data_2odg_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 2odg _Structure_validation_residue.Date_analyzed 2016-10-08 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 full ' A' A ' 1' ' ' MET . . . . . 0.61 ' O ' ' N ' ' A' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 106.833 -1.543 . . . . 0.16 106.833 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.474 ' H ' ' HG1' ' A' ' 2' ' ' THR . 2.8 p -56.32 61.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.609 -0.723 . . . . 0.16 111.348 -178.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.61 ' N ' ' O ' ' A' ' 1' ' ' MET . 72.6 p -72.5 152.09 42.11 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 108.277 -1.009 . . . . 0.13 108.277 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -71.2 164.44 25.65 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.065 -1.022 . . . . 0.11 109.797 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -51.79 -20.95 2.44 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.666 . . . . 0.14000000000000001 109.663 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -61.61 -37.26 83.3 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.332 -0.855 . . . . 0.089999999999999997 109.897 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.95 -50.09 75.13 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.947 -1.096 . . . . 0.12 110.029 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -69.97 -36.8 75.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.974 -1.078 . . . . 0.14999999999999999 110.178 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.42 -37.39 80.25 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.833 -0.803 . . . . 0.11 108.833 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -64.74 -49.61 70.13 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.515 -0.741 . . . . 0.089999999999999997 110.14 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -83.33 8.75 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.099 -1.001 . . . . 0.11 110.678 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -104.48 -13.45 16.04 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.214 -0.929 . . . . 0.12 110.145 179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -154.86 152.09 24.75 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.13 -0.981 . . . . 0.11 108.861 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -39.99 159.98 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.919 1.746 . . . . 0.10000000000000001 112.087 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.414 ' SD ' ' CD1' ' B' ' 89' ' ' LEU . 3.2 ptp -89.19 -28.09 20.23 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.188 -0.945 . . . . 0.059999999999999998 109.769 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.08 -141.06 43.97 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 108.762 -1.735 . . . . 0.070000000000000007 108.762 -178.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -108.14 33.6 4.04 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.301 -1.117 . . . . 0.080000000000000002 109.782 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -59.94 148.97 75.43 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.418 -0.801 . . . . 0.080000000000000002 109.57 -178.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -62.83 152.13 80.42 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.747 2.298 . . . . 0.059999999999999998 112.868 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.464 ' C ' ' H ' ' A' ' 22' ' ' SER . 7.7 p -53.67 -43.02 53.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 CA-C-O 121.401 0.62 . . . . 0.070000000000000007 110.22 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.51 -3.9 1.16 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 110.375 -1.09 . . . . 0.059999999999999998 110.375 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.464 ' H ' ' C ' ' A' ' 20' ' ' VAL . 42.1 t -84.08 -22.61 31.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.94 -1.329 . . . . 0.059999999999999998 110.132 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -64.02 138.52 58.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.006 -1.059 . . . . 0.059999999999999998 109.883 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.64 134.41 54.23 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.718 0.771 . . . . 0.089999999999999997 109.683 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.68 -20.78 49.29 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.337 -1.505 . . . . 0.089999999999999997 109.337 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.415 ' CD1' ' SG ' ' A' ' 77' ' ' CYS . 36.5 mm -98.54 112.3 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.306 -1.114 . . . . 0.089999999999999997 108.106 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -90.04 177.31 42.92 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.857 -1.297 . . . . 0.080000000000000002 109.857 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -58.63 -39.92 81.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.471 -1.017 . . . . 0.080000000000000002 109.974 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 72.6 t -65.21 -46.66 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.006 -1.059 . . . . 0.11 108.855 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.88 -39.8 83.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.852 . . . . 0.11 109.897 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.28 -33.89 77.64 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.882 -1.687 . . . . 0.080000000000000002 108.882 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -40.4 87.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.472 -1.017 . . . . 0.11 110.335 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.41 -44.61 74.64 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.993 -1.067 . . . . 0.14000000000000001 109.077 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.47 -39.37 93.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.884 -1.135 . . . . 0.10000000000000001 108.036 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -60.0 -42.21 93.75 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.538 -0.726 . . . . 0.11 109.274 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -68.1 -18.66 64.71 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.344 -0.984 . . . . 2.46 108.344 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.82 3.19 53.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.73 -0.606 . . . . 3.3799999999999999 109.787 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.05 7.55 49.79 Favored Glycine 0 N--CA 1.502 3.083 0 O-C-N 121.024 -1.048 . . . . 0.11 111.346 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -106.39 74.29 1.02 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.89 -1.359 . . . . 0.16 109.064 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -80.24 -10.02 59.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.289 -0.882 . . . . 0.089999999999999997 110.629 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -129.26 152.33 48.95 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.172 -0.955 . . . . 0.080000000000000002 109.192 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.98 94.46 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.292 -0.88 . . . . 0.050000000000000003 110.791 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 43' ' ' TYR . 7.0 p90 -60.64 -17.85 49.75 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 120.943 -1.098 . . . . 0.070000000000000007 110.975 -178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.8 t -78.95 -32.77 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 N-CA-C 107.29 -1.374 . . . . 0.080000000000000002 107.29 178.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 64.4 t -75.88 -39.86 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.565 -0.902 . . . . 0.080000000000000002 108.565 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -59.88 -35.16 74.24 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 107.046 -1.464 . . . . 0.070000000000000007 107.046 178.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.95 -40.76 95.78 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.614 -1.394 . . . . 0.080000000000000002 109.614 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -59.93 -42.48 94.06 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.265 -1.138 . . . . 2.4300000000000002 108.636 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -60.07 -39.98 87.91 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.11 109.557 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.5 mt -69.47 -37.77 77.43 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 119.62 -0.832 . . . . 1.03 108.982 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.48 -28.61 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.264 -0.897 . . . . 1.0600000000000001 109.805 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -87.27 13.19 10.14 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.054 -1.029 . . . . 1.05 110.581 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 49.93 38.95 17.48 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 120.565 -1.335 . . . . 2.1499999999999999 110.42 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.7 mttm 56.87 19.43 4.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.143 -0.973 . . . . 0.14000000000000001 110.092 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.465 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 4.1 t0 -66.22 106.72 1.74 Allowed 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 117.766 -1.573 . . . . 0.80000000000000004 106.994 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.05 -40.14 88.37 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.694 -0.629 . . . . 0.16 111.273 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -69.68 -40.02 76.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.287 -1.508 . . . . 0.19 110.006 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.62 -40.0 73.41 Favored 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 118.53 -1.268 . . . . 1.05 109.178 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -62.87 -49.93 72.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.14000000000000001 110.524 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -63.25 -41.09 99.02 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.051 -1.06 . . . . 0.17999999999999999 109.907 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' OE1' ' NZ ' ' C' ' 37' ' ' LYS . 22.0 mt-10 -65.32 -40.09 93.27 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.649 -1.282 . . . . 2.3900000000000001 108.122 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.459 ' O ' ' OG1' ' A' ' 66' ' ' THR . 92.1 t90 -64.54 -49.98 69.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.083 -1.011 . . . . 0.60999999999999999 111.239 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 42.2 tp -64.87 -46.14 83.04 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.119 -0.988 . . . . 0.13 109.644 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.28 -49.75 72.85 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.521 -0.737 . . . . 0.17999999999999999 109.944 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 1.7 t0 -66.66 -30.57 70.86 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.492 -0.755 . . . . 1.71 109.642 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 62' ' ' TRP . 86.8 m -78.34 -37.66 43.96 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.211 -0.931 . . . . 0.14000000000000001 111.062 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.0 p -127.26 -26.95 3.0 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.548 -1.345 . . . . 0.13 112.243 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.73 13.7 27.08 Favored Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.226 -1.55 . . . . 0.14999999999999999 109.226 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.05 155.53 1.23 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.013 -1.287 . . . . 0.14000000000000001 108.926 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -88.69 166.36 14.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.211 -0.93 . . . . 0.14999999999999999 109.6 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.0 -32.97 62.2 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.332 -0.988 . . . . 0.17000000000000001 108.332 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -70.06 -48.98 55.57 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-O 121.358 0.599 . . . . 0.14999999999999999 112.036 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.9 -29.99 69.22 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.042 -1.036 . . . . 0.13 110.856 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 86.9 p -70.06 -34.67 73.51 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.979 -1.088 . . . . 0.14000000000000001 109.251 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -60.29 -38.86 84.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.846 -1.159 . . . . 0.19 109.31 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -66.91 -38.75 86.8 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 120.884 -1.135 . . . . 0.12 109.565 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.415 ' SG ' ' CD1' ' A' ' 26' ' ' ILE . 93.7 m -69.9 -40.07 75.83 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.992 -1.068 . . . . 0.10000000000000001 109.719 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.78 -61.14 2.84 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.746 -1.221 . . . . 0.14000000000000001 109.79 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.88 88.44 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.472 -1.051 . . . . 0.12 110.472 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.3 t -69.4 -48.34 61.39 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 120.7 -1.471 . . . . 0.10000000000000001 109.952 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.0 mt -70.13 -40.05 75.06 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.899 -1.126 . . . . 0.089999999999999997 108.822 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -65.56 -40.11 92.43 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.394 -0.816 . . . . 0.14999999999999999 111.015 -178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -70.03 -35.41 74.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.733 -1.23 . . . . 0.14000000000000001 109.281 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.528 ' NE1' ' CD2' ' A' ' 88' ' ' PHE . 87.2 t90 -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.01 -1.478 . . . . 0.089999999999999997 107.01 178.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 89' ' ' LEU . 51.6 m -61.43 -40.18 93.51 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.609 0.719 . . . . 0.089999999999999997 109.902 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.98 -34.44 73.3 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.935 -1.103 . . . . 0.12 110.291 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -93.31 -32.03 14.46 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.109 -0.994 . . . . 