 -43.82 88.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.866 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.98 -48.44 58.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 103' ' ' GLU . 46.0 m -61.59 -31.01 71.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.544 -0.723 . . . . 0.0 109.458 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.713 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 33.7 p . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -106.91 150.37 26.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.332 -0.855 . . . . 0.0 109.458 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -138.22 161.2 37.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.264 -0.897 . . . . 0.0 109.578 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -76.79 133.38 39.42 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 109.434 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -108.65 -166.05 1.08 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.42 -0.8 . . . . 0.0 109.693 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -171.43 -76.12 0.04 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t -147.29 111.46 5.15 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.215 -1.168 . . . . 0.0 108.79 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.624 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.15 -32.75 74.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.258 -0.901 . . . . 0.0 109.953 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -61.03 -47.36 86.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 110.16 -179.472 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 4' ' ' LYS . 95.1 mttt -63.82 -43.47 96.13 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.969 -1.082 . . . . 0.0 109.545 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.674 ' HA2' HD12 ' A' ' 9' ' ' LEU . . . -61.44 -33.28 84.11 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.18 -44.38 95.11 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.356 -1.085 . . . . 0.0 109.769 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 p -75.33 -31.27 60.54 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.674 HD12 ' HA2' ' A' ' 6' ' ' GLY . 78.2 mt -56.01 -45.62 79.0 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.921 -1.112 . . . . 0.0 109.259 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.628 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.1 t80 -65.81 -43.34 88.96 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.288 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -62.95 -37.41 86.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.416 -0.803 . . . . 0.0 111.265 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 80.4 p -98.08 8.46 44.73 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.049 -1.032 . . . . 0.0 111.345 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -135.22 -66.77 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.921 -1.112 . . . . 0.0 110.8 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.78 -28.54 64.74 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.0 110.352 -178.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.1 tp -55.39 -36.06 65.98 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.936 -1.102 . . . . 0.0 109.82 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -56.73 -36.63 69.94 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.14 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 76.4 m -115.34 -46.67 2.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.196 -0.94 . . . . 0.0 110.823 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.517 ' N ' ' O ' ' A' ' 14' ' ' CYS . 96.2 m-70 -96.94 151.66 19.47 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.942 -1.099 . . . . 0.0 110.743 -179.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.1 m -126.09 126.78 44.76 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.628 HG13 ' CE1' ' A' ' 10' ' ' PHE . 28.5 m -69.91 -26.34 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.9 -1.125 . . . . 0.0 109.68 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.88 143.83 41.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.328 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -73.28 134.52 44.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.299 -0.876 . . . . 0.0 109.476 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.66 36.31 38.06 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.31 154.1 34.38 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.71 -13.14 37.85 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.946 2.431 . . . . 0.0 112.998 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.603 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 65.9 m-70 57.1 49.27 13.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.113 -0.992 . . . . 0.0 108.847 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -52.97 -43.44 66.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.223 -0.923 . . . . 0.0 110.055 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -114.37 -65.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.335 -0.853 . . . . 0.0 109.716 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.4 169.49 19.21 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.45 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 2.8 Cg_exo -42.86 147.47 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 123.342 2.695 . . . . 0.0 112.126 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.603 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 9.8 m120 -103.88 118.62 37.12 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.356 -0.84 . . . . 0.0 108.915 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.71 HD13 HD13 ' A' ' 35' ' ' ILE . 14.4 mt -100.55 151.04 22.06 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.336 -0.852 . . . . 0.0 110.75 -178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 86.0 t60 -171.06 100.92 0.21 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.43 7.27 62.05 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.71 HD13 HD13 ' A' ' 32' ' ' LEU . 20.8 pt -60.95 -10.82 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.897 -1.355 . . . . 0.0 108.632 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.578 ' HB2' HG21 ' A' ' 102' ' ' THR . 23.5 m-85 -58.48 119.32 6.79 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.48 ' O ' HD11 ' A' ' 58' ' ' LEU . . . 92.38 9.72 61.44 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.565 ' O ' ' N ' ' A' ' 59' ' ' TRP . 21.9 mmt85 -113.79 170.64 8.11 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.355 -1.085 . . . . 0.0 109.865 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -92.16 139.55 30.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.531 -0.73 . . . . 0.0 109.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.409 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.2 m -52.96 138.47 30.15 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.364 -0.835 . . . . 0.0 109.111 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.71 -0.92 55.39 Favored Glycine 0 N--CA 1.485 1.902 0 C-N-CA 119.81 -1.186 . . . . 0.0 110.399 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -102.0 117.56 35.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.01 -1.288 . . . . 0.0 110.409 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 46' ' ' TYR . . . -163.93 106.45 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.87 -36.78 82.27 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.23 -0.919 . . . . 0.0 109.116 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.518 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.95 -42.77 95.0 Favored Glycine 0 N--CA 1.486 1.982 0 N-CA-C 108.591 -1.804 . . . . 0.0 108.591 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 4.9 t80 -169.58 132.17 1.18 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.323 -1.104 . . . . 0.0 110.348 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.555 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 15.5 m -65.86 143.99 57.11 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.592 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 30.2 m-85 -63.71 -163.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.372 -0.83 . . . . 0.0 110.53 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.445 ' N ' ' O1D' ' A' ' 104' ' ' HEC . 60.3 m -78.02 147.64 34.72 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.528 -0.732 . . . . 0.0 109.641 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -49.24 -39.12 28.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.163 -0.961 . . . . 0.0 110.034 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.12 -54.24 32.96 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.906 -1.121 . . . . 0.0 109.052 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.489 ' O ' ' O ' ' A' ' 55' ' ' LYS . 45.6 t-20 -57.87 -42.78 85.28 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.551 -0.718 . . . . 0.0 109.541 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 98.6 mt -63.7 -35.8 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.261 -0.899 . . . . 0.0 109.634 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -55.7 -42.61 75.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' A' ' 52' ' ' ASN . 68.6 mttm -98.69 123.01 42.64 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.492 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 35.4 p-10 -128.39 129.31 46.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.027 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.944 HG11 ' OH ' ' A' ' 74' ' ' TYR . 47.6 t -137.35 136.99 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.265 -0.897 . . . . 0.0 110.161 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 37' ' ' GLY . 61.6 tp -53.63 144.0 18.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.271 -0.893 . . . . 0.0 108.686 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.565 ' N ' ' O ' ' A' ' 38' ' ' ARG . 27.2 m95 -100.27 143.43 30.48 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.706 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.45 160.44 40.57 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.575 ' OE1' ' NZ ' ' A' ' 99' ' ' LYS . 97.3 mt-10 -54.73 -38.72 67.48 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.025 -1.047 . . . . 0.0 109.211 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -75.79 -46.36 31.