0.11 110.305 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.528 ' CD2' ' NE1' ' A' ' 84' ' ' TRP . 66.3 m-85 -110.37 -3.08 16.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.496 -0.753 . . . . 0.089999999999999997 112.611 -176.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.547 ' N ' ' O ' ' A' ' 85' ' ' CYS . 18.4 tp . . . . . 0 N--CA 1.503 2.212 0 O-C-N 120.727 -1.233 . . . . 0.089999999999999997 109.728 -177.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.634 ' O ' ' N ' ' B' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 106.879 -1.526 . . . . 0.11 106.879 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -55.98 61.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.529 -0.759 . . . . 0.10000000000000001 111.381 -178.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' THR . . . . . 0.634 ' N ' ' O ' ' B' ' 1' ' ' MET . 72.6 p -72.72 152.11 41.82 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.31 -0.996 . . . . 0.080000000000000002 108.31 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 4.1 t -71.21 164.39 25.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.991 . . . . 0.070000000000000007 109.708 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -51.7 -21.16 2.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.10000000000000001 109.676 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -61.3 -37.33 82.82 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.27 -0.894 . . . . 0.080000000000000002 109.878 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -60.03 -49.93 75.74 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.048 -1.033 . . . . 0.070000000000000007 110.072 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -70.09 -36.85 75.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.039 . . . . 0.10000000000000001 110.217 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.07 -38.78 82.78 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.74 -0.837 . . . . 0.080000000000000002 108.74 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.68 -49.96 71.11 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.561 -0.712 . . . . 0.059999999999999998 110.09 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.9 10.47 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.146 -0.971 . . . . 0.080000000000000002 110.685 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.66 -14.97 14.88 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.118 -0.989 . . . . 0.10000000000000001 110.182 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.5 151.24 25.05 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.173 -0.955 . . . . 0.10000000000000001 108.74 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -39.99 160.04 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 121.941 1.761 . . . . 0.10000000000000001 112.091 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 3.8 ptp -89.06 -26.52 21.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.273 -0.892 . . . . 0.080000000000000002 109.441 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.53 -138.25 46.71 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 108.712 -1.755 . . . . 0.10000000000000001 108.712 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -110.6 35.45 3.47 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.332 -1.099 . . . . 0.13 109.632 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -61.73 149.72 84.07 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.358 -0.839 . . . . 0.10000000000000001 109.805 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.58 152.21 78.97 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.714 2.276 . . . . 0.11 112.736 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.441 ' C ' ' H ' ' B' ' 22' ' ' SER . 7.5 p -53.88 -42.64 54.14 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 O-C-N 121.616 -0.678 . . . . 0.11 110.342 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.57 -3.29 1.44 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.531 -1.027 . . . . 0.10000000000000001 110.531 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' SER . . . . . 0.441 ' H ' ' C ' ' B' ' 20' ' ' VAL . 45.5 t -83.3 -22.64 32.9 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.894 -1.356 . . . . 0.080000000000000002 110.025 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.3 138.97 58.7 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.011 -1.055 . . . . 0.070000000000000007 109.807 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.18 135.61 55.67 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.865 -0.734 . . . . 0.059999999999999998 109.663 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -21.79 44.25 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.333 -1.507 . . . . 0.080000000000000002 109.333 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . 0.416 ' CD1' ' SG ' ' B' ' 77' ' ' CYS . 36.2 mm -98.51 113.67 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 N-CA-C 107.844 -1.169 . . . . 0.089999999999999997 107.844 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.73 179.34 39.96 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.779 -1.328 . . . . 0.10000000000000001 109.779 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -58.71 -40.03 82.5 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.498 -1.001 . . . . 0.12 110.18 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.78 -45.77 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 120.99 -1.069 . . . . 0.14000000000000001 109.042 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 86.4 mt -68.81 -39.9 79.83 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.13 109.889 -179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.59 75.49 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 108.876 -1.69 . . . . 0.12 108.876 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.06 -39.99 86.99 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.61 -0.935 . . . . 0.17000000000000001 110.241 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -68.85 -44.73 72.78 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 120.902 -1.124 . . . . 0.17000000000000001 109.097 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.9 mt -62.45 -39.51 93.6 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.98 -1.118 . . . . 0.14000000000000001 107.98 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -60.02 -41.88 93.15 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.573 -0.704 . . . . 0.14999999999999999 109.295 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.45 -18.39 64.41 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.498 -0.927 . . . . 2.5699999999999998 108.498 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . 0.596 ' NH1' ' OD2' ' C' ' 9' ' ' ASP . 21.0 mmt180 -89.9 1.61 56.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.664 -0.648 . . . . 2.8300000000000001 109.768 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.49 8.44 43.46 Favored Glycine 0 N--CA 1.502 3.047 0 O-C-N 121.138 -0.977 . . . . 0.14999999999999999 111.28 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -107.2 74.16 0.96 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.884 -1.362 . . . . 0.29999999999999999 108.947 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 p-10 -80.03 -10.42 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.355 -0.841 . . . . 0.14000000000000001 110.768 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -129.26 150.72 50.51 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.174 -0.954 . . . . 0.14000000000000001 109.103 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.88 -43.23 99.34 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.195 -0.941 . . . . 0.089999999999999997 110.747 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' TYR . . . . . 0.466 ' C ' ' CD1' ' B' ' 43' ' ' TYR . 6.2 p90 -57.0 -18.28 13.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.902 -1.124 . . . . 0.12 110.75 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 41.6 t -78.44 -33.97 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 N-CA-C 107.286 -1.375 . . . . 0.11 107.286 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 64.1 t -75.37 -39.62 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 108.727 -0.842 . . . . 0.10000000000000001 108.727 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.84 -34.3 72.92 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.837 -1.542 . . . . 0.070000000000000007 106.837 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.7 96.34 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 109.535 -1.426 . . . . 0.070000000000000007 109.535 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' GLN . . . . . 0.485 ' CB ' ' CH2' ' B' ' 62' ' ' TRP . 34.5 mm-40 -59.99 -42.69 94.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.224 -1.162 . . . . 2.1000000000000001 108.916 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.96 -40.25 88.39 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.446 -0.784 . . . . 0.070000000000000007 109.672 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 83.1 mt -69.13 -38.13 78.68 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.878 -0.786 . . . . 1.02 108.878 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 52.9 t -66.05 -29.27 46.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.3 -0.875 . . . . 1.02 109.702 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.3 mt -87.13 14.52 7.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.981 -1.075 . . . . 1.03 110.707 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 49.98 35.51 9.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.555 -1.341 . . . . 2.3300000000000001 110.916 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 20.1 mttm 60.03 19.88 9.03 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.229 -0.919 . . . . 0.089999999999999997 109.875 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ASP . . . . . 0.495 ' C ' ' OD1' ' B' ' 55' ' ' ASP . 2.7 t0 -66.9 108.97 2.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 106.644 -1.613 . . . . 0.66000000000000003 106.644 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.79 -40.05 93.83 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.392 -0.818 . . . . 0.12 111.237 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -69.28 -40.1 77.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.356 -1.465 . . . . 0.14999999999999999 109.983 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.68 -38.85 73.78 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 118.922 -1.111 . . . . 1.0600000000000001 109.2 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -64.52 -50.0 69.07 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.857 . . . . 0.11 110.441 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -63.11 -41.63 99.39 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.031 -1.043 . . . . 0.14999999999999999 109.865 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -65.09 -40.21 94.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.656 -1.277 . . . . 2.5699999999999998 108.04 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' TRP . . . . . 0.485 ' CH2' ' CB ' ' B' ' 48' ' ' GLN . 31.7 t90 -64.26 -49.09 73.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 0.96999999999999997 111.166 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.449 HD23 ' CE3' ' B' ' 62' ' ' TRP . 0.2 OUTLIER -66.03 -48.34 71.44 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 120.941 -1.099 . . . . 0.13 109.739 -179.228 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.88 -49.8 76.0 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.524 -0.735 . . . . 0.17000000000000001 110.173 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -67.58 -28.16 67.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.494 -0.754 . . . . 1.75 109.826 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' B' ' 62' ' ' TRP . 91.3 m -80.85 -33.66 34.35 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.338 -0.851 . . . . 0.16 110.916 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 22.4 p -131.08 -28.52 1.93 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.441 -1.412 . . . . 0.14999999999999999 112.222 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.32 13.14 25.4 Favored Glycine 0 N--CA 1.499 2.865 0 N-CA-C 109.182 -1.567 . . . . 0.14999999999999999 109.182 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.48 154.67 1.75 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.073 -1.251 . . . . 0.14000000000000001 108.731 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -88.51 168.12 12.86 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 120.989 -1.069 . . . . 0.14000000000000001 109.661 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.75 -32.87 63.78 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.318 -0.993 . . . . 0.14000000000000001 108.318 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -69.97 -49.42 51.89 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.377 0.608 . . . . 0.12 112.096 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -67.67 -29.94 69.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.927 -1.108 . . . . 0.11 110.903 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 79.7 p -69.92 -34.64 73.74 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 119.081 -1.048 . . . . 0.12 109.163 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -60.78 -38.83 86.63 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.756 -1.215 . . . . 0.14999999999999999 109.532 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -66.81 -39.16 87.63 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.794 -1.192 . . . . 0.080000000000000002 109.616 -178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' CYS . . . . . 0.416 ' SG ' ' CD1' ' B' ' 26' ' ' ILE . 93.2 m -69.42 -39.96 77.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.052 -1.03 . . . . 0.080000000000000002 109.513 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.0 -60.68 3.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.737 -1.227 . . . . 0.089999999999999997 109.777 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.8 -33.92 88.54 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.546 -1.022 . . . . 0.070000000000000007 110.546 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 40.5 t -69.52 -48.4 60.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.762 -1.434 . . . . 0.059999999999999998 109.916 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.96 -40.05 75.65 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 118.954 -1.098 . . . . 0.059999999999999998 108.53 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -66.83 -40.15 87.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.346 -0.846 . . . . 0.10000000000000001 111.413 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -69.87 -34.91 74.21 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.638 -1.289 . . . . 0.089999999999999997 108.819 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' TRP . . . . . 0.567 ' O ' ' HB2' ' B' ' 88' ' ' PHE . 85.4 t90 -59.41 -48.69 80.67 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 105.679 -1.971 . . . . 0.059999999999999998 105.679 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' CYS . . . . . 0.658 ' O ' ' N ' ' B' ' 89' ' ' LEU . 36.9 m -58.0 -39.96 79.57 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.762 -0.586 . . . . 0.050000000000000003 110.359 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.22 -35.25 76.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.233 -1.542 . . . . 0.080000000000000002 111.187 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -90.06 -25.52 20.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.87 -1.143 . . . . 0.080000000000000002 107.956 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.567 ' HB2' ' O ' ' B' ' 84' ' ' TRP . 60.5 m-85 -115.15 -2.98 12.61 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 114.759 1.392 . . . . 0.080000000000000002 114.759 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.658 ' N ' ' O ' ' B' ' 85' ' ' CYS . 14.5 tp . . . . . 0 C--N 1.282 -2.35 0 O-C-N 119.008 -2.307 . . . . 0.059999999999999998 110.047 -176.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' HIS . . . . . 0.9 ' ND1' ' H3 ' ' C' ' 1' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 121.756 0.788 . . . . 0.28000000000000003 109.261 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.553 ' N ' ' HB3' ' C' ' 5' ' ' ALA . 22.7 m-20 -74.33 146.81 42.79 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.625 -0.88 . . . . 0.25 108.625 177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ASN . . . . . 0.468 ' C ' ' O ' ' C' ' 2' ' ' ASP . 1.3 m-20 -42.2 -52.08 4.5 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.22 108.695 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -74.16 -17.74 60.88 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.212 -0.93 . . . . 0.23000000000000001 109.844 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' ALA . . . . . 0.553 ' HB3' ' N ' ' C' ' 2' ' ' ASP . . . -72.93 -20.87 60.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.709 -1.244 . . . . 0.25 109.933 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -79.78 -8.0 59.0 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.515 -1.366 . . . . 0.23999999999999999 109.571 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.89 141.78 40.41 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 108.609 -0.886 . . . . 0.23999999999999999 108.609 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.4 t -83.46 157.96 22.24 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.332 -0.855 . . . . 0.23999999999999999 109.635 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' ASP . . . . . 0.617 ' N ' ' OD1' ' C' ' 9' ' ' ASP . 0.1 OUTLIER -50.55 -44.83 56.67 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.013 -1.054 . . . . 2.1400000000000001 110.618 -178.918 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -61.59 -43.14 99.42 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.066 -1.022 . . . . 1.0600000000000001 109.788 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' GLU . . . . . 0.5 ' O ' HG21 ' C' ' 14' ' ' THR . 26.6 mt-10 -71.07 -36.17 72.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.197 -0.939 . . . . 0.23000000000000001 109.941 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.44 -43.47 94.18 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 120.08 -1.637 . . . . 0.23999999999999999 109.293 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.3 m -61.24 -44.88 96.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.575 -0.703 . . . . 1.0800000000000001 110.413 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' THR . . . . . 0.5 HG21 ' O ' ' C' ' 11' ' ' GLU . 6.2 t -63.89 -30.79 71.84 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.859 -1.151 . . . . 0.22 109.456 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 56.3 mt -68.55 -45.3 72.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.056 -1.027 . . . . 0.20999999999999999 110.928 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.88 -37.97 84.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 107.854 -1.165 . . . . 0.23999999999999999 107.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -47.4 85.81 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.374 0.607 . . . . 4.0 109.822 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -52.92 -39.85 63.13 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.122 -0.986 . . . . 0.20000000000000001 109.701 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -89.23 3.01 53.43 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.579 -1.248 . . . . 0.20000000000000001 109.805 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 6.3 m120 58.83 46.43 14.02 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.356 -0.84 . . . . 0.22 109.198 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ILE . . . . . . . . . . . . . 53.4 mt -103.43 115.41 63.8 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.23000000000000001 109.036 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -54.65 138.81 76.2 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.115 1.876 . . . . 0.53000000000000003 112.135 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -156.98 162.35 39.59 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.204 -0.998 . . . . 0.26000000000000001 111.235 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.62 -147.72 10.81 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.942 -1.663 . . . . 0.28000000000000003 108.942 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -65.92 137.48 49.12 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.068 1.845 . . . . 0.60999999999999999 111.99 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' VAL . . . . . . . . . . . . . 8.3 p -96.35 119.31 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.167 -0.958 . . . . 1.1100000000000001 109.278 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' VAL . . . . . 0.603 ' O ' ' N ' ' C' ' 31' ' ' ARG . 20.0 t -143.29 148.2 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.473 -0.936 . . . . 1.1100000000000001 108.473 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' C' ' 27' ' ' VAL . . . -43.15 -35.31 2.43 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.915 -1.274 . . . . 0.28999999999999998 109.915 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -35.64 80.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.097 -1.237 . . . . 1.6799999999999999 110.673 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -120.68 2.41 10.62 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.36 -0.838 . . . . 1.0700000000000001 109.371 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' C' ' 27' ' ' VAL . 2.2 ttm180 -59.96 -43.15 95.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.235 -0.915 . . . . 0.28000000000000003 109.104 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -58.43 -45.25 88.87 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.229 -0.988 . . . . 0.28000000000000003 110.002 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 53.0 tp -57.74 -38.44 75.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.315 -0.995 . . . . 1.1399999999999999 108.315 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -68.38 -38.3 81.25 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.283 -0.886 . . . . 0.27000000000000002 110.656 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -63.05 -38.08 89.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.25 109.061 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -68.21 -39.03 82.5 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.253 -0.905 . . . . 2.5299999999999998 109.855 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' LYS . . . . . 0.668 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 14.4 mttt -61.58 -43.55 98.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.386 -0.821 . . . . 2.4199999999999999 110.51 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.94 -36.51 77.35 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 O-C-N 121.025 -1.047 . . . . 0.22 109.086 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -61.87 -45.18 94.88 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.899 -0.721 . . . . 0.20999999999999999 109.577 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -61.79 -42.31 98.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.068 -1.02 . . . . 0.22 110.42 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -68.68 -54.25 17.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.708 -1.245 . . . . 0.20000000000000001 109.475 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -55.7 -33.56 64.29 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 109.205 -0.665 . . . . 0.19 109.205 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -61.55 -44.14 97.59 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.964 -1.085 . . . . 0.19 108.37 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -56.52 -49.84 73.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 118.601 -1.239 . . . . 0.20000000000000001 109.707 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -59.1 -30.58 68.2 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.066 -1.021 . . . . 0.17000000000000001 108.578 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -73.76 -19.67 60.71 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 118.916 -1.114 . . . . 0.17999999999999999 109.382 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 120.919 -1.113 . . . . 0.19 108.958 179.216 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.629 ' O ' ' N ' ' A' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 106.833 -1.543 . . . . 0.16 106.833 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -56.32 61.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.609 -0.723 . . . . 0.14999999999999999 111.348 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.629 ' N ' ' O ' ' A' ' 1' ' ' MET . 72.6 p -72.5 152.09 42.11 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 108.277 -1.009 . . . . 0.13 108.277 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -71.2 164.44 25.65 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.065 -1.022 . . . . 0.11 109.797 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -51.79 -20.95 2.44 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.666 . . . . 0.13 109.663 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -61.61 -37.26 83.3 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.332 -0.855 . . . . 0.089999999999999997 109.897 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.95 -50.09 75.13 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.947 -1.096 . . . . 0.12 110.029 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -69.97 -36.8 75.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.974 -1.078 . . . . 0.14999999999999999 110.178 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.42 -37.39 80.25 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.833 -0.803 . . . . 0.11 108.833 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -64.74 -49.61 70.13 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.515 -0.741 . . . . 0.089999999999999997 110.14 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -83.33 8.75 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.099 -1.001 . . . . 0.11 110.678 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -104.48 -13.45 16.04 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.214 -0.929 . . . . 0.11 110.145 179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -154.86 152.09 24.75 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.13 -0.981 . . . . 0.11 108.861 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -39.99 159.98 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.919 1.746 . . . . 0.089999999999999997 112.087 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.687 ' SD ' HD11 ' B' ' 89' ' ' LEU . 3.2 ptp -89.19 -28.09 20.23 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.188 -0.945 . . . . 0.059999999999999998 109.769 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.08 -141.06 43.97 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 108.762 -1.735 . . . . 0.059999999999999998 108.762 -178.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -108.14 33.6 4.04 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.301 -1.117 . . . . 0.080000000000000002 109.782 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -59.94 148.97 75.43 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.418 -0.801 . . . . 0.080000000000000002 109.57 -178.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -62.83 152.13 80.42 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.747 2.298 . . . . 0.059999999999999998 112.868 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 21' ' ' GLY . 7.7 p -53.67 -43.02 53.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 CA-C-O 121.401 0.62 . . . . 0.059999999999999998 110.22 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.493 ' N ' HG13 ' A' ' 20' ' ' VAL . . . -57.51 -3.9 1.16 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 110.375 -1.09 . . . . 0.059999999999999998 110.375 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' VAL . 42.1 t -84.08 -22.61 31.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.94 -1.329 . . . . 0.059999999999999998 110.132 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.468 HD22 HD21 ' A' ' 81' ' ' LEU . 74.9 mt -64.02 138.52 58.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.006 -1.059 . . . . 0.059999999999999998 109.883 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.64 134.41 54.23 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.718 0.771 . . . . 0.080000000000000002 109.683 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.68 -20.78 49.29 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.337 -1.505 . . . . 0.089999999999999997 109.337 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.417 HD11 ' SG ' ' A' ' 77' ' ' CYS . 36.5 mm -98.54 112.3 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.306 -1.114 . . . . 0.080000000000000002 108.106 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -90.04 177.31 42.92 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.857 -1.297 . . . . 0.080000000000000002 109.857 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -58.63 -39.92 81.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.471 -1.017 . . . . 0.080000000000000002 109.974 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 72.6 t -65.21 -46.66 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.006 -1.059 . . . . 0.10000000000000001 108.855 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.688 HD11 ' OE1' ' A' ' 73' ' ' GLN . 87.7 mt -67.88 -39.8 83.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.852 . . . . 0.11 109.897 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.28 -33.89 77.64 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.882 -1.687 . . . . 0.080000000000000002 108.882 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -40.4 87.