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.313 -0.867 . . . . 0.0 109.81 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -61.93 -42.42 99.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 110.052 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.41 ' HG2' ' CE3' ' A' ' 59' ' ' TRP . 62.2 mtp -62.16 -37.05 83.75 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.108 -0.995 . . . . 0.0 109.627 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.49 ' HA ' HD11 ' A' ' 95' ' ' ILE . 20.2 t -55.26 -37.42 67.23 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.175 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.77 -39.18 93.64 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.237 -0.915 . . . . 0.0 109.422 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.508 ' O ' ' O ' ' A' ' 70' ' ' ASN . 59.4 t80 -66.8 -44.89 80.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.3 mp -52.57 -33.79 47.48 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.057 -1.027 . . . . 0.0 109.566 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 m -51.07 -37.37 45.26 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 0.0 108.395 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.519 ' CG ' ' H ' ' A' ' 71' ' ' HIS . 42.9 t-20 -140.01 -151.28 0.36 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.519 ' H ' ' CG ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -136.32 9.83 3.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.057 -1.027 . . . . 0.0 109.391 179.412 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -170.26 -1.14 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.274 -0.891 . . . . 0.0 109.717 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -56.24 -43.28 78.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.162 -0.961 . . . . 0.0 108.51 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.944 ' OH ' HG11 ' A' ' 57' ' ' VAL . 48.6 t80 -64.9 -37.34 87.32 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.29 82.11 45.52 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -55.31 141.83 80.48 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.374 2.049 . . . . 0.0 112.06 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.91 73.29 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 79' ' ' LYS . 5.3 m -95.33 163.98 13.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.231 -1.158 . . . . 0.0 109.721 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.539 ' N ' HG22 ' A' ' 78' ' ' THR . 23.4 mttm -64.66 150.2 47.55 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.354 -0.841 . . . . 0.0 110.081 -179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.711 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 69.0 mtm -138.48 159.29 42.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.359 -0.838 . . . . 0.0 109.504 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 80' ' ' MET . . . 165.59 71.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.041 . . . . 0.0 110.485 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.589 ' CD2' ' N ' ' A' ' 83' ' ' GLY . 91.3 t80 -139.15 -93.33 0.18 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.008 -1.057 . . . . 0.0 109.892 178.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.589 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 176.88 -96.24 0.1 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.403 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -157.51 74.99 0.21 Allowed Glycine 0 N--CA 1.491 2.34 0 O-C-N 121.042 -1.27 . . . . 0.0 110.344 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.674 HD21 HD12 ' A' ' 94' ' ' LEU . 8.7 tp -77.81 16.34 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.223 -1.163 . . . . 0.0 109.016 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 84' ' ' GLY . 15.1 tttp -53.2 -29.98 34.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.358 -0.839 . . . . 0.0 109.385 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -52.58 124.94 14.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.143 -0.973 . . . . 0.0 109.156 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.54 -29.99 71.01 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.362 -0.836 . . . . 0.0 110.214 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -56.98 -50.19 73.44 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.104 -0.998 . . . . 0.0 110.248 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.63 -47.3 60.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.043 -1.035 . . . . 0.0 109.493 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -57.37 -46.18 83.64 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.433 -0.792 . . . . 0.0 110.484 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -69.93 -44.09 70.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.15 -0.969 . . . . 0.0 110.476 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -64.39 -41.66 96.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.288 -0.883 . . . . 0.0 110.263 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.674 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -54.84 -63.69 1.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.201 -0.937 . . . . 0.0 110.421 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 65' ' ' SER . 32.7 mt -54.43 -35.01 29.76 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.71 0 O-C-N 121.671 -0.643 . . . . 0.0 109.88 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.624 HG22 ' HB2' ' A' ' 3' ' ' ALA . 24.8 m -56.65 -39.34 73.53 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.192 -0.942 . . . . 0.0 108.52 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -83.05 -49.25 9.74 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.389 -0.819 . . . . 0.0 110.126 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -54.21 -46.94 72.59 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.207 -0.933 . . . . 0.0 108.802 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.575 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 26.1 tttt -60.62 -38.66 85.45 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.445 -0.785 . . . . 0.0 109.118 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -59.06 -43.4 91.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.34 -0.85 . . . . 0.0 109.237 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.71 -50.18 46.22 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.578 HG21 ' HB2' ' A' ' 36' ' ' PHE . 44.9 m -62.39 -31.08 71.69 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.534 -0.729 . . . . 0.0 109.478 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.695 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.66 -33.89 74.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.431 ' HB3' HD22 ' A' ' 62' ' ' ASN . 40.9 p90 -73.66 -7.95 54.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' -3' ' ' PHE . 21.7 tptm 56.46 106.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.286 -0.884 . . . . 0.0 109.545 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -69.01 -143.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.589 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -176.18 -80.27 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.8 t -148.94 111.35 4.71 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.332 -1.099 . . . . 0.0 109.052 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -66.71 -34.68 78.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.143 -0.973 . . . . 0.0 109.912 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.634 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -59.83 -54.94 40.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.463 -179.271 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -62.37 -41.36 98.56 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.169 -0.957 . . . . 0.0 109.75 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.18 -36.88 94.03 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.62 -45.95 90.51 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.29 -1.123 . . . . 0.0 109.827 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.5 p -73.96 -34.42 64.25 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.118 -0.988 . . . . 0.0 110.231 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.0 tp -54.83 -45.03 74.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.017 -1.052 . . . . 0.0 108.656 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.602 ' CE1' HG13 ' A' ' 20' ' ' VAL . 28.6 t80 -63.16 -45.37 92.17 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.522 -0.736 . . . . 0.0 109.064 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.44 -35.32 80.06 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.593 -0.692 . . . . 0.0 111.086 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.2 p -88.25 1.13 55.18 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.12 -0.988 . . . . 0.0 111.884 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.423 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 97.3 mtt180 -143.18 -64.26 0.4 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.523 -1.361 . . . . 0.0 112.088 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -65.04 -25.21 67.73 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.931 -1.105 . . . . 0.0 110.668 -178.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.55 -35.1 69.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.842 -1.161 . . . . 0.0 110.139 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -55.72 -38.12 69.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.143 -0.973 . . . . 0.0 110.381 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 96.1 m -111.96 -42.96 3.66 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.143 -0.973 . . . . 0.0 110.74 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.4 m-70 -96.32 150.36 20.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 111.25 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.6 m -126.15 124.4 40.43 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 177.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.602 HG13 ' CE1' ' A' ' 10' ' ' PHE . 34.1 m -73.12 -23.62 20.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 O-C-N 120.888 -1.133 . . . . 0.0 109.494 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.12 146.31 28.15 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.314 -0.866 . . . . 0.0 109.209 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -78.1 134.11 37.76 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.195 -0.941 . . . . 0.0 109.554 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 35.36 45.34 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.47 158.05 36.29 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.87 -17.3 59.05 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.118 2.545 . . . . 0.0 113.583 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.629 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 93.2 m-70 56.11 43.56 26.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 109.082 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -56.76 -47.99 78.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.03 -1.044 . . . . 0.0 110.441 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.43 -77.84 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 120.99 -1.069 . . . . 0.0 109.74 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.69 172.21 14.69 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -49.65 145.18 17.91 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 121.677 1.585 . . . . 0.0 110.261 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.629 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.6 m120 -83.55 11.59 6.89 Favored 'General case' 0 C--N 1.298 -1.668 0 O-C-N 121.275 -0.891 . . . . 0.0 111.465 -177.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.692 HD11 HD13 ' A' ' 35' ' ' ILE . 5.7 tp 44.63 -129.02 1.0 Allowed 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.194 -0.941 . . . . 0.0 110.242 177.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.407 ' H ' ' CG ' ' A' ' 32' ' ' LEU . 68.6 t60 61.46 111.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.701 -0.624 . . . . 0.0 110.651 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.97 2.09 51.94 Favored Glycine 0 N--CA 1.491 2.302 0 C-N-CA 120.011 -1.09 . . . . 0.0 111.782 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.692 HD13 HD11 ' A' ' 32' ' ' LEU . 13.9 pt -79.08 -18.07 13.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.511 -1.582 . . . . 0.0 110.484 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.671 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 39.5 m-85 -58.4 128.37 36.81 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.901 -1.124 . . . . 0.0 108.889 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.36 14.59 80.0 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.2 mmt-85 -132.31 172.94 11.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.483 -1.01 . . . . 0.0 110.121 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -91.12 141.1 29.18 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.485 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 1.8 t -55.23 139.42 42.37 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.17 -0.956 . . . . 0.0 109.348 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.14 -9.06 42.44 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -99.77 117.44 34.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.039 -1.271 . . . . 0.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -156.87 117.38 3.6 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.465 -0.772 . . . . 0.0 109.323 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -66.33 -35.84 81.39 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -0.846 . . . . 0.0 108.944 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.538 ' C ' ' NE2' ' A' ' 26' ' ' HIS . . . -57.88 -41.46 94.18 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.587 ' CZ ' ' O ' ' A' ' 47' ' ' SER . 3.9 t80 -174.67 133.55 0.36 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.269 -1.136 . . . . 0.0 110.275 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.587 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 27.3 m -64.9 138.8 58.6 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.586 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 63.7 m-85 -65.49 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.0 110.321 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 46.9 m -72.36 151.76 42.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.498 -0.751 . . . . 0.0 109.337 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -51.73 -39.23 58.07 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.218 -0.926 . . . . 0.0 109.922 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.28 -48.91 73.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.018 -1.051 . . . . 0.0 109.026 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.529 HD22 ' CGD' ' A' ' 104' ' ' HEC . 62.6 t-20 -58.37 -43.26 88.36 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.483 -0.76 . . . . 0.0 109.424 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 83.5 mt -69.68 -40.7 79.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -58.62 -45.31 89.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.182 -0.948 . . . . 0.0 108.937 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 52' ' ' ASN . 27.6 mttt -102.19 117.86 35.66 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -141.57 155.45 45.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.949 -1.094 . . . . 0.0 110.993 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.442 HG11 ' HE2' ' A' ' 74' ' ' TYR . 40.5 t -145.02 141.63 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.8 tp -52.79 145.11 12.95 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.485 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 27.7 m95 -100.95 145.01 29.21 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.144 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 54.9 t0 -146.36 167.03 24.57 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.539 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 96.9 mt-10 -57.66 -39.17 76.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.936 -1.102 . . . . 0.0 109.579 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.431 HD22 ' HB3' ' A' ' -3' ' ' PHE . 26.3 m120 -76.55 -45.31 31.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.25 -0.906 . . . . 0.0 110.349 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -61.36 -43.86 98.16 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.13 -0.981 . . . . 0.0 110.332 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.671 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 50.8 mtp -62.76 -35.87 81.21 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.172 -0.955 . . . . 0.0 110.113 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 68' ' ' LEU . 86.3 p -59.06 -34.45 71.96 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.998 -1.064 . . . . 0.0 109.331 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.32 -41.04 94.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.187 -0.945 . . . . 0.0 109.385 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' CE1' ' C2A' ' A' ' 104' ' ' HEC . 40.5 t80 -65.18 -41.23 94.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.187 -0.946 . . . . 0.0 109.761 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 65' ' ' SER . 95.0 mt -53.2 -34.94 59.12 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.14 -0.975 . . . . 0.0 109.882 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 1.023 HG23 ' NH2' ' A' ' 91' ' ' ARG . 49.0 m -53.37 -41.86 66.29 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.088 -1.007 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.499 ' O ' ' O ' ' A' ' 67' ' ' TYR . 39.8 t-20 -157.26 157.73 34.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 109.099 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.463 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 10.6 m80 -79.29 143.72 34.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.018 -1.051 . . . . 0.0 109.97 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.579 ' HB2' ' OG1' ' A' ' 78' ' ' THR . . . 64.47 13.35 8.08 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.569 -0.707 . . . . 0.0 110.663 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.72 -43.84 97.34 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.898 -1.127 . . . . 0.0 109.718 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.442 ' HE2' HG11 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -92.4 -16.83 25.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.543 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.19 80.56 71.44 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.432 -0.792 . . . . 0.0 109.439 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.68 146.1 95.19 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.558 2.172 . . . . 0.0 112.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.71 -6.23 64.74 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.329 -1.509 . . . . 0.0 109.329 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.579 ' OG1' ' HB2' ' A' ' 72' ' ' ALA . 76.5 p -89.55 171.3 9.8 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.256 -1.143 . . . . 0.0 109.731 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.1 mttm -70.75 142.22 51.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.459 -0.775 . . . . 0.0 110.019 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.2 mtm -130.53 156.37 44.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -170.19 -45.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.777 -1.202 . . . . 0.0 110.841 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -64.3 -89.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.848 -1.157 . . . . 0.0 110.236 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.95 67.74 1.94 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 86' ' ' LYS . . . -143.69 -25.51 0.15 Allowed Glycine 0 N--CA 1.495 2.601 0 O-C-N 120.9 -1.353 . . . . 0.0 110.962 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.99 42.78 0.05 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.854 -1.38 . . . . 0.0 110.044 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' A' ' 84' ' ' GLY . 24.5 mttm -56.38 -30.99 63.41 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.109 -0.995 . . . . 0.0 109.111 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -83.88 134.81 34.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.585 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.54 -26.08 66.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -52.92 -49.71 65.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.124 -0.985 . . . . 0.0 109.909 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -61.46 -42.07 98.21 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.364 -0.835 . . . . 