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.472 -1.017 . . . . 0.10000000000000001 110.335 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.41 -44.61 74.64 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.993 -1.067 . . . . 0.13 109.077 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.47 -39.37 93.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.884 -1.135 . . . . 0.10000000000000001 108.036 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -60.0 -42.21 93.75 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.538 -0.726 . . . . 0.11 109.274 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -68.1 -18.66 64.71 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.344 -0.984 . . . . 2.46 108.344 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.82 3.19 53.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.73 -0.606 . . . . 2.8500000000000001 109.787 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.05 7.55 49.79 Favored Glycine 0 N--CA 1.502 3.083 0 O-C-N 121.024 -1.048 . . . . 0.11 111.346 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.632 ' CD2' HG12 ' A' ' 44' ' ' VAL . 91.1 m-85 -106.39 74.29 1.02 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.89 -1.359 . . . . 0.13 109.064 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -80.24 -10.02 59.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.289 -0.882 . . . . 0.089999999999999997 110.629 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -129.26 152.33 48.95 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.172 -0.955 . . . . 0.080000000000000002 109.192 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.98 94.46 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.292 -0.88 . . . . 0.050000000000000003 110.791 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 43' ' ' TYR . 7.0 p90 -60.64 -17.85 49.75 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 120.943 -1.098 . . . . 0.070000000000000007 110.975 -178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.632 HG12 ' CD2' ' A' ' 39' ' ' PHE . 44.8 t -78.95 -32.77 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 N-CA-C 107.29 -1.374 . . . . 0.080000000000000002 107.29 178.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 64.4 t -75.88 -39.86 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.565 -0.902 . . . . 0.070000000000000007 108.565 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -59.88 -35.16 74.24 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 107.046 -1.464 . . . . 0.070000000000000007 107.046 178.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.498 ' O ' HG23 ' A' ' 51' ' ' VAL . . . -58.95 -40.76 95.78 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.614 -1.394 . . . . 0.080000000000000002 109.614 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -59.93 -42.48 94.06 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.265 -1.138 . . . . 1.8999999999999999 108.636 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -60.07 -39.98 87.91 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.11 109.557 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.5 mt -69.47 -37.77 77.43 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 119.62 -0.832 . . . . 0.14000000000000001 108.982 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 47' ' ' GLY . 84.4 t -66.48 -28.61 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.264 -0.897 . . . . 0.19 109.805 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -87.27 13.19 10.14 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.054 -1.029 . . . . 0.17999999999999999 110.581 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 49.93 38.95 17.48 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 120.565 -1.335 . . . . 1.72 110.42 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.7 mttm 56.87 19.43 4.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.143 -0.973 . . . . 0.14000000000000001 110.092 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.465 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 4.1 t0 -66.22 106.72 1.74 Allowed 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 117.766 -1.573 . . . . 0.80000000000000004 106.994 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.05 -40.14 88.37 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.694 -0.629 . . . . 0.16 111.273 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -69.68 -40.02 76.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.287 -1.508 . . . . 0.19 110.006 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 58' ' ' LEU . 87.6 mt -70.62 -40.0 73.41 Favored 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 118.53 -1.268 . . . . 0.23000000000000001 109.178 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -62.87 -49.93 72.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.14000000000000001 110.524 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -63.25 -41.09 99.02 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.051 -1.06 . . . . 0.17999999999999999 109.907 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' OE1' ' NZ ' ' C' ' 37' ' ' LYS . 22.0 mt-10 -65.32 -40.09 93.27 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.649 -1.282 . . . . 2.3900000000000001 108.122 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -64.54 -49.98 69.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.083 -1.011 . . . . 0.51000000000000001 111.239 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 42.2 tp -64.87 -46.14 83.04 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.119 -0.988 . . . . 0.13 109.644 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.28 -49.75 72.85 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.521 -0.737 . . . . 0.17000000000000001 109.944 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 1.7 t0 -66.66 -30.57 70.86 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.492 -0.755 . . . . 1.71 109.642 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.8 m -78.34 -37.66 43.96 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.211 -0.931 . . . . 0.14000000000000001 111.062 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.0 p -127.26 -26.95 3.0 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.548 -1.345 . . . . 0.13 112.243 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.73 13.7 27.08 Favored Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.226 -1.55 . . . . 0.14000000000000001 109.226 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.05 155.53 1.23 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.013 -1.287 . . . . 0.14000000000000001 108.926 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -88.69 166.36 14.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.211 -0.93 . . . . 0.14999999999999999 109.6 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.0 -32.97 62.2 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.332 -0.988 . . . . 0.17000000000000001 108.332 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -70.06 -48.98 55.57 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-O 121.358 0.599 . . . . 0.14999999999999999 112.036 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.688 ' OE1' HD11 ' A' ' 30' ' ' LEU . 44.8 mt-30 -67.9 -29.99 69.22 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.042 -1.036 . . . . 0.13 110.856 -177.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 86.9 p -70.06 -34.67 73.51 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.979 -1.088 . . . . 0.14000000000000001 109.251 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -60.29 -38.86 84.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.846 -1.159 . . . . 0.17999999999999999 109.31 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -66.91 -38.75 86.8 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 120.884 -1.135 . . . . 0.12 109.565 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 26' ' ' ILE . 93.7 m -69.9 -40.07 75.83 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.992 -1.068 . . . . 0.10000000000000001 109.719 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.78 -61.14 2.84 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.746 -1.221 . . . . 0.14000000000000001 109.79 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.88 88.44 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.472 -1.051 . . . . 0.12 110.472 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.3 t -69.4 -48.34 61.39 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 120.7 -1.471 . . . . 0.10000000000000001 109.952 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD21 HD22 ' A' ' 23' ' ' LEU . 83.0 mt -70.13 -40.05 75.06 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.899 -1.126 . . . . 0.089999999999999997 108.822 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -65.56 -40.11 92.43 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.394 -0.816 . . . . 0.14999999999999999 111.015 -178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -70.03 -35.41 74.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.733 -1.23 . . . . 0.14000000000000001 109.281 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.528 ' NE1' ' CD2' ' A' ' 88' ' ' PHE . 87.2 t90 -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.01 -1.478 . . . . 0.089999999999999997 107.01 178.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 89' ' ' LEU . 51.6 m -61.43 -40.18 93.51 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.609 0.719 . . . . 0.089999999999999997 109.902 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.98 -34.44 73.3 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.935 -1.103 . . . . 0.12 110.291 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -93.31 -32.03 14.46 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.109 -0.994 . . . . 0.10000000000000001 110.305 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.528 ' CD2' ' NE1' ' A' ' 84' ' ' TRP . 66.3 m-85 -110.37 -3.08 16.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.496 -0.753 . . . . 0.089999999999999997 112.611 -176.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.661 HD11 ' SD ' ' B' ' 15' ' ' MET . 18.4 tp . . . . . 0 N--CA 1.503 2.212 0 O-C-N 120.727 -1.233 . . . . 0.089999999999999997 109.728 -177.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.634 ' O ' ' N ' ' B' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 106.879 -1.526 . . . . 0.11 106.879 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -55.98 61.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.529 -0.759 . . . . 0.10000000000000001 111.381 -178.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.634 ' N ' ' O ' ' B' ' 1' ' ' MET . 72.6 p -72.72 152.11 41.82 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.31 -0.996 . . . . 0.080000000000000002 108.31 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 4.1 t -71.21 164.39 25.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.991 . . . . 0.059999999999999998 109.708 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -51.7 -21.16 2.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.089999999999999997 109.676 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -61.3 -37.33 82.82 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.27 -0.894 . . . . 0.070000000000000007 109.878 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -60.03 -49.93 75.74 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.048 -1.033 . . . . 0.070000000000000007 110.072 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -70.09 -36.85 75.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.039 . . . . 0.10000000000000001 110.217 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.07 -38.78 82.78 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.74 -0.837 . . . . 0.080000000000000002 108.74 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.68 -49.96 71.11 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.561 -0.712 . . . . 0.059999999999999998 110.09 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.9 10.47 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.146 -0.971 . . . . 0.080000000000000002 110.685 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.66 -14.97 14.88 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.118 -0.989 . . . . 0.10000000000000001 110.182 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.5 151.24 25.05 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.173 -0.955 . . . . 0.10000000000000001 108.74 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -39.99 160.04 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 121.941 1.761 . . . . 0.10000000000000001 112.091 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' MET . . . . . 0.661 ' SD ' HD11 ' A' ' 89' ' ' LEU . 3.8 ptp -89.06 -26.52 21.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.273 -0.892 . . . . 0.080000000000000002 109.441 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.53 -138.25 46.71 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 108.712 -1.755 . . . . 0.10000000000000001 108.712 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -110.6 35.45 3.47 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.332 -1.099 . . . . 0.13 109.632 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -61.73 149.72 84.07 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.358 -0.839 . . . . 0.10000000000000001 109.805 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.58 152.21 78.97 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.714 2.276 . . . . 0.11 112.736 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.477 HG13 ' N ' ' B' ' 21' ' ' GLY . 7.5 p -53.88 -42.64 54.14 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 O-C-N 121.616 -0.678 . . . . 0.11 110.342 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLY . . . . . 0.477 ' N ' HG13 ' B' ' 20' ' ' VAL . . . -58.57 -3.29 1.44 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.531 -1.027 . . . . 0.089999999999999997 110.531 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.424 ' H ' ' C ' ' B' ' 20' ' ' VAL . 45.5 t -83.3 -22.64 32.9 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.894 -1.356 . . . . 0.080000000000000002 110.025 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.459 HD22 HD21 ' B' ' 81' ' ' LEU . 73.6 mt -64.3 138.97 58.7 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.011 -1.055 . . . . 0.070000000000000007 109.807 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.18 135.61 55.67 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.865 -0.734 . . . . 0.059999999999999998 109.663 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -21.79 44.25 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.333 -1.507 . . . . 0.080000000000000002 109.333 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.417 HD11 ' SG ' ' B' ' 77' ' ' CYS . 36.2 mm -98.51 113.67 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 N-CA-C 107.844 -1.169 . . . . 0.089999999999999997 107.844 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.73 179.34 39.96 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.779 -1.328 . . . . 