0.0 109.554 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 1.023 ' NH2' HG23 ' A' ' 69' ' ' THR . 71.0 mtt180 -58.75 -43.79 90.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.427 -0.795 . . . . 0.0 109.878 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -67.87 -44.93 75.93 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.201 -0.937 . . . . 0.0 110.587 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -64.82 -41.27 95.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.58 -61.37 2.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.47 -35.05 36.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 O-C-N 121.664 -0.647 . . . . 0.0 110.509 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.5 m -56.22 -39.28 72.24 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.083 -1.01 . . . . 0.0 108.745 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -84.14 -47.84 10.46 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.423 -0.798 . . . . 0.0 110.452 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.2 mt -53.16 -51.99 60.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.228 -0.92 . . . . 0.0 109.866 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.539 ' CE ' ' OE2' ' A' ' 61' ' ' GLU . 24.9 tttm -62.79 -40.56 97.73 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.315 -0.865 . . . . 0.0 109.555 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.69 -42.84 93.85 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.069 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.6 -47.82 65.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.6 m -62.41 -30.93 71.57 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.6 tt0 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.507 -0.745 . . . . 0.0 109.515 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.692 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' -4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' -5' ' ' THR . 96.1 mt-10 42.4 -166.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.851 . . . . 0.0 109.546 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -137.18 162.31 33.8 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.201 -0.937 . . . . 0.0 109.553 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -89.42 143.36 26.89 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.241 -0.912 . . . . 0.0 109.345 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -103.26 -162.61 0.92 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.329 -0.857 . . . . 0.0 109.696 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -168.17 -74.74 0.04 OUTLIER Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -148.93 110.76 4.55 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.284 -1.127 . . . . 0.0 109.296 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.535 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.69 -30.89 71.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.585 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.618 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.91 -62.91 1.47 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.197 -0.939 . . . . 0.0 109.156 -179.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -61.85 -38.36 87.96 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.25 -0.906 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.34 -38.15 94.23 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.31 96.24 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.202 -1.175 . . . . 0.0 109.532 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.7 p -74.06 -29.97 62.16 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.23 -0.918 . . . . 0.0 109.729 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.565 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 43.5 tp -53.86 -48.22 70.23 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.159 -0.963 . . . . 0.0 109.264 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.554 ' CZ ' HG23 ' A' ' 20' ' ' VAL . 44.8 t80 -64.11 -43.45 95.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.391 -0.818 . . . . 0.0 109.078 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.26 -34.38 77.55 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.555 -0.716 . . . . 0.0 110.879 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.8 p -92.81 3.27 55.96 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.055 -1.028 . . . . 0.0 111.779 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.565 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 96.0 mtt180 -137.62 -66.03 0.51 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.712 -1.242 . . . . 0.0 111.523 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' CD2' ' A' ' 10' ' ' PHE . 1.7 m -65.6 -34.25 77.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.108 -0.995 . . . . 0.0 110.688 -178.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.571 HD12 HG22 ' A' ' 19' ' ' THR . 10.1 tp -56.74 -32.93 66.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.995 -1.066 . . . . 0.0 109.622 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.88 -36.29 62.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -0.961 . . . . 0.0 109.73 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 54.6 m -104.77 -89.32 0.42 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 109.643 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HB2' HD22 ' A' ' 31' ' ' ASN . 28.1 p80 -106.89 145.59 32.01 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 121.393 -0.817 . . . . 0.0 109.345 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.571 HG22 HD12 ' A' ' 15' ' ' LEU . 8.0 p -104.92 162.61 13.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.544 -0.722 . . . . 0.0 110.333 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' CZ ' ' A' ' 10' ' ' PHE . 6.7 t -105.31 -5.8 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.444 -0.785 . . . . 0.0 109.18 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.82 145.18 35.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 108.982 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.72 124.65 22.49 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.123 -0.985 . . . . 0.0 109.289 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.79 18.05 76.05 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.62 143.32 45.33 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.442 ' C ' ' OD1' ' A' ' 31' ' ' ASN . 56.7 Cg_endo -72.73 145.36 41.07 Favored 'Trans proline' 0 N--CA 1.492 1.434 0 C-N-CA 122.435 2.09 . . . . 0.0 112.22 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 31' ' ' ASN . 75.8 m-70 -82.19 66.77 7.93 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.18 -0.95 . . . . 0.0 108.488 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -52.56 -40.92 63.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.902 . . . . 0.0 110.096 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.1 t -135.43 -54.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.175 -0.953 . . . . 0.0 110.038 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -117.66 167.6 12.81 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.38 139.32 86.55 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.748 2.299 . . . . 0.0 111.296 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.705 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 15.0 m120 -96.2 124.38 40.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.241 -0.912 . . . . 0.0 109.325 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' OH ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -115.59 148.42 39.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 110.446 -179.473 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -155.61 117.69 4.1 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.53 -0.731 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 7.01 82.34 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.7 pp -69.9 -6.81 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.148 -1.207 . . . . 0.0 109.25 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' A' ' 59' ' ' TRP . 7.6 m-85 -46.68 -20.78 0.14 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.314 -0.866 . . . . 0.0 108.93 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 35' ' ' ILE . . . -121.09 31.14 5.23 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.1 mmt-85 -127.43 170.54 12.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.367 -1.078 . . . . 0.0 109.981 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.9 152.6 21.95 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.539 -0.725 . . . . 0.0 109.569 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.458 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 0.1 OUTLIER -59.41 133.0 55.68 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.432 -0.793 . . . . 0.0 110.243 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.1 1.27 57.07 Favored Glycine 0 N--CA 1.484 1.864 0 C-N-CA 119.856 -1.164 . . . . 0.0 110.973 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -99.09 119.91 38.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.89 -1.359 . . . . 0.0 110.313 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -146.65 156.31 43.1 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -98.43 -52.3 3.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.086 -1.009 . . . . 0.0 110.148 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.46 -51.62 57.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE1' ' O ' ' A' ' 47' ' ' SER . 3.8 t80 -140.29 141.0 35.8 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.096 -1.238 . . . . 0.0 110.271 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.597 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 11.2 t -79.27 137.2 37.28 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.429 -0.795 . . . . 0.0 109.024 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.811 ' OH ' HD22 ' A' ' 32' ' ' LEU . 69.3 m-85 -57.49 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.862 . . . . 0.0 110.625 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.8 m -74.3 148.67 41.18 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.589 -0.694 . . . . 0.0 109.458 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -50.25 -37.17 34.41 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.216 -0.927 . . . . 0.0 110.169 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.521 ' HB1' ' HA3' ' A' ' 77' ' ' GLY . . . -61.36 -57.36 12.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.949 -1.095 . . . . 0.0 109.28 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LYS . 47.0 t-20 -58.51 -42.39 87.55 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.815 . . . . 0.0 109.539 179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.489 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 92.9 mt -65.02 -32.9 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.427 -0.796 . . . . 0.0 109.697 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.9 tttt -56.71 -42.37 79.03 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.146 -0.971 . . . . 0.0 108.847 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' O ' ' O ' ' A' ' 52' ' ' ASN . 44.2 tttp -108.07 123.98 49.51 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.489 ' OD1' ' O ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -129.68 130.37 45.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.237 -0.914 . . . . 0.0 109.725 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 40' ' ' SER . 38.9 t -127.99 135.98 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.42 -0.8 . . . . 0.0 109.484 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.9 tp -53.65 144.5 17.58 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.215 -0.928 . . . . 0.0 108.774 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.51 ' O ' ' O ' ' A' ' 36' ' ' PHE . 29.6 m95 -102.15 148.17 25.73 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.718 0.77 . . . . 0.0 110.857 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -151.28 159.61 44.25 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' OE2' ' CE ' ' A' ' 99' ' ' LYS . 97.0 mt-10 -55.28 -37.96 67.98 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.943 -1.098 . . . . 0.0 109.097 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -74.61 -45.59 44.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.375 -0.828 . . . . 0.0 109.933 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.53 -41.69 98.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 110.262 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 36' ' ' PHE . 61.5 mtp -62.04 -33.88 75.21 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.125 -0.984 . . . . 0.0 109.858 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.5 m -55.95 -39.47 71.79 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.085 -1.009 . . . . 0.0 109.055 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -65.31 -38.22 89.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 70' ' ' ASN . 60.0 t80 -62.49 -45.86 91.07 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.554 HD13 HD23 ' A' ' 94' ' ' LEU . 70.3 mt -56.07 -42.54 76.84 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.124 -0.985 . . . . 0.0 109.223 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.586 ' OG1' ' NE ' ' A' ' 91' ' ' ARG . 31.4 m -60.66 -39.84 89.86 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -126.38 90.61 3.21 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -81.67 134.39 35.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.463 -0.773 . . . . 0.0 110.111 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 79' ' ' LYS . . . 57.2 34.35 24.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.541 -0.724 . . . . 0.0 110.011 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' A' ' 70' ' ' ASN . 38.7 tptt -132.14 -36.82 1.14 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -58.89 -28.85 66.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.532 -0.73 . . . . 0.0 109.108 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 78' ' ' THR . 0.0 OUTLIER -110.35 97.37 31.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.456 -0.778 . . . . 0.0 109.699 -179.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -53.84 140.7 67.69 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 121.921 1.747 . . . . 0.0 111.743 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.521 ' HA3' ' HB1' ' A' ' 51' ' ' ALA . . . 90.39 -0.1 77.34 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 75' ' ' ILE . 11.5 t -86.78 162.26 17.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.445 -1.033 . . . . 0.0 109.289 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.534 ' O ' ' HB1' ' A' ' 72' ' ' ALA . 21.5 mttt -88.56 135.07 33.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.137 -0.977 . . . . 0.0 108.724 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 59.0 ttp -119.06 148.1 43.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.316 -0.865 . . . . 0.0 109.754 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.685 ' HB3' HBC2 ' A' ' 104' ' ' HEC . . . -172.63 21.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.134 -0.979 . . . . 0.0 110.49 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.42 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 63.1 t80 -99.95 142.47 31.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 109.397 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -54.77 -52.72 44.01 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.42 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 155.18 95.2 0.11 Allowed Glycine 0 N--CA 1.495 2.568 0 O-C-N 120.901 -1.352 . . . . 0.0 110.469 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 90' ' ' ASP . 9.0 tp -82.67 19.14 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.38 -1.071 . . . . 0.0 109.074 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -53.42 -28.56 30.55 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.285 -0.884 . . . . 0.0 109.367 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -56.61 122.29 11.71 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.225 -0.922 . . . . 0.0 109.092 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -62.41 -29.2 70.32 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.373 -0.829 . . . . 0.0 110.207 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -56.69 -54.0 51.2 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.109 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.504 ' HB3' HD11 ' A' ' 85' ' ' LEU . 86.0 m-20 -64.78 -45.11 87.74 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.66 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.586 ' NE ' ' OG1' ' A' ' 69' ' ' THR . 20.9 mtp-105 -57.72 -38.29 75.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.863 . . . . 0.0 110.7 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.27 -56.28 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.05 -1.032 . . . . 0.0 111.215 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' OD1' ' N ' ' A' ' 94' ' ' LEU . 54.8 p30 -67.62 -32.74 73.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.05 -1.031 . . . . 0.0 110.436 -179.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.646 HD21 ' CMB' ' A' ' 104' ' ' HEC . 43.9 tp -55.77 -55.36 33.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.088 -1.008 . . . . 0.0 110.121 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.418 HD11 HD12 ' A' ' 68' ' ' LEU . 64.1 mt -65.5 -31.82 55.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 O-C-N 121.663 -0.648 . . . . 0.0 110.568 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.535 HG22 ' HB2' ' A' ' 3' ' ' ALA . 22.9 m -51.38 -41.27 60.57 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.989 -1.069 . . . . 0.0 108.882 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -77.44 -46.13 23.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.347 -0.846 . . . . 0.0 110.148 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -57.88 -49.96 74.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 103' ' ' GLU . 20.0 tttm -61.85 -38.01 86.62 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.347 -0.846 . . . . 0.0 109.488 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -58.7 -43.36 90.02 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.32 -0.862 . . . . 0.0 108.94 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 -48.66 57.95 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 m -61.76 -31.24 71.42 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.508 -0.745 . . . . 0.0 109.494 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.748 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -58.32 144.67 40.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.837 . . . . 0.0 109.501 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -98.06 130.2 44.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.264 -0.898 . . . . 0.0 109.753 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -110.94 152.06 27.21 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.404 -0.81 . . . . 0.0 109.3 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.29 -172.31 3.11 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.301 -0.874 . . . . 0.0 109.767 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -167.67 -68.03 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -148.27 113.14 5.43 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.26 -1.141 . . . . 0.0 108.998 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.459 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -67.77 -35.16 78.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.913 . . . . 0.0 110.164 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.657 ' H ' ' CD ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -60.48 -51.35 69.81 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.945 . . . . 0.0 109.596 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -61.87 -42.3 98.89 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.186 -0.946 . . . . 0.0 109.572 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -64.42 -35.33 91.83 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 97' ' ' TYR . . . -61.22 -40.47 94.12 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.275 -1.133 . . . . 0.0 109.75 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 41.5 p -73.09 -32.74 65.18 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.146 -0.971 . . . . 0.0 109.868 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.762 HD11 ' HE ' ' A' ' 13' ' ' ARG . 45.4 tp -56.99 -44.58 82.86 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.124 -0.985 . . . . 0.0 109.021 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 10' ' ' PHE . 11.8 t80 -61.81 -44.71 96.31 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.408 -0.808 . . . . 0.0 109.126 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -63.18 -35.1 79.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.537 -0.727 . . . . 