0.10000000000000001 109.779 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -58.71 -40.03 82.5 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.498 -1.001 . . . . 0.12 110.18 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.78 -45.77 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 120.99 -1.069 . . . . 0.14000000000000001 109.042 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.704 HD11 ' OE1' ' B' ' 73' ' ' GLN . 86.4 mt -68.81 -39.9 79.83 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.12 109.889 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.59 75.49 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 108.876 -1.69 . . . . 0.12 108.876 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.06 -39.99 86.99 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.61 -0.935 . . . . 0.16 110.241 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' B' ' 37' ' ' ARG . 27.0 mttm -68.85 -44.73 72.78 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 120.902 -1.124 . . . . 0.17000000000000001 109.097 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.9 mt -62.45 -39.51 93.6 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.98 -1.118 . . . . 0.14000000000000001 107.98 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -60.02 -41.88 93.15 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.573 -0.704 . . . . 0.14999999999999999 109.295 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.45 -18.39 64.41 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.498 -0.927 . . . . 2.5699999999999998 108.498 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.596 ' NH1' ' OD2' ' C' ' 9' ' ' ASP . 21.0 mmt180 -89.9 1.61 56.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.664 -0.648 . . . . 2.3100000000000001 109.768 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.49 8.44 43.46 Favored Glycine 0 N--CA 1.502 3.047 0 O-C-N 121.138 -0.977 . . . . 0.14999999999999999 111.28 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' PHE . . . . . 0.626 ' CD2' HG12 ' B' ' 44' ' ' VAL . 97.4 m-85 -107.2 74.16 0.96 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.884 -1.362 . . . . 0.25 108.947 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 p-10 -80.03 -10.42 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.355 -0.841 . . . . 0.14000000000000001 110.768 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -129.26 150.72 50.51 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.174 -0.954 . . . . 0.13 109.103 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.88 -43.23 99.34 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.195 -0.941 . . . . 0.089999999999999997 110.747 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' TYR . . . . . 0.466 ' C ' ' CD1' ' B' ' 43' ' ' TYR . 6.2 p90 -57.0 -18.28 13.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.902 -1.124 . . . . 0.12 110.75 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' VAL . . . . . 0.626 HG12 ' CD2' ' B' ' 39' ' ' PHE . 41.6 t -78.44 -33.97 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 N-CA-C 107.286 -1.375 . . . . 0.11 107.286 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 64.1 t -75.37 -39.62 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 108.727 -0.842 . . . . 0.089999999999999997 108.727 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.84 -34.3 72.92 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.837 -1.542 . . . . 0.070000000000000007 106.837 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.7 96.34 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 109.535 -1.426 . . . . 0.070000000000000007 109.535 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' GLN . . . . . 0.579 ' NE2' ' CE2' ' B' ' 62' ' ' TRP . 7.3 mm100 -59.99 -42.69 94.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.224 -1.162 . . . . 1.6799999999999999 108.916 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.96 -40.25 88.39 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.446 -0.784 . . . . 0.070000000000000007 109.672 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 83.1 mt -69.13 -38.13 78.68 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.878 -0.786 . . . . 0.070000000000000007 108.878 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 52.9 t -66.05 -29.27 46.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.3 -0.875 . . . . 0.11 109.702 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.3 mt -87.13 14.52 7.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.981 -1.075 . . . . 0.14000000000000001 110.707 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 49.98 35.51 9.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.555 -1.341 . . . . 1.8400000000000001 110.916 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 20.1 mttm 60.03 19.88 9.03 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.229 -0.919 . . . . 0.089999999999999997 109.875 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ASP . . . . . 0.495 ' C ' ' OD1' ' B' ' 55' ' ' ASP . 2.7 t0 -66.9 108.97 2.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 106.644 -1.613 . . . . 0.66000000000000003 106.644 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.79 -40.05 93.83 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.392 -0.818 . . . . 0.12 111.237 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -69.28 -40.1 77.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.356 -1.465 . . . . 0.14999999999999999 109.983 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.436 ' N ' ' OD1' ' B' ' 55' ' ' ASP . 84.0 mt -70.68 -38.85 73.78 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 118.922 -1.111 . . . . 0.23000000000000001 109.2 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -64.52 -50.0 69.07 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.857 . . . . 0.11 110.441 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -63.11 -41.63 99.39 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.031 -1.043 . . . . 0.14000000000000001 109.865 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' B' ' 65' ' ' ASP . 11.1 tt0 -65.09 -40.21 94.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.656 -1.277 . . . . 2.5699999999999998 108.04 179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' TRP . . . . . 0.579 ' CE2' ' NE2' ' B' ' 48' ' ' GLN . 31.7 t90 -64.26 -49.09 73.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 0.81999999999999995 111.166 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -66.03 -48.34 71.44 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 120.941 -1.099 . . . . 0.13 109.739 -179.228 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.88 -49.8 76.0 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.524 -0.735 . . . . 0.16 110.173 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' B' ' 61' ' ' GLU . 10.9 t0 -67.58 -28.16 67.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.494 -0.754 . . . . 1.75 109.826 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' B' ' 62' ' ' TRP . 91.3 m -80.85 -33.66 34.35 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.338 -0.851 . . . . 0.14999999999999999 110.916 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 22.4 p -131.08 -28.52 1.93 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.441 -1.412 . . . . 0.14999999999999999 112.222 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.32 13.14 25.4 Favored Glycine 0 N--CA 1.499 2.865 0 N-CA-C 109.182 -1.567 . . . . 0.14999999999999999 109.182 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.48 154.67 1.75 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.073 -1.251 . . . . 0.14000000000000001 108.731 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -88.51 168.12 12.86 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 120.989 -1.069 . . . . 0.14000000000000001 109.661 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.75 -32.87 63.78 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.318 -0.993 . . . . 0.14000000000000001 108.318 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -69.97 -49.42 51.89 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.377 0.608 . . . . 0.12 112.096 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' GLN . . . . . 0.704 ' OE1' HD11 ' B' ' 30' ' ' LEU . 44.3 mt-30 -67.67 -29.94 69.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.927 -1.108 . . . . 0.11 110.903 -177.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 79.7 p -69.92 -34.64 73.74 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 119.081 -1.048 . . . . 0.11 109.163 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -60.78 -38.83 86.63 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.756 -1.215 . . . . 0.14000000000000001 109.532 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -66.81 -39.16 87.63 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.794 -1.192 . . . . 0.080000000000000002 109.616 -178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' B' ' 26' ' ' ILE . 93.2 m -69.42 -39.96 77.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.052 -1.03 . . . . 0.070000000000000007 109.513 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.0 -60.68 3.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.737 -1.227 . . . . 0.089999999999999997 109.777 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.8 -33.92 88.54 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.546 -1.022 . . . . 0.070000000000000007 110.546 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 40.5 t -69.52 -48.4 60.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.762 -1.434 . . . . 0.059999999999999998 109.916 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.459 HD21 HD22 ' B' ' 23' ' ' LEU . 83.6 mt -69.96 -40.05 75.65 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 118.954 -1.098 . . . . 0.059999999999999998 108.53 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -66.83 -40.15 87.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.346 -0.846 . . . . 0.089999999999999997 111.413 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -69.87 -34.91 74.21 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.638 -1.289 . . . . 0.089999999999999997 108.819 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' TRP . . . . . 0.544 ' O ' ' HB2' ' B' ' 88' ' ' PHE . 85.4 t90 -59.41 -48.69 80.67 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 105.679 -1.971 . . . . 0.050000000000000003 105.679 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' CYS . . . . . 0.66 ' O ' ' N ' ' B' ' 89' ' ' LEU . 36.9 m -58.0 -39.96 79.57 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.762 -0.586 . . . . 0.050000000000000003 110.359 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.22 -35.25 76.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.233 -1.542 . . . . 0.080000000000000002 111.187 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -90.06 -25.52 20.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.87 -1.143 . . . . 0.080000000000000002 107.956 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.544 ' HB2' ' O ' ' B' ' 84' ' ' TRP . 60.5 m-85 -115.15 -2.98 12.61 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 114.759 1.392 . . . . 0.080000000000000002 114.759 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.687 HD11 ' SD ' ' A' ' 15' ' ' MET . 14.5 tp . . . . . 0 C--N 1.282 -2.35 0 O-C-N 119.008 -2.307 . . . . 0.059999999999999998 110.047 -176.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' HIS . . . . . 0.703 ' N ' ' ND1' ' C' ' 1' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 121.756 0.788 . . . . 0.28000000000000003 109.261 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' C' ' 5' ' ' ALA . 22.7 m-20 -74.33 146.81 42.79 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.625 -0.88 . . . . 0.23999999999999999 108.625 177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ASN . . . . . 0.468 ' C ' ' O ' ' C' ' 2' ' ' ASP . 1.3 m-20 -42.2 -52.08 4.5 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.22 108.695 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -74.16 -17.74 60.88 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.212 -0.93 . . . . 0.23000000000000001 109.844 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' C' ' 2' ' ' ASP . . . -72.93 -20.87 60.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.709 -1.244 . . . . 0.23999999999999999 109.933 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -79.78 -8.0 59.0 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.515 -1.366 . . . . 0.23999999999999999 109.571 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.89 141.78 40.41 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 108.609 -0.886 . . . . 0.23999999999999999 108.609 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.4 t -83.46 157.96 22.24 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.332 -0.855 . . . . 0.23999999999999999 109.635 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 9' ' ' ASP . . . . . 0.617 ' N ' ' OD1' ' C' ' 9' ' ' ASP . 0.1 OUTLIER -50.55 -44.83 56.67 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.013 -1.054 . . . . 2.1400000000000001 110.618 -178.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -61.59 -43.14 99.42 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.066 -1.022 . . . . 0.23999999999999999 109.788 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 11' ' ' GLU . . . . . 0.576 ' O ' HG22 ' C' ' 14' ' ' THR . 26.6 mt-10 -71.07 -36.17 72.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.197 -0.939 . . . . 0.22 109.941 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.44 -43.47 94.18 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 120.08 -1.637 . . . . 0.23999999999999999 109.293 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.3 m -61.24 -44.88 96.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.575 -0.703 . . . . 0.28999999999999998 110.413 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' THR . . . . . 0.576 HG22 ' O ' ' C' ' 11' ' ' GLU . 6.2 t -63.89 -30.79 71.84 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.859 -1.151 . . . . 0.22 109.456 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 56.3 mt -68.55 -45.3 72.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.056 -1.027 . . . . 0.20999999999999999 110.928 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.88 -37.97 84.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 107.854 -1.165 . . . . 0.23000000000000001 107.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' C' ' 17' ' ' ARG . 0.0 OUTLIER -61.48 -47.4 85.81 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.374 0.607 . . . . 3.4700000000000002 109.822 -179.602 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -52.92 -39.85 63.13 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.122 -0.986 . . . . 0.20000000000000001 109.701 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -89.23 3.01 53.43 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.579 -1.248 . . . . 0.20000000000000001 109.805 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 58.83 46.43 14.02 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.356 -0.84 . . . . 