0.0 110.857 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 p -92.95 6.06 49.2 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.091 -1.006 . . . . 0.0 111.447 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.762 ' HE ' HD11 ' A' ' 9' ' ' LEU . 95.6 mtt-85 -140.23 -66.61 0.44 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.712 -1.243 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.9 m -66.22 -30.51 70.97 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.92 -1.112 . . . . 0.0 110.513 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.3 tp -56.39 -35.23 67.52 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.86 -1.15 . . . . 0.0 110.061 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -56.87 -37.71 71.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 0.0 110.474 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' SG ' HMC1 ' A' ' 104' ' ' HEC . 73.2 m -112.56 -46.35 3.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.0 110.555 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 14' ' ' CYS . 98.1 m-70 -93.81 153.39 18.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.1 -1.0 . . . . 0.0 109.977 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.2 m -119.71 139.17 52.69 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.596 ' O ' ' CG ' ' A' ' 33' ' ' HIS . 19.2 t -65.46 -42.72 94.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 109.593 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -57.25 143.37 39.7 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.226 -0.921 . . . . 0.0 109.373 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -83.92 138.13 33.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.311 -0.868 . . . . 0.0 109.191 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.9 25.62 52.12 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.55 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . -63.51 161.88 34.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.65 -17.56 42.94 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 123.148 2.565 . . . . 0.0 113.038 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 24' ' ' GLY . 72.5 m-70 58.59 48.74 11.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 109.226 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -54.67 -46.38 74.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.001 -1.062 . . . . 0.0 110.092 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -72.53 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.054 -1.029 . . . . 0.0 109.714 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.16 170.02 18.94 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -45.51 149.1 1.89 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.032 1.822 . . . . 0.0 110.792 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.543 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 11.5 m120 -94.09 130.05 40.4 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.074 -1.017 . . . . 0.0 109.761 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.063 HD11 HD13 ' A' ' 35' ' ' ILE . 6.9 tp -76.3 -145.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.404 0.621 . . . . 0.0 110.507 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.596 ' CG ' ' O ' ' A' ' 20' ' ' VAL . 2.1 t-80 85.03 103.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.793 -0.567 . . . . 0.0 111.193 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.72 10.24 50.53 Favored Glycine 0 N--CA 1.494 2.543 0 C-N-CA 120.1 -1.048 . . . . 0.0 112.143 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 1.063 HD13 HD11 ' A' ' 32' ' ' LEU . 42.9 pt -85.85 -16.4 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.329 -1.689 . . . . 0.0 110.896 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.665 ' CE2' ' SD ' ' A' ' 64' ' ' MET . 28.2 m-85 -54.99 -29.77 57.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.065 -1.022 . . . . 0.0 110.117 -179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -108.13 23.83 24.34 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.4 mmt-85 -132.11 174.61 10.02 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -1.229 . . . . 0.0 109.868 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -89.74 162.57 15.49 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.482 -0.761 . . . . 0.0 109.817 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.521 ' HG ' ' HZ2' ' A' ' 59' ' ' TRP . 0.2 OUTLIER -62.51 126.27 26.77 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.578 -0.702 . . . . 0.0 110.158 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.2 9.78 56.63 Favored Glycine 0 N--CA 1.484 1.856 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.452 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -103.3 118.7 37.36 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.885 -1.362 . . . . 0.0 110.149 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.726 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . . . -148.26 136.13 20.92 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.5 -0.75 . . . . 0.0 109.229 179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -82.76 -38.53 23.09 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.298 -0.876 . . . . 0.0 108.718 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.511 ' CA ' ' HE2' ' A' ' 26' ' ' HIS . . . -64.63 -55.41 22.97 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.708 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 5.4 t80 -145.27 138.33 26.35 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.131 -1.217 . . . . 0.0 110.781 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.588 ' O ' ' CZ ' ' A' ' 46' ' ' TYR . 49.8 m -71.28 137.08 48.27 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.726 ' CE1' ' HB2' ' A' ' 43' ' ' ALA . 81.9 m-85 -66.11 -172.17 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.516 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.0 m -70.35 145.22 51.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.477 -0.764 . . . . 0.0 109.634 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -51.8 -37.38 51.32 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.261 -0.9 . . . . 0.0 110.123 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.89 -57.35 12.09 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.003 -1.06 . . . . 0.0 109.29 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -58.01 -42.65 85.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.94 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.413 -0.805 . . . . 0.0 109.717 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.04 -43.15 73.49 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.126 -0.984 . . . . 0.0 108.59 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -105.23 118.41 36.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.579 ' OD1' ' N ' ' A' ' 56' ' ' ASN . 0.0 OUTLIER -122.33 124.35 43.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.295 -0.878 . . . . 0.0 109.746 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.509 HG11 ' OH ' ' A' ' 74' ' ' TYR . 40.6 t -126.03 137.09 58.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.594 -0.691 . . . . 0.0 109.637 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 68.6 tp -54.85 146.5 17.24 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.093 -1.004 . . . . 0.0 108.423 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.521 ' HZ2' ' HG ' ' A' ' 40' ' ' SER . 27.8 m95 -100.52 143.03 31.19 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.868 0.842 . . . . 0.0 111.087 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.487 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 54.0 t0 -143.97 155.96 44.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 52.9 mp0 -55.69 -38.53 69.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.836 -1.165 . . . . 0.0 109.187 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -72.96 -43.19 62.56 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -65.44 -41.36 93.57 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.283 -0.886 . . . . 0.0 110.186 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.665 ' SD ' ' CE2' ' A' ' 36' ' ' PHE . 69.3 mtp -61.66 -36.62 81.36 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 110.002 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.5 m -53.9 -40.51 66.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.899 -1.125 . . . . 0.0 109.43 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.76 -41.0 99.01 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.103 -0.998 . . . . 0.0 109.055 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.524 ' O ' ' O ' ' A' ' 70' ' ' ASN . 69.9 t80 -67.28 -42.82 83.19 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.214 -0.929 . . . . 0.0 109.943 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.528 ' CD1' HD23 ' A' ' 94' ' ' LEU . 2.7 mm? -44.83 -38.69 4.73 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.202 -0.937 . . . . 0.0 109.382 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 24.3 m -51.75 -38.74 56.65 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.376 -0.827 . . . . 0.0 110.364 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.74 HD22 ' H ' ' A' ' 73' ' ' LYS . 29.4 t30 -143.37 173.73 11.35 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.887 -1.133 . . . . 0.0 110.573 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 82' ' ' PHE . 0.1 OUTLIER -95.62 -16.9 21.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.062 -1.024 . . . . 0.0 110.237 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.583 ' H ' ' ND2' ' A' ' 70' ' ' ASN . . . -146.94 2.75 0.8 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.825 -1.172 . . . . 0.0 111.42 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.74 ' H ' HD22 ' A' ' 70' ' ' ASN . 87.0 tttt -57.06 -43.95 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.557 -1.339 . . . . 0.0 109.178 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.509 ' OH ' HG11 ' A' ' 57' ' ' VAL . 63.2 t80 -65.35 -37.63 87.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.27 -0.894 . . . . 0.0 109.223 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.38 83.73 27.05 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.604 -0.685 . . . . 0.0 109.452 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -55.04 140.76 80.17 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.317 2.012 . . . . 0.0 111.721 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.81 1.85 72.97 Favored Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.525 ' CG2' ' N ' ' A' ' 79' ' ' LYS . 2.4 m -89.24 163.87 15.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.362 -1.081 . . . . 0.0 109.281 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.525 ' N ' ' CG2' ' A' ' 78' ' ' THR . 21.7 mttm -74.99 147.61 40.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.855 . . . . 0.0 110.46 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 70.4 mtm -132.15 155.36 48.31 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.441 -0.787 . . . . 0.0 108.914 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -175.43 22.0 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.866 -1.146 . . . . 0.0 110.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.501 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 72.7 t80 -112.07 145.43 39.74 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.117 -0.989 . . . . 0.0 109.548 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.07 -55.65 29.48 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.501 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 136.83 123.84 2.28 Favored Glycine 0 N--CA 1.495 2.577 0 O-C-N 121.164 -1.198 . . . . 0.0 110.24 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.53 68.07 10.31 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.389 -1.065 . . . . 0.0 108.811 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -56.92 -34.07 67.59 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.455 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 mttm -75.31 124.45 27.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.28 -0.887 . . . . 0.0 109.158 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.424 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.4 mt-10 -63.72 -30.73 71.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.314 -0.866 . . . . 0.0 109.564 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -58.08 -42.17 84.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.39 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -63.03 -53.02 60.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.152 -0.967 . . . . 0.0 109.663 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.58 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 77.8 mtm180 -58.76 -40.06 82.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.257 -0.902 . . . . 0.0 110.392 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -70.0 -56.32 7.28 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.746 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -62.39 -38.81 91.05 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.222 -0.924 . . . . 0.0 109.508 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.736 HD21 HMB1 ' A' ' 104' ' ' HEC . 13.3 tp -51.57 -57.85 7.96 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.005 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.502 HD11 ' HG ' ' A' ' 68' ' ' LEU . 92.1 mt -65.3 -30.83 51.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 121.623 -0.673 . . . . 0.0 110.327 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 3' ' ' ALA . 25.8 m -51.67 -42.69 62.32 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.057 -1.027 . . . . 0.0 108.893 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 83.7 t80 -72.05 -44.15 63.8 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.407 -0.808 . . . . 0.0 109.622 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.8 -46.57 90.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.347 -0.846 . . . . 0.0 109.714 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 103' ' ' GLU . 62.3 tttm -61.37 -38.68 87.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -0.849 . . . . 0.0 109.344 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -58.96 -42.05 88.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.352 -0.842 . . . . 0.0 109.134 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.5 57.25 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 32.3 m -63.07 -30.88 71.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 99' ' ' LYS . 84.2 tt0 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.446 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.736 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -61.66 -33.45 73.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.275 -0.89 . . . . 0.0 109.434 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -136.64 160.76 37.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.916 . . . . 0.0 109.506 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -75.94 133.96 40.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.13 -167.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.415 -0.803 . . . . 0.0 109.596 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -150.18 -74.97 0.01 OUTLIER Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.97 111.38 5.43 Favored 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.204 -1.174 . . . . 0.0 109.115 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.867 ' HB2' HG22 ' A' ' 96' ' ' THR . . . -64.67 -22.55 67.01 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.25 -0.906 . . . . 0.0 109.254 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mtmt -56.24 -49.1 75.11 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.82 . . . . 0.0 109.478 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -66.11 -41.99 89.82 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.243 -0.911 . . . . 0.0 109.501 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.36 -35.54 92.2 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.4 90.73 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.214 -1.168 . . . . 0.0 109.6 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 12' ' ' THR . 37.2 p -76.22 -29.77 57.71 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.31 -0.869 . . . . 0.0 109.854 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.481 HD11 ' CZ ' ' A' ' 13' ' ' ARG . 34.9 tp -57.6 -44.23 85.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.074 -1.016 . . . . 0.0 108.927 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.62 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 25.1 t80 -65.02 -43.06 93.7 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -63.7 -33.8 76.44 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.604 -0.685 . . . . 0.0 111.457 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 8' ' ' THR . 6.2 t -98.39 6.41 47.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.913 -1.117 . . . . 0.0 111.59 -177.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HG3' HG23 ' A' ' 12' ' ' THR . 88.2 mtt180 -137.46 -63.93 0.57 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.744 -1.222 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' O ' ' N ' ' A' ' 18' ' ' HIS . 1.8 m -70.26 -29.17 65.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.922 -1.111 . . . . 0.0 110.51 -178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.0 tp -54.89 -36.03 64.72 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.974 -1.079 . . . . 0.0 110.008 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -57.68 -37.66 73.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.214 -0.929 . . . . 0.0 110.474 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.81 -42.99 3.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.185 -0.947 . . . . 0.0 110.865 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 30' ' ' PRO . 97.9 m-70 -100.09 153.35 19.3 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.936 -1.103 . . . . 0.0 110.957 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.27 109.16 8.12 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.62 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 21.0 m -65.68 -18.02 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.969 -1.082 . . . . 0.0 109.247 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -53.96 150.3 8.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 0.0 109.335 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -67.2 143.78 56.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.351 -0.843 . . . . 0.0 109.581 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.69 -29.05 11.43 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.587 ' O ' ' CD2' ' A' ' 26' ' ' HIS . . . 46.66 67.15 1.5 Allowed Glycine 0 N--CA 1.489 2.231 0 O-C-N 121.228 -1.16 . . . . 0.0 110.232 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -53.92 -24.9 33.46 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 121.999 1.799 . . . . 0.0 111.966 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.614 ' NE2' ' N ' ' A' ' 46' ' ' TYR . 30.5 m-70 58.1 54.95 5.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 109.815 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -51.15 -42.06 60.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.066 -1.021 . . . . 0.0 108.902 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 t -125.29 -58.46 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.397 -0.814 . . . . 0.0 109.424 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.46 168.75 16.53 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 5.7 Cg_exo -45.27 150.62 1.11 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.961 2.441 . . . . 0.0 112.037 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.595 ' H ' ' CE1' ' A' ' 26' ' ' HIS . 4.6 m120 -112.88 124.06 51.74 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.518 -0.739 . . . . 0.0 110.026 -179.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD22 ' ND1' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -94.16 148.74 21.9 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.418 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.03 90.22 0.29 Allowed 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.38 4.36 58.37 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.5 pp -67.65 -12.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 120.885 -1.362 . . . . 0.0 109.2 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.504 ' O ' ' O ' ' A' ' 59' ' ' TRP . 12.4 m-85 -48.74 -29.47 4.53 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.39 -0.819 . . . . 0.0 109.566 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -111.43 32.79 6.21 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -133.12 168.12 19.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.226 -1.161 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -88.23 149.39 23.