0.22 109.198 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ILE . . . . . . . . . . . . . 53.4 mt -103.43 115.41 63.8 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.23000000000000001 109.036 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -54.65 138.81 76.2 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.115 1.876 . . . . 0.34000000000000002 112.135 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -156.98 162.35 39.59 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.204 -0.998 . . . . 0.26000000000000001 111.235 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.62 -147.72 10.81 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.942 -1.663 . . . . 0.28000000000000003 108.942 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -65.92 137.48 49.12 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.068 1.845 . . . . 0.39000000000000001 111.99 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' VAL . . . . . 0.576 HG13 ' O ' ' C' ' 26' ' ' VAL . 8.3 p -96.35 119.31 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.167 -0.958 . . . . 0.34000000000000002 109.278 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 27' ' ' VAL . . . . . 0.603 ' O ' ' N ' ' C' ' 31' ' ' ARG . 20.0 t -143.29 148.2 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.473 -0.936 . . . . 0.34999999999999998 108.473 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 28' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' C' ' 27' ' ' VAL . . . -43.15 -35.31 2.43 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.915 -1.274 . . . . 0.28999999999999998 109.915 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -35.64 80.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.097 -1.237 . . . . 1.21 110.673 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -120.68 2.41 10.62 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.36 -0.838 . . . . 0.29999999999999999 109.371 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' C' ' 27' ' ' VAL . 2.2 ttm180 -59.96 -43.15 95.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.235 -0.915 . . . . 0.27000000000000002 109.104 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -58.43 -45.25 88.87 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.229 -0.988 . . . . 0.27000000000000002 110.002 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 53.0 tp -57.74 -38.44 75.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.315 -0.995 . . . . 0.40000000000000002 108.315 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 34' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -68.38 -38.3 81.25 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.283 -0.886 . . . . 0.27000000000000002 110.656 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -63.05 -38.08 89.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.25 109.061 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -68.21 -39.03 82.5 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.253 -0.905 . . . . 2.0699999999999998 109.855 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 37' ' ' LYS . . . . . 0.668 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 14.4 mttt -61.58 -43.55 98.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.386 -0.821 . . . . 1.9299999999999999 110.51 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.94 -36.51 77.35 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 O-C-N 121.025 -1.047 . . . . 0.22 109.086 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 39' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -61.87 -45.18 94.88 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.899 -0.721 . . . . 0.20999999999999999 109.577 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -61.79 -42.31 98.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.068 -1.02 . . . . 0.22 110.42 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -68.68 -54.25 17.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.708 -1.245 . . . . 0.20000000000000001 109.475 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -55.7 -33.56 64.29 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 109.205 -0.665 . . . . 0.19 109.205 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -61.55 -44.14 97.59 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.964 -1.085 . . . . 0.19 108.37 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -56.52 -49.84 73.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 118.601 -1.239 . . . . 0.19 109.707 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -59.1 -30.58 68.2 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.066 -1.021 . . . . 0.17000000000000001 108.578 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 46' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -73.76 -19.67 60.71 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 118.916 -1.114 . . . . 0.17999999999999999 109.382 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 120.919 -1.113 . . . . 0.17999999999999999 108.958 179.216 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.629 ' O ' ' N ' ' A' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 106.833 -1.543 . . . . 0.16 106.833 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -56.32 61.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.609 -0.723 . . . . 0.14999999999999999 111.348 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.629 ' N ' ' O ' ' A' ' 1' ' ' MET . 72.6 p -72.5 152.09 42.11 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 108.277 -1.009 . . . . 0.13 108.277 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -71.2 164.44 25.65 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.065 -1.022 . . . . 0.11 109.797 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -51.79 -20.95 2.44 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.666 . . . . 0.13 109.663 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -61.61 -37.26 83.3 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.332 -0.855 . . . . 0.089999999999999997 109.897 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.95 -50.09 75.13 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.947 -1.096 . . . . 0.12 110.029 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -69.97 -36.8 75.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.974 -1.078 . . . . 0.14999999999999999 110.178 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.42 -37.39 80.25 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.833 -0.803 . . . . 0.11 108.833 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -64.74 -49.61 70.13 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.515 -0.741 . . . . 0.089999999999999997 110.14 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -83.33 8.75 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.099 -1.001 . . . . 0.11 110.678 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -104.48 -13.45 16.04 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.214 -0.929 . . . . 0.11 110.145 179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -154.86 152.09 24.75 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.13 -0.981 . . . . 0.11 108.861 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -39.99 159.98 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.919 1.746 . . . . 0.089999999999999997 112.087 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.687 ' SD ' HD11 ' B' ' 89' ' ' LEU . 3.2 ptp -89.19 -28.09 20.23 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.188 -0.945 . . . . 0.059999999999999998 109.769 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.08 -141.06 43.97 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 108.762 -1.735 . . . . 0.059999999999999998 108.762 -178.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -108.14 33.6 4.04 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.301 -1.117 . . . . 0.080000000000000002 109.782 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -59.94 148.97 75.43 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.418 -0.801 . . . . 0.080000000000000002 109.57 -178.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -62.83 152.13 80.42 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.747 2.298 . . . . 0.059999999999999998 112.868 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 21' ' ' GLY . 7.7 p -53.67 -43.02 53.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 CA-C-O 121.401 0.62 . . . . 0.059999999999999998 110.22 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.493 ' N ' HG13 ' A' ' 20' ' ' VAL . . . -57.51 -3.9 1.16 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 110.375 -1.09 . . . . 0.059999999999999998 110.375 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' VAL . 42.1 t -84.08 -22.61 31.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.94 -1.329 . . . . 0.059999999999999998 110.132 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.468 HD22 HD21 ' A' ' 81' ' ' LEU . 74.9 mt -64.02 138.52 58.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.006 -1.059 . . . . 0.059999999999999998 109.883 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.64 134.41 54.23 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.718 0.771 . . . . 0.080000000000000002 109.683 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.68 -20.78 49.29 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.337 -1.505 . . . . 0.089999999999999997 109.337 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.417 HD11 ' SG ' ' A' ' 77' ' ' CYS . 36.5 mm -98.54 112.3 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.306 -1.114 . . . . 0.080000000000000002 108.106 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -90.04 177.31 42.92 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.857 -1.297 . . . . 0.080000000000000002 109.857 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -58.63 -39.92 81.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.471 -1.017 . . . . 0.080000000000000002 109.974 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 72.6 t -65.21 -46.66 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.006 -1.059 . . . . 0.10000000000000001 108.855 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.688 HD11 ' OE1' ' A' ' 73' ' ' GLN . 87.7 mt -67.88 -39.8 83.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.852 . . . . 0.11 109.897 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.28 -33.89 77.64 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.882 -1.687 . . . . 0.080000000000000002 108.882 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -40.4 87.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.472 -1.017 . . . . 0.10000000000000001 110.335 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.41 -44.61 74.64 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.993 -1.067 . . . . 0.13 109.077 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.47 -39.37 93.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.884 -1.135 . . . . 0.10000000000000001 108.036 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -60.0 -42.21 93.75 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.538 -0.726 . . . . 0.11 109.274 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -68.1 -18.66 64.71 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.344 -0.984 . . . . 2.46 108.344 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.82 3.19 53.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.73 -0.606 . . . . 2.8500000000000001 109.787 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.05 7.55 49.79 Favored Glycine 0 N--CA 1.502 3.083 0 O-C-N 121.024 -1.048 . . . . 0.11 111.346 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.632 ' CD2' HG12 ' A' ' 44' ' ' VAL . 91.1 m-85 -106.39 74.29 1.02 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.89 -1.359 . . . . 0.13 109.064 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -80.24 -10.02 59.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.289 -0.882 . . . . 0.089999999999999997 110.629 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -129.26 152.33 48.95 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.172 -0.955 . . . . 0.080000000000000002 109.192 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.98 94.46 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.292 -0.88 . . . . 0.050000000000000003 110.791 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 43' ' ' TYR . 7.0 p90 -60.64 -17.85 49.75 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 120.943 -1.098 . . . . 0.070000000000000007 110.975 -178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.632 HG12 ' CD2' ' A' ' 39' ' ' PHE . 44.8 t -78.95 -32.77 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 N-CA-C 107.29 -1.374 . . . . 0.080000000000000002 107.29 178.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 64.4 t -75.88 -39.86 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.565 -0.902 . . . . 0.070000000000000007 108.565 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -59.88 -35.16 74.24 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 107.046 -1.464 . . . . 0.070000000000000007 107.046 178.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.498 ' O ' HG23 ' A' ' 51' ' ' VAL . . . -58.95 -40.76 95.78 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.614 -1.394 . . . . 0.080000000000000002 109.614 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -59.93 -42.48 94.06 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.265 -1.138 . . . . 1.8999999999999999 108.636 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -60.07 -39.98 87.91 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.11 109.557 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.5 mt -69.47 -37.77 77.43 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 119.62 -0.832 . . . . 0.14000000000000001 108.982 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 47' ' ' GLY . 84.4 t -66.48 -28.61 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.264 -0.897 . . . . 0.19 109.805 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -87.27 13.19 10.14 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.054 -1.029 . . . . 0.17999999999999999 110.581 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 49.93 38.95 17.48 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 120.565 -1.335 . . . . 1.72 110.42 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.7 mttm 56.87 19.43 4.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.143 -0.973 . . . . 0.14000000000000001 110.092 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.465 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 4.1 t0 -66.22 106.72 1.74 Allowed 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 117.766 -1.573 . . . . 0.80000000000000004 106.994 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.05 -40.14 88.37 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.694 -0.629 . . . . 0.16 111.273 -178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -69.68 -40.02 76.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.287 -1.508 . . . . 0.19 110.006 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 58' ' ' LEU . 87.6 mt -70.62 -40.0 73.41 Favored 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 118.53 -1.268 . . . . 0.23000000000000001 109.178 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -62.87 -49.93 72.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.14000000000000001 110.524 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -63.25 -41.09 99.02 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.051 -1.06 . . . . 0.17999999999999999 109.907 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' OE1' ' NZ ' ' C' ' 37' ' ' LYS . 22.0 mt-10 -65.32 -40.09 93.27 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.649 -1.282 . . . . 2.3900000000000001 108.122 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -64.54 -49.98 69.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.083 -1.011 . . . . 0.51000000000000001 111.239 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 42.2 tp -64.87 -46.14 83.04 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.119 -0.988 . . . . 0.13 109.644 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.28 -49.75 72.85 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.521 -0.737 . . . . 0.17000000000000001 109.944 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 1.7 t0 -66.66 -30.57 70.86 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.492 -0.755 . . . . 1.71 109.642 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.8 m -78.34 -37.66 43.96 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.211 -0.931 . . . . 0.14000000000000001 111.062 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.0 p -127.26 -26.95 3.0 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.548 -1.345 . . . . 0.13 112.243 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.73 13.7 27.08 Favored Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.226 -1.55 . . . . 0.14000000000000001 109.226 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.05 155.53 1.23 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.013 -1.287 . . . . 0.14000000000000001 108.926 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -88.69 166.36 14.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.211 -0.93 . . . . 0.14999999999999999 109.6 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.0 -32.97 62.2 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.332 -0.988 . . . . 0.17000000000000001 108.332 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -70.06 -48.98 55.57 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-O 121.358 0.599 . . . . 0.14999999999999999 112.036 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.688 ' OE1' HD11 ' A' ' 30' ' ' LEU . 44.8 mt-30 -67.9 -29.99 69.22 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.042 -1.036 . . . . 0.13 110.856 -177.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 86.9 p -70.06 -34.67 73.51 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.979 -1.088 . . . . 0.14000000000000001 109.251 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -60.29 -38.86 84.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.846 -1.159 . . . . 0.17999999999999999 109.31 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -66.91 -38.75 86.8 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 120.884 -1.135 . . . . 0.12 109.565 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 26' ' ' ILE . 93.7 m -69.9 -40.07 75.83 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.992 -1.068 . . . . 0.10000000000000001 109.719 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.78 -61.14 2.84 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.746 -1.221 . . . . 0.14000000000000001 109.79 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.88 88.44 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.472 -1.051 . . . . 0.12 110.472 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.3 t -69.4 -48.34 61.39 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 120.7 -1.471 . . . . 0.10000000000000001 109.952 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD21 HD22 ' A' ' 23' ' ' LEU . 83.0 mt -70.13 -40.05 75.06 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.899 -1.126 . . . . 0.089999999999999997 108.822 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -65.56 -40.11 92.43 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.394 -0.816 . . . . 0.14999999999999999 111.015 -178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -70.03 -35.41 74.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.733 -1.23 . . . . 0.14000000000000001 109.281 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.528 ' NE1' ' CD2' ' A' ' 88' ' ' PHE . 87.2 t90 -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.01 -1.478 . . . . 0.089999999999999997 107.01 178.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 89' ' ' LEU . 51.6 m -61.43 -40.18 93.51 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.609 0.719 . . . . 0.089999999999999997 109.902 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.98 -34.44 73.3 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.935 -1.103 . . . . 0.12 110.291 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -93.31 -32.03 14.46 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.109 -0.994 . . . . 0.10000000000000001 110.305 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.528 ' CD2' ' NE1' ' A' ' 84' ' ' TRP . 66.3 m-85 -110.37 -3.08 16.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.496 -0.753 . . . . 0.089999999999999997 112.611 -176.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.661 HD11 ' SD ' ' B' ' 15' ' ' MET . 18.4 tp . . . . . 0 N--CA 1.503 2.212 0 O-C-N 120.727 -1.233 . . . . 0.089999999999999997 109.728 -177.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.634 ' O ' ' N ' ' B' ' 3' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 106.879 -1.526 . . . . 0.11 106.879 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -55.98 61.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.529 -0.759 . . . . 0.10000000000000001 111.381 -178.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.634 ' N ' ' O ' ' B' ' 1' ' ' MET . 72.6 p -72.72 152.11 41.82 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.31 -0.996 . . . . 0.080000000000000002 108.31 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 4.1 t -71.21 164.39 25.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.991 . . . . 0.059999999999999998 109.708 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -51.7 -21.16 2.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.089999999999999997 109.676 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -61.3 -37.33 82.82 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.27 -0.894 . . . . 0.070000000000000007 109.878 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -60.03 -49.93 75.74 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.048 -1.033 . . . . 0.070000000000000007 110.072 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -70.09 -36.85 75.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.039 . . . . 0.10000000000000001 110.217 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.07 -38.78 82.78 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.74 -0.837 . . . . 0.080000000000000002 108.74 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.68 -49.96 71.11 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.561 -0.712 . . . . 0.059999999999999998 110.09 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.9 10.47 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.146 -0.971 . . . . 0.080000000000000002 110.685 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.66 -14.97 14.88 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.118 -0.989 . . . . 0.10000000000000001 110.182 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.5 151.24 25.05 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.173 -0.955 . . . . 0.10000000000000001 108.74 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -39.99 160.04 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 121.941 1.761 . . . . 0.10000000000000001 112.091 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' MET . . . . . 0.661 ' SD ' HD11 ' A' ' 89' ' ' LEU . 3.8 ptp -89.06 -26.52 21.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.273 -0.892 . . . . 0.080000000000000002 109.441 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.53 -138.25 46.71 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 108.712 -1.755 . . . . 0.10000000000000001 108.712 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -110.6 35.45 3.47 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.332 -1.099 . . . . 0.13 109.632 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -61.73 149.72 84.07 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.358 -0.839 . . . . 0.10000000000000001 109.805 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.58 152.21 78.97 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.714 2.276 . . . . 0.11 112.736 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.477 HG13 ' N ' ' B' ' 21' ' ' GLY . 7.5 p -53.88 -42.64 54.14 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 O-C-N 121.616 -0.678 . . . . 0.11 110.342 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . 0.477 ' N ' HG13 ' B' ' 20' ' ' VAL . . . -58.57 -3.29 1.44 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.531 -1.027 . . . . 0.089999999999999997 110.531 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.424 ' H ' ' C ' ' B' ' 20' ' ' VAL . 45.5 t -83.3 -22.64 32.9 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.894 -1.356 . . . . 0.080000000000000002 110.025 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.459 HD22 HD21 ' B' ' 81' ' ' LEU . 73.6 mt -64.3 138.97 58.7 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.011 -1.055 . . . . 0.070000000000000007 109.807 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.18 135.61 55.67 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.865 -0.734 . . . . 0.059999999999999998 109.663 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -21.79 44.25 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.333 -1.507 . . . . 0.080000000000000002 109.333 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.417 HD11 ' SG ' ' B' ' 77' ' ' CYS . 36.2 mm -98.51 113.67 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 N-CA-C 107.844 -1.169 . . . . 0.089999999999999997 107.844 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.73 179.34 39.96 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.779 -1.328 . . . . 0.10000000000000001 109.779 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -58.71 -40.03 82.5 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.498 -1.001 . . . . 0.12 110.18 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.78 -45.77 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 120.99 -1.069 . . . . 0.14000000000000001 109.042 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.704 HD11 ' OE1' ' B' ' 73' ' ' GLN . 86.4 mt -68.81 -39.9 79.83 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.12 109.889 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.59 75.49 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 108.876 -1.69 . . . . 0.12 108.876 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.06 -39.99 86.99 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.61 -0.935 . . . . 0.16 110.241 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' B' ' 37' ' ' ARG . 27.0 mttm -68.85 -44.73 72.78 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 120.902 -1.124 . . . . 0.17000000000000001 109.097 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.9 mt -62.45 -39.51 93.6 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.98 -1.118 . . . . 0.14000000000000001 107.98 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -60.02 -41.88 93.15 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.573 -0.704 . . . . 0.14999999999999999 109.295 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.45 -18.39 64.41 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.498 -0.927 . . . . 2.5699999999999998 108.498 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.596 ' NH1' ' OD2' ' C' ' 9' ' ' ASP . 21.0 mmt180 -89.9 1.61 56.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.664 -0.648 . . . . 2.3100000000000001 109.768 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.49 8.44 43.46 Favored Glycine 0 N--CA 1.502 3.047 0 O-C-N 121.138 -0.977 . . . . 0.14999999999999999 111.28 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' PHE . . . . . 0.626 ' CD2' HG12 ' B' ' 44' ' ' VAL . 97.4 m-85 -107.2 74.16 0.96 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.884 -1.362 . . . . 0.25 108.947 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 p-10 -80.03 -10.42 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.355 -0.841 . . . . 0.14000000000000001 110.768 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -129.26 150.72 50.51 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.174 -0.954 . . . . 0.13 109.103 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.88 -43.23 99.34 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.195 -0.941 . . . . 0.089999999999999997 110.747 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' TYR . . . . . 0.466 ' C ' ' CD1' ' B' ' 43' ' ' TYR . 6.2 p90 -57.0 -18.28 13.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.902 -1.124 . . . . 0.12 110.75 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . 0.626 HG12 ' CD2' ' B' ' 39' ' ' PHE . 41.6 t -78.44 -33.97 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 N-CA-C 107.286 -1.375 . . . . 0.11 107.286 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 64.1 t -75.37 -39.62 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 108.727 -0.842 . . . . 0.089999999999999997 108.727 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.84 -34.3 72.92 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.837 -1.542 . . . . 0.070000000000000007 106.837 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.7 96.34 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 109.535 -1.426 . . . . 0.070000000000000007 109.535 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' GLN . . . . . 0.485 ' CB ' ' CH2' ' B' ' 62' ' ' TRP . 34.5 mm-40 -59.99 -42.69 94.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.224 -1.162 . . . . 1.6799999999999999 108.916 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.96 -40.25 88.39 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.446 -0.784 . . . . 0.070000000000000007 109.672 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 83.1 mt -69.13 -38.13 78.68 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.878 -0.786 . . . . 0.070000000000000007 108.878 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 52.9 t -66.05 -29.27 46.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.3 -0.875 . . . . 0.11 109.702 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.3 mt -87.13 14.52 7.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.981 -1.075 . . . . 0.14000000000000001 110.707 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 49.98 35.51 9.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.555 -1.341 . . . . 