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.59 -0.694 . . . . 0.0 109.202 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.412 ' HB2' ' H ' ' A' ' 57' ' ' VAL . 1.0 OUTLIER -55.88 139.42 45.96 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.31 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.23 -13.05 52.02 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -101.83 119.44 38.79 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.231 -1.158 . . . . 0.0 109.336 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 46' ' ' TYR . . . -128.75 154.65 46.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.488 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -81.03 -37.87 28.39 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.463 -0.773 . . . . 0.0 109.187 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.64 -72.56 1.03 Allowed Glycine 0 N--CA 1.486 1.967 0 N-CA-C 109.936 -1.265 . . . . 0.0 109.936 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.614 ' N ' ' NE2' ' A' ' 26' ' ' HIS . 5.5 t80 -116.78 127.85 54.74 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.416 -1.049 . . . . 0.0 111.052 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.565 ' O ' ' CE1' ' A' ' 46' ' ' TYR . 53.6 p -67.66 154.33 41.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' ' O1A' ' A' ' 104' ' ' HEC . 65.0 m-85 -62.26 -175.13 0.07 Allowed 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.619 0.724 . . . . 0.0 110.626 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.4 m -71.99 149.25 45.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 109.507 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -48.74 -37.89 20.12 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.162 -0.961 . . . . 0.0 110.08 -179.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.61 -55.89 20.16 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.954 -1.091 . . . . 0.0 109.152 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.521 ' ND2' ' CD2' ' A' ' 48' ' ' TYR . 29.1 t-20 -58.69 -42.52 88.77 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.395 -0.815 . . . . 0.0 109.257 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 48' ' ' TYR . 97.6 mt -60.5 -34.86 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -54.98 -42.14 72.05 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 52' ' ' ASN . 33.1 mmtp -92.13 128.02 37.82 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.497 ' O ' ' OD1' ' A' ' 56' ' ' ASN . 32.5 p-10 -134.33 128.49 33.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.213 -0.929 . . . . 0.0 110.284 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.412 ' H ' ' HB2' ' A' ' 40' ' ' SER . 65.0 t -139.57 138.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.39 -0.819 . . . . 0.0 110.056 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.5 tp -55.14 143.95 25.67 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.222 -0.924 . . . . 0.0 108.963 179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.591 ' CE2' ' O2A' ' A' ' 104' ' ' HEC . 30.5 m95 -101.35 146.9 26.96 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.853 -0.739 . . . . 0.0 110.002 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.49 ' OD1' ' OE1' ' A' ' 61' ' ' GLU . 45.7 t0 -150.67 161.64 42.21 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 48.3 mp0 -56.7 -39.31 73.63 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.893 -1.129 . . . . 0.0 109.288 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.404 ' N ' HD22 ' A' ' 62' ' ' ASN . 2.9 m120 -75.72 -42.63 50.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.34 -0.85 . . . . 0.0 109.761 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -63.33 -43.19 98.46 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.486 ' SD ' ' CZ ' ' A' ' 36' ' ' PHE . 63.0 mtp -62.0 -34.6 76.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.216 -0.927 . . . . 0.0 110.037 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.545 ' HA ' HD11 ' A' ' 95' ' ' ILE . 86.8 p -56.53 -36.11 68.85 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.003 -1.061 . . . . 0.0 108.9 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.06 -39.15 89.87 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.225 -0.922 . . . . 0.0 108.793 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.593 ' CZ ' ' O ' ' A' ' 71' ' ' HIS . 57.6 t80 -64.7 -43.17 94.34 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 109.68 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 85' ' ' LEU . 85.6 mt -53.03 -34.6 57.16 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.987 -1.071 . . . . 0.0 109.587 -179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.581 ' OG1' ' NH1' ' A' ' 91' ' ' ARG . 26.2 m -53.97 -43.33 69.83 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.04 -1.037 . . . . 0.0 108.914 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.757 HD22 ' N ' ' A' ' 73' ' ' LYS . 12.2 t30 -143.95 140.98 29.97 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.593 ' O ' ' CZ ' ' A' ' 67' ' ' TYR . 0.1 OUTLIER -64.11 -23.82 67.46 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.186 -0.946 . . . . 0.0 111.611 -178.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.0 21.92 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.091 -1.63 . . . . 0.0 112.089 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.757 ' N ' HD22 ' A' ' 70' ' ' ASN . 17.7 ttpt -61.99 -42.13 98.79 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.603 -1.311 . . . . 0.0 109.183 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -23.07 35.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.39 -0.819 . . . . 0.0 109.544 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mm -123.05 78.3 51.25 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.513 -0.742 . . . . 0.0 109.478 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -50.58 -35.77 47.66 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.071 1.847 . . . . 0.0 111.704 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.28 62.36 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 108.092 -2.003 . . . . 0.0 108.092 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.446 HG23 HAD2 ' A' ' 104' ' ' HEC . 86.8 m -77.11 142.2 39.85 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.588 -0.948 . . . . 0.0 109.864 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -77.37 175.06 10.12 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.571 0.7 . . . . 0.0 110.275 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 60.1 ttp -134.03 149.83 51.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.574 -0.704 . . . . 0.0 109.265 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -177.12 25.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.987 -1.07 . . . . 0.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 84' ' ' GLY . 73.0 t80 -109.73 148.07 32.07 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.544 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.31 -49.86 69.3 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.438 ' N ' ' CD2' ' A' ' 82' ' ' PHE . . . 152.84 93.56 0.1 OUTLIER Glycine 0 N--CA 1.494 2.558 0 O-C-N 120.939 -1.33 . . . . 0.0 110.306 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.748 HD21 HD12 ' A' ' 94' ' ' LEU . 8.6 tp -80.98 26.42 0.42 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.314 -1.109 . . . . 0.0 108.948 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 mttp -54.52 -30.26 53.15 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.437 -0.79 . . . . 0.0 109.821 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -57.5 123.89 17.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.118 -0.989 . . . . 0.0 109.251 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HG2' HH21 ' A' ' 91' ' ' ARG . 96.6 mt-10 -64.45 -33.34 75.64 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.406 -0.809 . . . . 0.0 109.991 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.07 -45.25 91.29 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.178 -0.951 . . . . 0.0 110.426 -179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.484 ' HB3' HD11 ' A' ' 85' ' ' LEU . 81.5 m-20 -66.56 -49.37 66.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.09 -1.006 . . . . 0.0 109.689 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.581 ' NH1' ' OG1' ' A' ' 69' ' ' THR . 57.7 mtm180 -60.0 -43.39 95.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.358 -0.839 . . . . 0.0 110.216 -179.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.472 ' O ' ' OG1' ' A' ' 96' ' ' THR . 79.0 m-20 -66.61 -44.72 81.33 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.126 -0.983 . . . . 0.0 110.303 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -64.91 -41.11 95.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 0.0 109.98 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.748 HD12 HD21 ' A' ' 85' ' ' LEU . 1.5 mt -55.92 -63.87 1.04 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.238 -0.914 . . . . 0.0 110.355 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.545 HD11 ' HA ' ' A' ' 65' ' ' SER . 29.1 mt -53.69 -36.18 28.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 O-C-N 121.603 -0.685 . . . . 0.0 109.864 -178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.867 HG22 ' HB2' ' A' ' 3' ' ' ALA . 17.7 m -55.96 -38.59 70.58 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 108.531 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.73 -49.2 9.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 110.032 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 42.7 mt -55.03 -48.19 73.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.238 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 103' ' ' GLU . 21.7 tttp -61.24 -40.08 92.7 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.463 -0.773 . . . . 0.0 109.293 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.69 -43.67 93.94 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.371 -0.831 . . . . 0.0 109.056 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.88 -48.07 60.14 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.7 m -61.67 -31.23 71.34 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 99' ' ' LYS . 49.1 tp10 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.501 -0.749 . . . . 0.0 109.37 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' HEC . . . . . 0.667 HBB3 HMB1 ' A' ' 104' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_