1.8400000000000001 110.916 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 20.1 mttm 60.03 19.88 9.03 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.229 -0.919 . . . . 0.089999999999999997 109.875 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ASP . . . . . 0.495 ' C ' ' OD1' ' B' ' 55' ' ' ASP . 2.7 t0 -66.9 108.97 2.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 106.644 -1.613 . . . . 0.66000000000000003 106.644 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.79 -40.05 93.83 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.392 -0.818 . . . . 0.12 111.237 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -69.28 -40.1 77.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.356 -1.465 . . . . 0.14999999999999999 109.983 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.436 ' N ' ' OD1' ' B' ' 55' ' ' ASP . 84.0 mt -70.68 -38.85 73.78 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 118.922 -1.111 . . . . 0.23000000000000001 109.2 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -64.52 -50.0 69.07 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.857 . . . . 0.11 110.441 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -63.11 -41.63 99.39 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.031 -1.043 . . . . 0.14000000000000001 109.865 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' B' ' 65' ' ' ASP . 11.1 tt0 -65.09 -40.21 94.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.656 -1.277 . . . . 2.5699999999999998 108.04 179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' TRP . . . . . 0.485 ' CH2' ' CB ' ' B' ' 48' ' ' GLN . 31.7 t90 -64.26 -49.09 73.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 0.81999999999999995 111.166 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -66.03 -48.34 71.44 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 120.941 -1.099 . . . . 0.13 109.739 -179.228 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.88 -49.8 76.0 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.524 -0.735 . . . . 0.16 110.173 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' B' ' 61' ' ' GLU . 10.9 t0 -67.58 -28.16 67.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.494 -0.754 . . . . 1.75 109.826 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' B' ' 62' ' ' TRP . 91.3 m -80.85 -33.66 34.35 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.338 -0.851 . . . . 0.14999999999999999 110.916 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 22.4 p -131.08 -28.52 1.93 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.441 -1.412 . . . . 0.14999999999999999 112.222 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.32 13.14 25.4 Favored Glycine 0 N--CA 1.499 2.865 0 N-CA-C 109.182 -1.567 . . . . 0.14999999999999999 109.182 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.48 154.67 1.75 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.073 -1.251 . . . . 0.14000000000000001 108.731 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -88.51 168.12 12.86 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 120.989 -1.069 . . . . 0.14000000000000001 109.661 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.75 -32.87 63.78 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.318 -0.993 . . . . 0.14000000000000001 108.318 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -69.97 -49.42 51.89 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.377 0.608 . . . . 0.12 112.096 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . 0.704 ' OE1' HD11 ' B' ' 30' ' ' LEU . 44.3 mt-30 -67.67 -29.94 69.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.927 -1.108 . . . . 0.11 110.903 -177.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 79.7 p -69.92 -34.64 73.74 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 119.081 -1.048 . . . . 0.11 109.163 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -60.78 -38.83 86.63 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.756 -1.215 . . . . 0.14000000000000001 109.532 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -66.81 -39.16 87.63 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.794 -1.192 . . . . 0.080000000000000002 109.616 -178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' B' ' 26' ' ' ILE . 93.2 m -69.42 -39.96 77.57 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.052 -1.03 . . . . 0.070000000000000007 109.513 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.0 -60.68 3.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.737 -1.227 . . . . 0.089999999999999997 109.777 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.8 -33.92 88.54 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.546 -1.022 . . . . 0.070000000000000007 110.546 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 40.5 t -69.52 -48.4 60.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.762 -1.434 . . . . 0.059999999999999998 109.916 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.459 HD21 HD22 ' B' ' 23' ' ' LEU . 83.6 mt -69.96 -40.05 75.65 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 118.954 -1.098 . . . . 0.059999999999999998 108.53 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -66.83 -40.15 87.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.346 -0.846 . . . . 0.089999999999999997 111.413 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -69.87 -34.91 74.21 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.638 -1.289 . . . . 0.089999999999999997 108.819 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' TRP . . . . . 0.544 ' O ' ' HB2' ' B' ' 88' ' ' PHE . 85.4 t90 -59.41 -48.69 80.67 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 105.679 -1.971 . . . . 0.050000000000000003 105.679 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' CYS . . . . . 0.66 ' O ' ' N ' ' B' ' 89' ' ' LEU . 36.9 m -58.0 -39.96 79.57 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.762 -0.586 . . . . 0.050000000000000003 110.359 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.22 -35.25 76.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.233 -1.542 . . . . 0.080000000000000002 111.187 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -90.06 -25.52 20.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.87 -1.143 . . . . 0.080000000000000002 107.956 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.544 ' HB2' ' O ' ' B' ' 84' ' ' TRP . 60.5 m-85 -115.15 -2.98 12.61 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 114.759 1.392 . . . . 0.080000000000000002 114.759 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.687 HD11 ' SD ' ' A' ' 15' ' ' MET . 14.5 tp . . . . . 0 C--N 1.282 -2.35 0 O-C-N 119.008 -2.307 . . . . 0.059999999999999998 110.047 -176.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' HIS . . . . . 0.703 ' N ' ' ND1' ' C' ' 1' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 121.756 0.788 . . . . 0.28000000000000003 109.261 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' C' ' 5' ' ' ALA . 22.7 m-20 -74.33 146.81 42.79 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.625 -0.88 . . . . 0.23999999999999999 108.625 177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ASN . . . . . 0.468 ' C ' ' O ' ' C' ' 2' ' ' ASP . 1.3 m-20 -42.2 -52.08 4.5 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.22 108.695 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -74.16 -17.74 60.88 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.212 -0.93 . . . . 0.23000000000000001 109.844 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' C' ' 2' ' ' ASP . . . -72.93 -20.87 60.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.709 -1.244 . . . . 0.23999999999999999 109.933 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -79.78 -8.0 59.0 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.515 -1.366 . . . . 0.23999999999999999 109.571 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.89 141.78 40.41 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 108.609 -0.886 . . . . 0.23999999999999999 108.609 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.4 t -83.46 157.96 22.24 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.332 -0.855 . . . . 0.23999999999999999 109.635 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' ASP . . . . . 0.617 ' N ' ' OD1' ' C' ' 9' ' ' ASP . 0.1 OUTLIER -50.55 -44.83 56.67 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.013 -1.054 . . . . 2.1400000000000001 110.618 -178.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -61.59 -43.14 99.42 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.066 -1.022 . . . . 0.23999999999999999 109.788 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' GLU . . . . . 0.576 ' O ' HG22 ' C' ' 14' ' ' THR . 26.6 mt-10 -71.07 -36.17 72.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.197 -0.939 . . . . 0.22 109.941 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.44 -43.47 94.18 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 120.08 -1.637 . . . . 0.23999999999999999 109.293 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.3 m -61.24 -44.88 96.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.575 -0.703 . . . . 0.28999999999999998 110.413 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' THR . . . . . 0.576 HG22 ' O ' ' C' ' 11' ' ' GLU . 6.2 t -63.89 -30.79 71.84 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.859 -1.151 . . . . 0.22 109.456 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 56.3 mt -68.55 -45.3 72.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.056 -1.027 . . . . 0.20999999999999999 110.928 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.88 -37.97 84.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 107.854 -1.165 . . . . 0.23000000000000001 107.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' C' ' 17' ' ' ARG . 0.0 OUTLIER -61.48 -47.4 85.81 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.374 0.607 . . . . 3.4700000000000002 109.822 -179.602 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -52.92 -39.85 63.13 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.122 -0.986 . . . . 0.20000000000000001 109.701 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -89.23 3.01 53.43 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.579 -1.248 . . . . 0.20000000000000001 109.805 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 6.3 m120 58.83 46.43 14.02 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.356 -0.84 . . . . 0.22 109.198 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ILE . . . . . . . . . . . . . 53.4 mt -103.43 115.41 63.8 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.23000000000000001 109.036 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -54.65 138.81 76.2 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.115 1.876 . . . . 0.34000000000000002 112.135 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -156.98 162.35 39.59 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.204 -0.998 . . . . 0.26000000000000001 111.235 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.62 -147.72 10.81 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.942 -1.663 . . . . 0.28000000000000003 108.942 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -65.92 137.48 49.12 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.068 1.845 . . . . 0.39000000000000001 111.99 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' VAL . . . . . 0.576 HG13 ' O ' ' C' ' 26' ' ' VAL . 8.3 p -96.35 119.31 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.167 -0.958 . . . . 0.34000000000000002 109.278 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' VAL . . . . . 0.603 ' O ' ' N ' ' C' ' 31' ' ' ARG . 20.0 t -143.29 148.2 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.473 -0.936 . . . . 0.34999999999999998 108.473 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' C' ' 27' ' ' VAL . . . -43.15 -35.31 2.43 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.915 -1.274 . . . . 0.28999999999999998 109.915 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -35.64 80.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.097 -1.237 . . . . 1.21 110.673 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -120.68 2.41 10.62 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.36 -0.838 . . . . 0.29999999999999999 109.371 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' C' ' 27' ' ' VAL . 2.2 ttm180 -59.96 -43.15 95.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.235 -0.915 . . . . 0.27000000000000002 109.104 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -58.43 -45.25 88.87 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.229 -0.988 . . . . 0.27000000000000002 110.002 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 53.0 tp -57.74 -38.44 75.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.315 -0.995 . . . . 0.40000000000000002 108.315 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -68.38 -38.3 81.25 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.283 -0.886 . . . . 0.27000000000000002 110.656 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -63.05 -38.08 89.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.25 109.061 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -68.21 -39.03 82.5 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.253 -0.905 . . . . 2.0699999999999998 109.855 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' LYS . . . . . 0.668 ' NZ ' ' OE1' ' A' ' 61' ' ' GLU . 14.4 mttt -61.58 -43.55 98.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.386 -0.821 . . . . 1.9299999999999999 110.51 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.94 -36.51 77.35 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 O-C-N 121.025 -1.047 . . . . 0.22 109.086 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -61.87 -45.18 94.88 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.899 -0.721 . . . . 0.20999999999999999 109.577 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -61.79 -42.31 98.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.068 -1.02 . . . . 0.22 110.42 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -68.68 -54.25 17.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.708 -1.245 . . . . 0.20000000000000001 109.475 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -55.7 -33.56 64.29 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 109.205 -0.665 . . . . 0.19 109.205 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -61.55 -44.14 97.59 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.964 -1.085 . . . . 0.19 108.37 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -56.52 -49.84 73.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 118.601 -1.239 . . . . 0.19 109.707 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -59.1 -30.58 68.2 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.066 -1.021 . . . . 0.17000000000000001 108.578 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -73.76 -19.67 60.71 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 118.916 -1.114 . . . . 0.17999999999999999 109.382 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 120.919 -1.113 . . . . 0.17999999999999999 108.958 179.216 . . . . . . . . 0 0 . 1 stop_ save_